File: dvb_sp_hf.out

package info (click to toggle)
cclib-data 1.6.2-2
links: PTS, VCS
area: non-free
in suites: bookworm, bullseye, sid
size: 87,912 kB
sloc: python: 16,440; sh: 131; makefile: 79; cpp: 31
file content (3472 lines) | stat: -rw-r--r-- 234,033 bytes
 argument  1 = dvb_sp_hf.nw
                                         
                                         


              Northwest Computational Chemistry Package (NWChem) 6.5
              ------------------------------------------------------


                    Environmental Molecular Sciences Laboratory
                       Pacific Northwest National Laboratory
                                Richland, WA 99352

                              Copyright (c) 1994-2014
                       Pacific Northwest National Laboratory
                            Battelle Memorial Institute

             NWChem is an open-source computational chemistry package
                        distributed under the terms of the
                      Educational Community License (ECL) 2.0
             A copy of the license is included with this distribution
                              in the LICENSE.TXT file

                                  ACKNOWLEDGMENT
                                  --------------

            This software and its documentation were developed at the
            EMSL at Pacific Northwest National Laboratory, a multiprogram
            national laboratory, operated for the U.S. Department of Energy
            by Battelle under Contract Number DE-AC05-76RL01830. Support
            for this work was provided by the Department of Energy Office
            of Biological and Environmental Research, Office of Basic
            Energy Sciences, and the Office of Advanced Scientific Computing.


           Job information
           ---------------

    hostname        = boman
    program         = /usr/lib64/mpich/bin/nwchem_mpich
    date            = Wed Jan 21 23:10:22 2015

    compiled        = Sat_Dec_06_13:02:58_2014
    source          = /builddir/build/BUILD/Nwchem-6.5.revision26243-src.2014-09-10
    nwchem branch   = 6.5
    nwchem revision = 26243
    ga revision     = 10506
    input           = dvb_sp_hf.nw
    prefix          = dvb.
    data base       = ./dvb.db
    status          = startup
    nproc           =        1
    time left       =     -1s



           Memory information
           ------------------

    heap     =   13107194 doubles =    100.0 Mbytes
    stack    =   13107199 doubles =    100.0 Mbytes
    global   =   26214400 doubles =    200.0 Mbytes (distinct from heap & stack)
    total    =   52428793 doubles =    400.0 Mbytes
    verify   = yes
    hardfail = no 


           Directory information
           ---------------------

  0 permanent = .
  0 scratch   = .




                                NWChem Input Module
                                -------------------


                        Divinylbenzene in STO-3G basis set
                        ----------------------------------

 Scaling coordinates for geometry "geometry" by  1.889725989
 (inverse scale =  0.529177249)

 C2H symmetry detected

          ------
          auto-z
          ------


                             Geometry "geometry" -> ""
                             -------------------------

 Output coordinates in angstroms (scale by  1.889725989 to convert to a.u.)

  No.       Tag          Charge          X              Y              Z
 ---- ---------------- ---------- -------------- -------------- --------------
    1 C                    6.0000     0.23680554     1.41416660     0.00000000
    2 C                    6.0000    -0.23680554    -1.41416660     0.00000000
    3 C                    6.0000     1.31675086     0.48901061     0.00000000
    4 C                    6.0000    -1.31675086    -0.48901061     0.00000000
    5 C                    6.0000     1.08679847    -0.89447642     0.00000000
    6 C                    6.0000    -1.08679847     0.89447642     0.00000000
    7 H                    1.0000     2.34780221     0.86863451     0.00000000
    8 H                    1.0000    -2.34780221    -0.86863451     0.00000000
    9 H                    1.0000     1.93764188    -1.58693865     0.00000000
   10 H                    1.0000    -1.93764188     1.58693865     0.00000000
   11 C                    6.0000    -0.53450789    -2.88212824     0.00000000
   12 C                    6.0000     0.53450789     2.88212824     0.00000000
   13 H                    1.0000    -1.60655769    -3.13289308     0.00000000
   14 H                    1.0000     1.60655769     3.13289308     0.00000000
   15 C                    6.0000     0.36419263    -3.88177971     0.00000000
   16 C                    6.0000    -0.36419263     3.88177971     0.00000000
   17 H                    1.0000     1.44522900    -3.70144241     0.00000000
   18 H                    1.0000    -1.44522900     3.70144241     0.00000000
   19 H                    1.0000     0.04815351    -4.93192286     0.00000000
   20 H                    1.0000    -0.04815351     4.93192286     0.00000000

      Atomic Mass 
      ----------- 

      C                 12.000000
      H                  1.007825


 Effective nuclear repulsion energy (a.u.)     445.9370121674

            Nuclear Dipole moment (a.u.) 
            ----------------------------
        X                 Y               Z
 ---------------- ---------------- ----------------
     0.0000000000     0.0000000000     0.0000000000

      Symmetry information
      --------------------

 Group name             C2h       
 Group number             21
 Group order               4
 No. of unique centers    10

      Symmetry unique atoms

     1    3    5    7    9   11   13   15   17   19



                                Z-matrix (autoz)
                                -------- 

 Units are Angstrom for bonds and degrees for angles

      Type          Name      I     J     K     L     M      Value
      ----------- --------  ----- ----- ----- ----- ----- ----------
    1 Stretch                  1     3                       1.42204
    2 Stretch                  1     6                       1.42197
    3 Stretch                  1    12                       1.49784
    4 Stretch                  2     4                       1.42204
    5 Stretch                  2     5                       1.42197
    6 Stretch                  2    11                       1.49784
    7 Stretch                  3     5                       1.40247
    8 Stretch                  3     7                       1.09872
    9 Stretch                  4     6                       1.40247
   10 Stretch                  4     8                       1.09872
   11 Stretch                  5     9                       1.09701
   12 Stretch                  6    10                       1.09701
   13 Stretch                 11    13                       1.10099
   14 Stretch                 11    15                       1.34423
   15 Stretch                 12    14                       1.10099
   16 Stretch                 12    16                       1.34423
   17 Stretch                 15    17                       1.09597
   18 Stretch                 15    19                       1.09667
   19 Stretch                 16    18                       1.09597
   20 Stretch                 16    20                       1.09667
   21 Bend                     1     3     5               121.14867
   22 Bend                     1     3     7               119.20109
   23 Bend                     1     6     4               120.87358
   24 Bend                     1     6    10               119.42285
   25 Bend                     1    12    14               114.62953
   26 Bend                     1    12    16               126.57992
   27 Bend                     2     4     6               121.14867
   28 Bend                     2     4     8               119.20109
   29 Bend                     2     5     3               120.87358
   30 Bend                     2     5     9               119.42285
   31 Bend                     2    11    13               114.62953
   32 Bend                     2    11    15               126.57992
   33 Bend                     3     1     6               117.97776
   34 Bend                     3     1    12               119.12155
   35 Bend                     3     5     9               119.70357
   36 Bend                     4     2     5               117.97776
   37 Bend                     4     2    11               119.12155
   38 Bend                     4     6    10               119.70357
   39 Bend                     5     2    11               122.90069
   40 Bend                     5     3     7               119.65024
   41 Bend                     6     1    12               122.90069
   42 Bend                     6     4     8               119.65024
   43 Bend                    11    15    17               122.48517
   44 Bend                    11    15    19               121.29492
   45 Bend                    12    16    18               122.48517
   46 Bend                    12    16    20               121.29492
   47 Bend                    13    11    15               118.79054
   48 Bend                    14    12    16               118.79054
   49 Bend                    17    15    19               116.21990
   50 Bend                    18    16    20               116.21990
   51 Torsion                  1     3     5     2           0.00000
   52 Torsion                  1     3     5     9         180.00000
   53 Torsion                  1     6     4     2           0.00000
   54 Torsion                  1     6     4     8         180.00000
   55 Torsion                  1    12    16    18           0.00000
   56 Torsion                  1    12    16    20         180.00000
   57 Torsion                  2     4     6    10         180.00000
   58 Torsion                  2     5     3     7         180.00000
   59 Torsion                  2    11    15    17           0.00000
   60 Torsion                  2    11    15    19         180.00000
   61 Torsion                  3     1     6     4           0.00000
   62 Torsion                  3     1     6    10         180.00000
   63 Torsion                  3     1    12    14           0.00000
   64 Torsion                  3     1    12    16         180.00000
   65 Torsion                  3     5     2     4           0.00000
   66 Torsion                  3     5     2    11         180.00000
   67 Torsion                  4     2     5     9         180.00000
   68 Torsion                  4     2    11    13           0.00000
   69 Torsion                  4     2    11    15         180.00000
   70 Torsion                  4     6     1    12         180.00000
   71 Torsion                  5     2     4     6          -0.00000
   72 Torsion                  5     2     4     8         180.00000
   73 Torsion                  5     2    11    13         180.00000
   74 Torsion                  5     2    11    15           0.00000
   75 Torsion                  5     3     1     6           0.00000
   76 Torsion                  5     3     1    12         180.00000
   77 Torsion                  6     1     3     7         180.00000
   78 Torsion                  6     1    12    14         180.00000
   79 Torsion                  6     1    12    16           0.00000
   80 Torsion                  6     4     2    11         180.00000
   81 Torsion                  7     3     1    12          -0.00000
   82 Torsion                  7     3     5     9           0.00000
   83 Torsion                  8     4     2    11          -0.00000
   84 Torsion                  8     4     6    10           0.00000
   85 Torsion                  9     5     2    11           0.00000
   86 Torsion                 10     6     1    12           0.00000
   87 Torsion                 13    11    15    17         180.00000
   88 Torsion                 13    11    15    19          -0.00000
   89 Torsion                 14    12    16    18         180.00000
   90 Torsion                 14    12    16    20          -0.00000


            XYZ format geometry
            -------------------
    20
 geometry
 C                     0.23680554     1.41416660     0.00000000
 C                    -0.23680554    -1.41416660     0.00000000
 C                     1.31675086     0.48901061     0.00000000
 C                    -1.31675086    -0.48901061     0.00000000
 C                     1.08679847    -0.89447642     0.00000000
 C                    -1.08679847     0.89447642     0.00000000
 H                     2.34780221     0.86863451     0.00000000
 H                    -2.34780221    -0.86863451     0.00000000
 H                     1.93764188    -1.58693865     0.00000000
 H                    -1.93764188     1.58693865     0.00000000
 C                    -0.53450789    -2.88212824     0.00000000
 C                     0.53450789     2.88212824     0.00000000
 H                    -1.60655769    -3.13289308     0.00000000
 H                     1.60655769     3.13289308     0.00000000
 C                     0.36419263    -3.88177971     0.00000000
 C                    -0.36419263     3.88177971     0.00000000
 H                     1.44522900    -3.70144241     0.00000000
 H                    -1.44522900     3.70144241     0.00000000
 H                     0.04815351    -4.93192286     0.00000000
 H                    -0.04815351     4.93192286     0.00000000

 ==============================================================================
                                internuclear distances
 ------------------------------------------------------------------------------
       center one      |      center two      | atomic units |  angstroms
 ------------------------------------------------------------------------------
    3 C                |   1 C                |     2.68726  |     1.42204
    4 C                |   2 C                |     2.68726  |     1.42204
    5 C                |   2 C                |     2.68714  |     1.42197
    5 C                |   3 C                |     2.65028  |     1.40247
    6 C                |   1 C                |     2.68714  |     1.42197
    6 C                |   4 C                |     2.65028  |     1.40247
    7 H                |   3 C                |     2.07628  |     1.09872
    8 H                |   4 C                |     2.07628  |     1.09872
    9 H                |   5 C                |     2.07305  |     1.09701
   10 H                |   6 C                |     2.07305  |     1.09701
   11 C                |   2 C                |     2.83052  |     1.49784
   12 C                |   1 C                |     2.83052  |     1.49784
   13 H                |  11 C                |     2.08056  |     1.10099
   14 H                |  12 C                |     2.08056  |     1.10099
   15 C                |  11 C                |     2.54023  |     1.34423
   16 C                |  12 C                |     2.54023  |     1.34423
   17 H                |  15 C                |     2.07109  |     1.09597
   18 H                |  16 C                |     2.07109  |     1.09597
   19 H                |  15 C                |     2.07240  |     1.09667
   20 H                |  16 C                |     2.07240  |     1.09667
 ------------------------------------------------------------------------------
                         number of included internuclear distances:         20
 ==============================================================================



 ==============================================================================
                                 internuclear angles
 ------------------------------------------------------------------------------
        center 1       |       center 2       |       center 3       |  degrees
 ------------------------------------------------------------------------------
    3 C                |   1 C                |   6 C                |   117.98
    3 C                |   1 C                |  12 C                |   119.12
    6 C                |   1 C                |  12 C                |   122.90
    4 C                |   2 C                |   5 C                |   117.98
    4 C                |   2 C                |  11 C                |   119.12
    5 C                |   2 C                |  11 C                |   122.90
    1 C                |   3 C                |   5 C                |   121.15
    1 C                |   3 C                |   7 H                |   119.20
    5 C                |   3 C                |   7 H                |   119.65
    2 C                |   4 C                |   6 C                |   121.15
    2 C                |   4 C                |   8 H                |   119.20
    6 C                |   4 C                |   8 H                |   119.65
    2 C                |   5 C                |   3 C                |   120.87
    2 C                |   5 C                |   9 H                |   119.42
    3 C                |   5 C                |   9 H                |   119.70
    1 C                |   6 C                |   4 C                |   120.87
    1 C                |   6 C                |  10 H                |   119.42
    4 C                |   6 C                |  10 H                |   119.70
    2 C                |  11 C                |  13 H                |   114.63
    2 C                |  11 C                |  15 C                |   126.58
   13 H                |  11 C                |  15 C                |   118.79
    1 C                |  12 C                |  14 H                |   114.63
    1 C                |  12 C                |  16 C                |   126.58
   14 H                |  12 C                |  16 C                |   118.79
   11 C                |  15 C                |  17 H                |   122.49
   11 C                |  15 C                |  19 H                |   121.29
   17 H                |  15 C                |  19 H                |   116.22
   12 C                |  16 C                |  18 H                |   122.49
   12 C                |  16 C                |  20 H                |   121.29
   18 H                |  16 C                |  20 H                |   116.22
 ------------------------------------------------------------------------------
                            number of included internuclear angles:         30
 ==============================================================================



  library name resolved from: environment
  library file name is: </usr/share/nwchem/libraries/>
  


 Summary of "ao basis" -> "" (cartesian)
 ------------------------------------------------------------------------------
       Tag                 Description            Shells   Functions and Types
 ---------------- ------------------------------  ------  ---------------------
 *                           sto-3g                   on all atoms 


                              NWChem Property Module
                              ----------------------


                        Divinylbenzene in STO-3G basis set

                      Basis "ao basis" -> "ao basis" (cartesian)
                      -----
  C (Carbon)
  ----------
            Exponent  Coefficients 
       -------------- ---------------------------------------------------------
  1 S  7.16168370E+01  0.154329
  1 S  1.30450960E+01  0.535328
  1 S  3.53051220E+00  0.444635

  2 S  2.94124940E+00 -0.099967
  2 S  6.83483100E-01  0.399513
  2 S  2.22289900E-01  0.700115

  3 P  2.94124940E+00  0.155916
  3 P  6.83483100E-01  0.607684
  3 P  2.22289900E-01  0.391957

  H (Hydrogen)
  ------------
            Exponent  Coefficients 
       -------------- ---------------------------------------------------------
  1 S  3.42525091E+00  0.154329
  1 S  6.23913730E-01  0.535328
  1 S  1.68855400E-01  0.444635



 Summary of "ao basis" -> "ao basis" (cartesian)
 ------------------------------------------------------------------------------
       Tag                 Description            Shells   Functions and Types
 ---------------- ------------------------------  ------  ---------------------
 C                           sto-3g                  3        5   2s1p
 H                           sto-3g                  1        1   1s


                                 NWChem SCF Module
                                 -----------------


                        Divinylbenzene in STO-3G basis set



  ao basis        = "ao basis"
  functions       =    60
  atoms           =    20
  closed shells   =    35
  open shells     =     0
  charge          =   0.00
  wavefunction    = RHF 
  input vectors   = atomic
  output vectors  = ./dvb.movecs
  use symmetry    = T
  symmetry adapt  = T


 Summary of "ao basis" -> "ao basis" (cartesian)
 ------------------------------------------------------------------------------
       Tag                 Description            Shells   Functions and Types
 ---------------- ------------------------------  ------  ---------------------
 C                           sto-3g                  3        5   2s1p
 H                           sto-3g                  1        1   1s


      Symmetry analysis of basis
      --------------------------

        ag         25
        au          5
        bg          5
        bu         25


 global array: Temp Over[1:60,1:60],  handle: -996 

            1           2           3           4           5           6  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       1.00000     0.24836    -0.00000    -0.00000     0.00000     0.00000
   2       0.24836     1.00000     0.00000    -0.00000     0.00000     0.00030
   3      -0.00000     0.00000     1.00000     0.00000     0.00000    -0.00014
   4      -0.00000    -0.00000     0.00000     1.00000     0.00000    -0.00081
   5       0.00000     0.00000     0.00000     0.00000     1.00000     0.00000
   6       0.00000     0.00030    -0.00014    -0.00081     0.00000     1.00000
   7       0.00030     0.02187    -0.00590    -0.03524     0.00000     0.24836
   8       0.00014     0.00590     0.00661    -0.01021     0.00000     0.00000
   9       0.00081     0.03524    -0.01021    -0.05268     0.00000     0.00000
  10       0.00000     0.00000     0.00000     0.00000     0.00832     0.00000
  11       0.00000     0.03557     0.04482    -0.03839     0.00000     0.00000
  12       0.03557     0.35371     0.28849    -0.24714     0.00000     0.00159
  13      -0.04482    -0.28849    -0.10190     0.26261     0.00000    -0.00235
  14       0.03839     0.24714     0.26261    -0.02032     0.00000    -0.00288
  15       0.00000     0.00000     0.00000     0.00000     0.20465     0.00000
  16       0.00000     0.00159    -0.00235    -0.00288     0.00000     0.00000
  17       0.00159     0.05619    -0.05280    -0.06468     0.00000     0.03557
  18       0.00235     0.05280    -0.03131    -0.06691     0.00000     0.04482
  19       0.00288     0.06468    -0.06691    -0.05866     0.00000    -0.03839
  20       0.00000     0.00000     0.00000     0.00000     0.02331     0.00000
  21       0.00000     0.00157     0.00127    -0.00344     0.00000     0.00000
  22       0.00157     0.05578     0.02866    -0.07785     0.00000     0.03558
  23      -0.00127    -0.02866     0.00691     0.04403     0.00000    -0.05494
  24       0.00344     0.07785     0.04403    -0.09646     0.00000    -0.02157
  25       0.00000     0.00000     0.00000     0.00000     0.02312     0.00000
  26       0.00000     0.03558    -0.05494    -0.02157     0.00000     0.00000
  27       0.03558     0.35374    -0.35362    -0.13884     0.00000     0.00157
  28       0.05494     0.35362    -0.25587    -0.18083     0.00000     0.00127
  29       0.02157     0.13884    -0.18083     0.13368     0.00000    -0.00344
  30       0.00000     0.00000     0.00000     0.00000     0.20467     0.00000
  31       0.00509     0.09301     0.11685    -0.03020     0.00000     0.00008
  32       0.00008     0.00590    -0.00738    -0.00652     0.00000     0.00509
  33       0.00008     0.00588     0.00484    -0.00854     0.00000     0.00508
  34       0.00508     0.09284    -0.12012     0.00954     0.00000     0.00008
  35       0.00000     0.00000    -0.00000    -0.00000     0.00000     0.00000
  36       0.00000     0.00026    -0.00010    -0.00057     0.00000     0.02955
  37       0.00000     0.00010     0.00004    -0.00022     0.00000     0.00980
  38       0.00000     0.00057    -0.00022    -0.00117     0.00000     0.04831
  39       0.00000     0.00000     0.00000     0.00000     0.00008     0.00000
  40       0.00000     0.02955     0.00980     0.04831     0.00000     0.00000
  41       0.02955     0.31761     0.06996     0.34497     0.00000     0.00000
  42      -0.00980    -0.06996     0.15824    -0.09697     0.00000    -0.00000
  43      -0.04831    -0.34497    -0.09697    -0.30023     0.00000    -0.00000
  44       0.00000     0.00000     0.00000     0.00000     0.17791     0.00000
  45       0.00000     0.00008    -0.00007    -0.00016     0.00000     0.00487
  46       0.00487     0.09007     0.07314     0.09177     0.00000     0.00000
  47       0.00000     0.00000     0.00000    -0.00000     0.00000     0.00000
  48       0.00000     0.00001     0.00000    -0.00002     0.00000     0.00116
  49      -0.00000    -0.00000     0.00000     0.00000     0.00000    -0.00066
  50       0.00000     0.00002     0.00000    -0.00005     0.00000     0.00272
  51       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  52       0.00000     0.00116    -0.00066     0.00272     0.00000     0.00000
  53       0.00116     0.04688    -0.01682     0.06907     0.00000     0.00000
  54       0.00066     0.01682     0.01248     0.02713     0.00000     0.00000
  55      -0.00272    -0.06907     0.02713    -0.09229     0.00000    -0.00000
  56       0.00000     0.00000     0.00000     0.00000     0.01908     0.00000
  57       0.00000     0.00002     0.00001    -0.00005     0.00000     0.00074
  58       0.00074     0.02468    -0.02186     0.02972     0.00000     0.00000
  59       0.00000     0.00000    -0.00000    -0.00000     0.00000     0.00006
  60       0.00006     0.00481    -0.00066     0.00811     0.00000     0.00000

            7           8           9          10          11          12  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.00030     0.00014     0.00081     0.00000     0.00000     0.03557
   2       0.02187     0.00590     0.03524     0.00000     0.03557     0.35371
   3      -0.00590     0.00661    -0.01021     0.00000     0.04482     0.28849
   4      -0.03524    -0.01021    -0.05268     0.00000    -0.03839    -0.24714
   5       0.00000     0.00000     0.00000     0.00832     0.00000     0.00000
   6       0.24836     0.00000     0.00000     0.00000     0.00000     0.00159
   7       1.00000    -0.00000     0.00000     0.00000     0.00159     0.05619
   8      -0.00000     1.00000     0.00000     0.00000     0.00235     0.05280
   9       0.00000     0.00000     1.00000     0.00000     0.00288     0.06468
  10       0.00000     0.00000     0.00000     1.00000     0.00000     0.00000
  11       0.00159     0.00235     0.00288     0.00000     1.00000     0.24836
  12       0.05619     0.05280     0.06468     0.00000     0.24836     1.00000
  13      -0.05280    -0.03131    -0.06691     0.00000     0.00000     0.00000
  14      -0.06468    -0.06691    -0.05866     0.00000    -0.00000    -0.00000
  15       0.00000     0.00000     0.00000     0.02331     0.00000     0.00000
  16       0.03557    -0.04482     0.03839     0.00000     0.00000     0.00039
  17       0.35371    -0.28849     0.24714     0.00000     0.00039     0.02519
  18       0.28849    -0.10190     0.26261     0.00000     0.00097     0.03810
  19      -0.24714     0.26261    -0.02032     0.00000     0.00036     0.01415
  20       0.00000     0.00000     0.00000     0.20465     0.00000     0.00000
  21       0.03558     0.05494     0.02157     0.00000     0.00000     0.03729
  22       0.35374     0.35362     0.13884     0.00000     0.03729     0.36341
  23      -0.35362    -0.25587    -0.18083     0.00000     0.01014     0.06345
  24      -0.13884    -0.18083     0.13368     0.00000     0.06099     0.38176
  25       0.00000     0.00000     0.00000     0.20467     0.00000     0.00000
  26       0.00157    -0.00127     0.00344     0.00000     0.00000     0.00170
  27       0.05578    -0.02866     0.07785     0.00000     0.00170     0.05856
  28       0.02866     0.00691     0.04403     0.00000     0.00390     0.08539
  29      -0.07785     0.04403    -0.09646     0.00000    -0.00066    -0.01441
  30       0.00000     0.00000     0.00000     0.02312     0.00000     0.00000
  31       0.00590     0.00738     0.00652     0.00000     0.06102     0.48575
  32       0.09301    -0.11685     0.03020     0.00000     0.00001     0.00175
  33       0.09284     0.12012    -0.00954     0.00000     0.00527     0.09535
  34       0.00588    -0.00484     0.00854     0.00000     0.00008     0.00611
  35       0.02955    -0.00980    -0.04831     0.00000     0.00000     0.00000
  36       0.31761    -0.06996    -0.34497     0.00000     0.00000     0.00144
  37       0.06996     0.15824    -0.09697     0.00000     0.00000     0.00139
  38       0.34497    -0.09697    -0.30023     0.00000     0.00001     0.00253
  39       0.00000     0.00000     0.00000     0.17791     0.00000     0.00000
  40       0.00000     0.00000     0.00000     0.00000     0.00000     0.00126
  41       0.00026     0.00010     0.00057     0.00000     0.00126     0.04921
  42      -0.00010     0.00004    -0.00022     0.00000     0.00094     0.02306
  43      -0.00057    -0.00022    -0.00117     0.00000    -0.00287    -0.07056
  44       0.00000     0.00000     0.00000     0.00008     0.00000     0.00000
  45       0.09007    -0.07314    -0.09177     0.00000     0.00000     0.00019
  46       0.00008     0.00007     0.00016     0.00000     0.00132     0.03624
  47       0.00116     0.00066    -0.00272     0.00000     0.00000     0.00000
  48       0.04688     0.01682    -0.06907     0.00000     0.00000     0.00018
  49      -0.01682     0.01248     0.02713     0.00000     0.00000     0.00009
  50       0.06907     0.02713    -0.09229     0.00000     0.00000     0.00039
  51       0.00000     0.00000     0.00000     0.01908     0.00000     0.00000
  52       0.00000    -0.00000     0.00000     0.00000     0.00000     0.00000
  53       0.00001    -0.00000     0.00002     0.00000     0.00000     0.00174
  54       0.00000     0.00000     0.00000     0.00000     0.00000     0.00152
  55      -0.00002     0.00000    -0.00005     0.00000    -0.00001    -0.00307
  56       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  57       0.02468     0.02186    -0.02972     0.00000     0.00000     0.00078
  58       0.00002    -0.00001     0.00005     0.00000     0.00000     0.00068
  59       0.00481     0.00066    -0.00811     0.00000     0.00000     0.00001
  60       0.00000     0.00000     0.00000     0.00000     0.00000     0.00019

           13          14          15          16          17          18  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.04482     0.03839     0.00000     0.00000     0.00159     0.00235
   2      -0.28849     0.24714     0.00000     0.00159     0.05619     0.05280
   3      -0.10190     0.26261     0.00000    -0.00235    -0.05280    -0.03131
   4       0.26261    -0.02032     0.00000    -0.00288    -0.06468    -0.06691
   5       0.00000     0.00000     0.20465     0.00000     0.00000     0.00000
   6      -0.00235    -0.00288     0.00000     0.00000     0.03557     0.04482
   7      -0.05280    -0.06468     0.00000     0.03557     0.35371     0.28849
   8      -0.03131    -0.06691     0.00000    -0.04482    -0.28849    -0.10190
   9      -0.06691    -0.05866     0.00000     0.03839     0.24714     0.26261
  10       0.00000     0.00000     0.02331     0.00000     0.00000     0.00000
  11       0.00000    -0.00000     0.00000     0.00000     0.00039     0.00097
  12       0.00000    -0.00000     0.00000     0.00039     0.02519     0.03810
  13       1.00000     0.00000     0.00000    -0.00097    -0.03810    -0.05238
  14       0.00000     1.00000     0.00000    -0.00036    -0.01415    -0.02305
  15       0.00000     0.00000     1.00000     0.00000     0.00000     0.00000
  16      -0.00097    -0.00036     0.00000     1.00000     0.24836    -0.00000
  17      -0.03810    -0.01415     0.00000     0.24836     1.00000    -0.00000
  18      -0.05238    -0.02305     0.00000    -0.00000    -0.00000     1.00000
  19      -0.02305     0.00113     0.00000     0.00000     0.00000     0.00000
  20       0.00000     0.00000     0.00969     0.00000     0.00000     0.00000
  21      -0.01014    -0.06099     0.00000     0.00000     0.00170     0.00390
  22      -0.06345    -0.38176     0.00000     0.00170     0.05856     0.08539
  23       0.19756    -0.08733     0.00000    -0.00390    -0.08539    -0.11288
  24      -0.08733    -0.31332     0.00000     0.00066     0.01441     0.02316
  25       0.00000     0.00000     0.21207     0.00000     0.00000     0.00000
  26      -0.00390     0.00066     0.00000     0.00000     0.03729     0.01014
  27      -0.08539     0.01441     0.00000     0.03729     0.36341     0.06345
  28      -0.11288     0.02316     0.00000    -0.01014    -0.06345     0.19756
  29       0.02316     0.02049     0.00000    -0.06099    -0.38176    -0.08733
  30       0.00000     0.00000     0.02440     0.00000     0.00000     0.00000
  31       0.43567     0.16041     0.00000     0.00001     0.00175     0.00297
  32      -0.00297    -0.00110     0.00000     0.06102     0.48575    -0.43567
  33       0.03534    -0.11815     0.00000     0.00008     0.00611     0.00963
  34      -0.00963     0.00325     0.00000     0.00527     0.09535    -0.03534
  35      -0.00000    -0.00001     0.00000     0.00000     0.00126     0.00094
  36      -0.00139    -0.00253     0.00000     0.00126     0.04921     0.02306
  37      -0.00089    -0.00250     0.00000    -0.00094    -0.02306     0.00828
  38      -0.00250    -0.00407     0.00000     0.00287     0.07056     0.03624
  39       0.00000     0.00000     0.00048     0.00000     0.00000     0.00000
  40      -0.00094     0.00287     0.00000     0.00000     0.00000     0.00000
  41      -0.02306     0.07056     0.00000     0.00000     0.00144     0.00139
  42       0.00828     0.03624     0.00000    -0.00000    -0.00139    -0.00089
  43       0.03624    -0.09075     0.00000    -0.00001    -0.00253    -0.00250
  44       0.00000     0.00000     0.02013     0.00000     0.00000     0.00000
  45      -0.00024    -0.00030     0.00000     0.00132     0.03624    -0.00570
  46       0.00570     0.05196     0.00000     0.00000     0.00019     0.00024
  47      -0.00000    -0.00000     0.00000     0.00000     0.00000     0.00000
  48      -0.00009    -0.00039     0.00000     0.00000     0.00174     0.00152
  49       0.00002    -0.00019     0.00000    -0.00000    -0.00152    -0.00079
  50      -0.00019    -0.00082     0.00000     0.00001     0.00307     0.00277
  51       0.00000     0.00000     0.00006     0.00000     0.00000     0.00000
  52      -0.00000     0.00001     0.00000     0.00000     0.00000     0.00000
  53      -0.00152     0.00307     0.00000     0.00000     0.00018     0.00009
  54      -0.00079     0.00277     0.00000    -0.00000    -0.00009     0.00002
  55       0.00277    -0.00501     0.00000    -0.00000    -0.00039    -0.00019
  56       0.00000     0.00000     0.00058     0.00000     0.00000     0.00000
  57       0.00005    -0.00148     0.00000     0.00000     0.00068     0.00085
  58      -0.00085     0.00099     0.00000     0.00000     0.00078    -0.00005
  59      -0.00000    -0.00002     0.00000     0.00000     0.00019     0.00012
  60      -0.00012     0.00038     0.00000     0.00000     0.00001     0.00000

           19          20          21          22          23          24  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.00288     0.00000     0.00000     0.00157    -0.00127     0.00344
   2       0.06468     0.00000     0.00157     0.05578    -0.02866     0.07785
   3      -0.06691     0.00000     0.00127     0.02866     0.00691     0.04403
   4      -0.05866     0.00000    -0.00344    -0.07785     0.04403    -0.09646
   5       0.00000     0.02331     0.00000     0.00000     0.00000     0.00000
   6      -0.03839     0.00000     0.00000     0.03558    -0.05494    -0.02157
   7      -0.24714     0.00000     0.03558     0.35374    -0.35362    -0.13884
   8       0.26261     0.00000     0.05494     0.35362    -0.25587    -0.18083
   9      -0.02032     0.00000     0.02157     0.13884    -0.18083     0.13368
  10       0.00000     0.20465     0.00000     0.00000     0.00000     0.00000
  11       0.00036     0.00000     0.00000     0.03729     0.01014     0.06099
  12       0.01415     0.00000     0.03729     0.36341     0.06345     0.38176
  13      -0.02305     0.00000    -0.01014    -0.06345     0.19756    -0.08733
  14       0.00113     0.00000    -0.06099    -0.38176    -0.08733    -0.31332
  15       0.00000     0.00969     0.00000     0.00000     0.00000     0.00000
  16       0.00000     0.00000     0.00000     0.00170    -0.00390     0.00066
  17       0.00000     0.00000     0.00170     0.05856    -0.08539     0.01441
  18       0.00000     0.00000     0.00390     0.08539    -0.11288     0.02316
  19       1.00000     0.00000    -0.00066    -0.01441     0.02316     0.02049
  20       0.00000     1.00000     0.00000     0.00000     0.00000     0.00000
  21      -0.00066     0.00000     1.00000     0.24836    -0.00000    -0.00000
  22      -0.01441     0.00000     0.24836     1.00000     0.00000    -0.00000
  23       0.02316     0.00000    -0.00000     0.00000     1.00000     0.00000
  24       0.02049     0.00000    -0.00000    -0.00000     0.00000     1.00000
  25       0.00000     0.02440     0.00000     0.00000     0.00000     0.00000
  26       0.06099     0.00000     0.00000     0.00038    -0.00078     0.00065
  27       0.38176     0.00000     0.00038     0.02484    -0.03098     0.02550
  28      -0.08733     0.00000     0.00078     0.03098    -0.03207     0.03425
  29      -0.31332     0.00000    -0.00065    -0.02550     0.03425    -0.01864
  30       0.00000     0.21207     0.00000     0.00000     0.00000     0.00000
  31       0.00110     0.00000     0.00526     0.09520     0.07165     0.10018
  32      -0.16041     0.00000     0.00008     0.00611    -0.01016     0.00008
  33      -0.00325     0.00000     0.06126     0.48673     0.36054    -0.29343
  34       0.11815     0.00000     0.00001     0.00173    -0.00242     0.00199
  35      -0.00287     0.00000     0.00000     0.00105    -0.00162    -0.00199
  36      -0.07056     0.00000     0.00105     0.04432    -0.04274    -0.05240
  37       0.03624     0.00000     0.00162     0.04274    -0.02709    -0.05521
  38      -0.09075     0.00000     0.00199     0.05240    -0.05521    -0.04974
  39       0.00000     0.02013     0.00000     0.00000     0.00000     0.00000
  40       0.00001     0.00000     0.00000     0.00000    -0.00000     0.00001
  41       0.00253     0.00000     0.00000     0.00158    -0.00045     0.00311
  42      -0.00250     0.00000     0.00000     0.00045     0.00039     0.00092
  43      -0.00407     0.00000    -0.00001    -0.00311     0.00092    -0.00575
  44       0.00000     0.00048     0.00000     0.00000     0.00000     0.00000
  45      -0.05196     0.00000     0.00006     0.00515    -0.00667    -0.00554
  46       0.00030     0.00000     0.00001     0.00114     0.00027     0.00210
  47      -0.00001     0.00000     0.00000     0.00012    -0.00008    -0.00034
  48      -0.00307     0.00000     0.00012     0.01305    -0.00524    -0.02165
  49       0.00277     0.00000     0.00008     0.00524     0.00255    -0.00924
  50      -0.00501     0.00000     0.00034     0.02165    -0.00924    -0.03340
  51       0.00000     0.00058     0.00000     0.00000     0.00000     0.00000
  52       0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  53       0.00039     0.00000     0.00000     0.00002    -0.00002     0.00006
  54      -0.00019     0.00000     0.00000     0.00002    -0.00001     0.00004
  55      -0.00082     0.00000    -0.00000    -0.00006     0.00004    -0.00014
  56       0.00000     0.00006     0.00000     0.00000     0.00000     0.00000
  57      -0.00099     0.00000     0.00076     0.02519     0.00476    -0.03729
  58       0.00148     0.00000     0.00000     0.00002    -0.00003     0.00005
  59      -0.00038     0.00000     0.00000     0.00083    -0.00039    -0.00153
  60       0.00002     0.00000     0.00000     0.00000    -0.00000     0.00000

           25          26          27          28          29          30  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.00000     0.00000     0.03558     0.05494     0.02157     0.00000
   2       0.00000     0.03558     0.35374     0.35362     0.13884     0.00000
   3       0.00000    -0.05494    -0.35362    -0.25587    -0.18083     0.00000
   4       0.00000    -0.02157    -0.13884    -0.18083     0.13368     0.00000
   5       0.02312     0.00000     0.00000     0.00000     0.00000     0.20467
   6       0.00000     0.00000     0.00157     0.00127    -0.00344     0.00000
   7       0.00000     0.00157     0.05578     0.02866    -0.07785     0.00000
   8       0.00000    -0.00127    -0.02866     0.00691     0.04403     0.00000
   9       0.00000     0.00344     0.07785     0.04403    -0.09646     0.00000
  10       0.20467     0.00000     0.00000     0.00000     0.00000     0.02312
  11       0.00000     0.00000     0.00170     0.00390    -0.00066     0.00000
  12       0.00000     0.00170     0.05856     0.08539    -0.01441     0.00000
  13       0.00000    -0.00390    -0.08539    -0.11288     0.02316     0.00000
  14       0.00000     0.00066     0.01441     0.02316     0.02049     0.00000
  15       0.21207     0.00000     0.00000     0.00000     0.00000     0.02440
  16       0.00000     0.00000     0.03729    -0.01014    -0.06099     0.00000
  17       0.00000     0.03729     0.36341    -0.06345    -0.38176     0.00000
  18       0.00000     0.01014     0.06345     0.19756    -0.08733     0.00000
  19       0.00000     0.06099     0.38176    -0.08733    -0.31332     0.00000
  20       0.02440     0.00000     0.00000     0.00000     0.00000     0.21207
  21       0.00000     0.00000     0.00038     0.00078    -0.00065     0.00000
  22       0.00000     0.00038     0.02484     0.03098    -0.02550     0.00000
  23       0.00000    -0.00078    -0.03098    -0.03207     0.03425     0.00000
  24       0.00000     0.00065     0.02550     0.03425    -0.01864     0.00000
  25       1.00000     0.00000     0.00000     0.00000     0.00000     0.00954
  26       0.00000     1.00000     0.24836     0.00000     0.00000     0.00000
  27       0.00000     0.24836     1.00000     0.00000     0.00000     0.00000
  28       0.00000     0.00000     0.00000     1.00000     0.00000     0.00000
  29       0.00000     0.00000     0.00000     0.00000     1.00000     0.00000
  30       0.00954     0.00000     0.00000     0.00000     0.00000     1.00000
  31       0.00000     0.00008     0.00611     0.01016    -0.00008     0.00000
  32       0.00000     0.00526     0.09520    -0.07165    -0.10018     0.00000
  33       0.00000     0.00001     0.00173     0.00242    -0.00199     0.00000
  34       0.00000     0.06126     0.48673    -0.36054     0.29343     0.00000
  35       0.00000     0.00000     0.00000     0.00000    -0.00001     0.00000
  36       0.00000     0.00000     0.00158     0.00045    -0.00311     0.00000
  37       0.00000    -0.00000    -0.00045     0.00039     0.00092     0.00000
  38       0.00000     0.00001     0.00311     0.00092    -0.00575     0.00000
  39       0.01794     0.00000     0.00000     0.00000     0.00000     0.00053
  40       0.00000     0.00000     0.00105     0.00162     0.00199     0.00000
  41       0.00000     0.00105     0.04432     0.04274     0.05240     0.00000
  42       0.00000    -0.00162    -0.04274    -0.02709    -0.05521     0.00000
  43       0.00000    -0.00199    -0.05240    -0.05521    -0.04974     0.00000
  44       0.00053     0.00000     0.00000     0.00000     0.00000     0.01794
  45       0.00000     0.00001     0.00114    -0.00027    -0.00210     0.00000
  46       0.00000     0.00006     0.00515     0.00667     0.00554     0.00000
  47       0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  48       0.00000     0.00000     0.00002     0.00002    -0.00006     0.00000
  49       0.00000    -0.00000    -0.00002    -0.00001     0.00004     0.00000
  50       0.00000     0.00000     0.00006     0.00004    -0.00014     0.00000
  51       0.00478     0.00000     0.00000     0.00000     0.00000     0.00001
  52       0.00000     0.00000     0.00012     0.00008     0.00034     0.00000
  53       0.00000     0.00012     0.01305     0.00524     0.02165     0.00000
  54       0.00000    -0.00008    -0.00524     0.00255    -0.00924     0.00000
  55       0.00000    -0.00034    -0.02165    -0.00924    -0.03340     0.00000
  56       0.00001     0.00000     0.00000     0.00000     0.00000     0.00478
  57       0.00000     0.00000     0.00002     0.00003    -0.00005     0.00000
  58       0.00000     0.00076     0.02519    -0.00476     0.03729     0.00000
  59       0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  60       0.00000     0.00000     0.00083     0.00039     0.00153     0.00000

           31          32          33          34          35          36  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.00509     0.00008     0.00008     0.00508     0.00000     0.00000
   2       0.09301     0.00590     0.00588     0.09284     0.00000     0.00026
   3       0.11685    -0.00738     0.00484    -0.12012    -0.00000    -0.00010
   4      -0.03020    -0.00652    -0.00854     0.00954    -0.00000    -0.00057
   5       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
   6       0.00008     0.00509     0.00508     0.00008     0.00000     0.02955
   7       0.00590     0.09301     0.09284     0.00588     0.02955     0.31761
   8       0.00738    -0.11685     0.12012    -0.00484    -0.00980    -0.06996
   9       0.00652     0.03020    -0.00954     0.00854    -0.04831    -0.34497
  10       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  11       0.06102     0.00001     0.00527     0.00008     0.00000     0.00000
  12       0.48575     0.00175     0.09535     0.00611     0.00000     0.00144
  13       0.43567    -0.00297     0.03534    -0.00963    -0.00000    -0.00139
  14       0.16041    -0.00110    -0.11815     0.00325    -0.00001    -0.00253
  15       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  16       0.00001     0.06102     0.00008     0.00527     0.00000     0.00126
  17       0.00175     0.48575     0.00611     0.09535     0.00126     0.04921
  18       0.00297    -0.43567     0.00963    -0.03534     0.00094     0.02306
  19       0.00110    -0.16041    -0.00325     0.11815    -0.00287    -0.07056
  20       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  21       0.00526     0.00008     0.06126     0.00001     0.00000     0.00105
  22       0.09520     0.00611     0.48673     0.00173     0.00105     0.04432
  23       0.07165    -0.01016     0.36054    -0.00242    -0.00162    -0.04274
  24       0.10018     0.00008    -0.29343     0.00199    -0.00199    -0.05240
  25       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  26       0.00008     0.00526     0.00001     0.06126     0.00000     0.00000
  27       0.00611     0.09520     0.00173     0.48673     0.00000     0.00158
  28       0.01016    -0.07165     0.00242    -0.36054     0.00000     0.00045
  29      -0.00008    -0.10018    -0.00199     0.29343    -0.00001    -0.00311
  30       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  31       1.00000     0.00011     0.05049     0.00071     0.00000     0.00015
  32       0.00011     1.00000     0.00071     0.05049     0.00113     0.03262
  33       0.05049     0.00071     1.00000     0.00010     0.00087     0.02741
  34       0.00071     0.05049     0.00010     1.00000     0.00000     0.00017
  35       0.00000     0.00113     0.00087     0.00000     1.00000     0.24836
  36       0.00015     0.03262     0.02741     0.00017     0.24836     1.00000
  37       0.00019    -0.03181     0.03596    -0.00011    -0.00000    -0.00000
  38       0.00024     0.03532     0.01884     0.00034    -0.00000    -0.00000
  39       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  40       0.00113     0.00000     0.00000     0.00087     0.00000     0.00000
  41       0.03262     0.00015     0.00017     0.02741     0.00000     0.00000
  42       0.03181    -0.00019     0.00011    -0.03596    -0.00000    -0.00000
  43      -0.03532    -0.00024    -0.00034    -0.01884    -0.00000    -0.00000
  44       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  45       0.00001     0.06153     0.00248     0.00024     0.06070     0.48445
  46       0.06153     0.00001     0.00024     0.00248     0.00000     0.00000
  47       0.00000     0.00001     0.00089     0.00000     0.00000     0.04284
  48       0.00004     0.00116     0.02792     0.00000     0.04284     0.39315
  49       0.00003    -0.00144     0.02334    -0.00000    -0.04749    -0.27266
  50       0.00007     0.00160     0.03404     0.00000     0.05283     0.30328
  51       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  52       0.00001     0.00000     0.00000     0.00089     0.00000     0.00000
  53       0.00116     0.00004     0.00000     0.02792     0.00000     0.00000
  54       0.00144    -0.00003     0.00000    -0.02334    -0.00000    -0.00000
  55      -0.00160    -0.00007    -0.00000    -0.03404    -0.00000    -0.00000
  56       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  57       0.00030     0.00024     0.08944     0.00000     0.00561     0.09966
  58       0.00024     0.00030     0.00000     0.08944     0.00000     0.00000
  59       0.00000     0.00025     0.00264     0.00000     0.00577     0.10177
  60       0.00025     0.00000     0.00000     0.00264     0.00000     0.00000

           37          38          39          40          41          42  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.00000     0.00000     0.00000     0.00000     0.02955    -0.00980
   2       0.00010     0.00057     0.00000     0.02955     0.31761    -0.06996
   3       0.00004    -0.00022     0.00000     0.00980     0.06996     0.15824
   4      -0.00022    -0.00117     0.00000     0.04831     0.34497    -0.09697
   5       0.00000     0.00000     0.00008     0.00000     0.00000     0.00000
   6       0.00980     0.04831     0.00000     0.00000     0.00000    -0.00000
   7       0.06996     0.34497     0.00000     0.00000     0.00026    -0.00010
   8       0.15824    -0.09697     0.00000     0.00000     0.00010     0.00004
   9      -0.09697    -0.30023     0.00000     0.00000     0.00057    -0.00022
  10       0.00000     0.00000     0.17791     0.00000     0.00000     0.00000
  11       0.00000     0.00001     0.00000     0.00000     0.00126     0.00094
  12       0.00139     0.00253     0.00000     0.00126     0.04921     0.02306
  13      -0.00089    -0.00250     0.00000    -0.00094    -0.02306     0.00828
  14      -0.00250    -0.00407     0.00000     0.00287     0.07056     0.03624
  15       0.00000     0.00000     0.00048     0.00000     0.00000     0.00000
  16      -0.00094     0.00287     0.00000     0.00000     0.00000    -0.00000
  17      -0.02306     0.07056     0.00000     0.00000     0.00144    -0.00139
  18       0.00828     0.03624     0.00000     0.00000     0.00139    -0.00089
  19       0.03624    -0.09075     0.00000     0.00001     0.00253    -0.00250
  20       0.00000     0.00000     0.02013     0.00000     0.00000     0.00000
  21       0.00162     0.00199     0.00000     0.00000     0.00000     0.00000
  22       0.04274     0.05240     0.00000     0.00000     0.00158     0.00045
  23      -0.02709    -0.05521     0.00000    -0.00000    -0.00045     0.00039
  24      -0.05521    -0.04974     0.00000     0.00001     0.00311     0.00092
  25       0.00000     0.00000     0.01794     0.00000     0.00000     0.00000
  26      -0.00000     0.00001     0.00000     0.00000     0.00105    -0.00162
  27      -0.00045     0.00311     0.00000     0.00105     0.04432    -0.04274
  28       0.00039     0.00092     0.00000     0.00162     0.04274    -0.02709
  29       0.00092    -0.00575     0.00000     0.00199     0.05240    -0.05521
  30       0.00000     0.00000     0.00053     0.00000     0.00000     0.00000
  31       0.00019     0.00024     0.00000     0.00113     0.03262     0.03181
  32      -0.03181     0.03532     0.00000     0.00000     0.00015    -0.00019
  33       0.03596     0.01884     0.00000     0.00000     0.00017     0.00011
  34      -0.00011     0.00034     0.00000     0.00087     0.02741    -0.03596
  35      -0.00000    -0.00000     0.00000     0.00000     0.00000    -0.00000
  36      -0.00000    -0.00000     0.00000     0.00000     0.00000    -0.00000
  37       1.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  38       0.00000     1.00000     0.00000     0.00000     0.00000    -0.00000
  39       0.00000     0.00000     1.00000     0.00000     0.00000     0.00000
  40       0.00000     0.00000     0.00000     1.00000     0.24836     0.00000
  41       0.00000     0.00000     0.00000     0.24836     1.00000     0.00000
  42       0.00000    -0.00000     0.00000     0.00000     0.00000     1.00000
  43      -0.00000    -0.00000     0.00000     0.00000     0.00000     0.00000
  44       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  45      -0.45129    -0.10556     0.00000     0.00000     0.00000    -0.00000
  46       0.00000     0.00000     0.00000     0.06070     0.48445     0.45129
  47       0.04749    -0.05283     0.00000     0.00000     0.00000    -0.00000
  48       0.27266    -0.30328     0.00000     0.00000     0.00000    -0.00000
  49      -0.01650     0.28029     0.00000     0.00000     0.00000     0.00000
  50       0.28029    -0.07629     0.00000     0.00000     0.00000    -0.00000
  51       0.00000     0.00000     0.23549     0.00000     0.00000     0.00000
  52       0.00000     0.00000     0.00000     0.00000     0.04284    -0.04749
  53       0.00000     0.00000     0.00000     0.04284     0.39315    -0.27266
  54       0.00000    -0.00000     0.00000     0.04749     0.27266    -0.01650
  55      -0.00000    -0.00000     0.00000    -0.05283    -0.30328     0.28029
  56       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  57       0.11842    -0.04901     0.00000     0.00000     0.00000     0.00000
  58      -0.00000     0.00000     0.00000     0.00561     0.09966    -0.11842
  59       0.03569    -0.12555     0.00000     0.00000     0.00000    -0.00000
  60       0.00000     0.00000     0.00000     0.00577     0.10177    -0.03569

           43          44          45          46          47          48  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.04831     0.00000     0.00000     0.00487     0.00000     0.00000
   2      -0.34497     0.00000     0.00008     0.09007     0.00000     0.00001
   3      -0.09697     0.00000    -0.00007     0.07314     0.00000     0.00000
   4      -0.30023     0.00000    -0.00016     0.09177    -0.00000    -0.00002
   5       0.00000     0.17791     0.00000     0.00000     0.00000     0.00000
   6      -0.00000     0.00000     0.00487     0.00000     0.00000     0.00116
   7      -0.00057     0.00000     0.09007     0.00008     0.00116     0.04688
   8      -0.00022     0.00000    -0.07314     0.00007     0.00066     0.01682
   9      -0.00117     0.00000    -0.09177     0.00016    -0.00272    -0.06907
  10       0.00000     0.00008     0.00000     0.00000     0.00000     0.00000
  11      -0.00287     0.00000     0.00000     0.00132     0.00000     0.00000
  12      -0.07056     0.00000     0.00019     0.03624     0.00000     0.00018
  13       0.03624     0.00000    -0.00024     0.00570    -0.00000    -0.00009
  14      -0.09075     0.00000    -0.00030     0.05196    -0.00000    -0.00039
  15       0.00000     0.02013     0.00000     0.00000     0.00000     0.00000
  16      -0.00001     0.00000     0.00132     0.00000     0.00000     0.00000
  17      -0.00253     0.00000     0.03624     0.00019     0.00000     0.00174
  18      -0.00250     0.00000    -0.00570     0.00024     0.00000     0.00152
  19      -0.00407     0.00000    -0.05196     0.00030    -0.00001    -0.00307
  20       0.00000     0.00048     0.00000     0.00000     0.00000     0.00000
  21      -0.00001     0.00000     0.00006     0.00001     0.00000     0.00012
  22      -0.00311     0.00000     0.00515     0.00114     0.00012     0.01305
  23       0.00092     0.00000    -0.00667     0.00027    -0.00008    -0.00524
  24      -0.00575     0.00000    -0.00554     0.00210    -0.00034    -0.02165
  25       0.00000     0.00053     0.00000     0.00000     0.00000     0.00000
  26      -0.00199     0.00000     0.00001     0.00006     0.00000     0.00000
  27      -0.05240     0.00000     0.00114     0.00515     0.00000     0.00002
  28      -0.05521     0.00000    -0.00027     0.00667     0.00000     0.00002
  29      -0.04974     0.00000    -0.00210     0.00554    -0.00000    -0.00006
  30       0.00000     0.01794     0.00000     0.00000     0.00000     0.00000
  31      -0.03532     0.00000     0.00001     0.06153     0.00000     0.00004
  32      -0.00024     0.00000     0.06153     0.00001     0.00001     0.00116
  33      -0.00034     0.00000     0.00248     0.00024     0.00089     0.02792
  34      -0.01884     0.00000     0.00024     0.00248     0.00000     0.00000
  35      -0.00000     0.00000     0.06070     0.00000     0.00000     0.04284
  36      -0.00000     0.00000     0.48445     0.00000     0.04284     0.39315
  37      -0.00000     0.00000    -0.45129     0.00000     0.04749     0.27266
  38      -0.00000     0.00000    -0.10556     0.00000    -0.05283    -0.30328
  39       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  40       0.00000     0.00000     0.00000     0.06070     0.00000     0.00000
  41       0.00000     0.00000     0.00000     0.48445     0.00000     0.00000
  42       0.00000     0.00000    -0.00000     0.45129    -0.00000    -0.00000
  43       1.00000     0.00000    -0.00000     0.10556    -0.00000    -0.00000
  44       0.00000     1.00000     0.00000     0.00000     0.00000     0.00000
  45      -0.00000     0.00000     1.00000     0.00000     0.00611     0.10604
  46       0.10556     0.00000     0.00000     1.00000     0.00000     0.00000
  47      -0.00000     0.00000     0.00611     0.00000     1.00000     0.24836
  48      -0.00000     0.00000     0.10604     0.00000     0.24836     1.00000
  49      -0.00000     0.00000    -0.12645     0.00000    -0.00000     0.00000
  50      -0.00000     0.00000     0.04805     0.00000    -0.00000    -0.00000
  51       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  52       0.05283     0.00000     0.00000     0.00611     0.00000     0.00000
  53       0.30328     0.00000     0.00000     0.10604     0.00000     0.00000
  54       0.28029     0.00000    -0.00000     0.12645     0.00000     0.00000
  55      -0.07629     0.00000    -0.00000    -0.04805     0.00000    -0.00000
  56       0.00000     0.23549     0.00000     0.00000     0.00000     0.00000
  57      -0.00000     0.00000     0.01462     0.00000     0.06141     0.48732
  58       0.04901     0.00000     0.00000     0.01462     0.00000     0.00000
  59      -0.00000     0.00000     0.05493     0.00000     0.06131     0.48692
  60       0.12555     0.00000     0.00000     0.05493     0.00000     0.00000

           49          50          51          52          53          54  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.00000     0.00000     0.00000     0.00000     0.00116     0.00066
   2      -0.00000     0.00002     0.00000     0.00116     0.04688     0.01682
   3       0.00000     0.00000     0.00000    -0.00066    -0.01682     0.01248
   4       0.00000    -0.00005     0.00000     0.00272     0.06907     0.02713
   5       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
   6      -0.00066     0.00272     0.00000     0.00000     0.00000     0.00000
   7      -0.01682     0.06907     0.00000     0.00000     0.00001     0.00000
   8       0.01248     0.02713     0.00000    -0.00000    -0.00000     0.00000
   9       0.02713    -0.09229     0.00000     0.00000     0.00002     0.00000
  10       0.00000     0.00000     0.01908     0.00000     0.00000     0.00000
  11       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  12       0.00009     0.00039     0.00000     0.00000     0.00174     0.00152
  13       0.00002    -0.00019     0.00000    -0.00000    -0.00152    -0.00079
  14      -0.00019    -0.00082     0.00000     0.00001     0.00307     0.00277
  15       0.00000     0.00000     0.00006     0.00000     0.00000     0.00000
  16      -0.00000     0.00001     0.00000     0.00000     0.00000    -0.00000
  17      -0.00152     0.00307     0.00000     0.00000     0.00018    -0.00009
  18      -0.00079     0.00277     0.00000     0.00000     0.00009     0.00002
  19       0.00277    -0.00501     0.00000     0.00000     0.00039    -0.00019
  20       0.00000     0.00000     0.00058     0.00000     0.00000     0.00000
  21       0.00008     0.00034     0.00000     0.00000     0.00000     0.00000
  22       0.00524     0.02165     0.00000     0.00000     0.00002     0.00002
  23       0.00255    -0.00924     0.00000    -0.00000    -0.00002    -0.00001
  24      -0.00924    -0.03340     0.00000     0.00000     0.00006     0.00004
  25       0.00000     0.00000     0.00478     0.00000     0.00000     0.00000
  26      -0.00000     0.00000     0.00000     0.00000     0.00012    -0.00008
  27      -0.00002     0.00006     0.00000     0.00012     0.01305    -0.00524
  28      -0.00001     0.00004     0.00000     0.00008     0.00524     0.00255
  29       0.00004    -0.00014     0.00000     0.00034     0.02165    -0.00924
  30       0.00000     0.00000     0.00001     0.00000     0.00000     0.00000
  31       0.00003     0.00007     0.00000     0.00001     0.00116     0.00144
  32      -0.00144     0.00160     0.00000     0.00000     0.00004    -0.00003
  33       0.02334     0.03404     0.00000     0.00000     0.00000     0.00000
  34      -0.00000     0.00000     0.00000     0.00089     0.02792    -0.02334
  35      -0.04749     0.05283     0.00000     0.00000     0.00000    -0.00000
  36      -0.27266     0.30328     0.00000     0.00000     0.00000    -0.00000
  37      -0.01650     0.28029     0.00000     0.00000     0.00000     0.00000
  38       0.28029    -0.07629     0.00000     0.00000     0.00000    -0.00000
  39       0.00000     0.00000     0.23549     0.00000     0.00000     0.00000
  40       0.00000     0.00000     0.00000     0.00000     0.04284     0.04749
  41       0.00000     0.00000     0.00000     0.04284     0.39315     0.27266
  42       0.00000    -0.00000     0.00000    -0.04749    -0.27266    -0.01650
  43      -0.00000    -0.00000     0.00000     0.05283     0.30328     0.28029
  44       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  45      -0.12645     0.04805     0.00000     0.00000     0.00000    -0.00000
  46       0.00000     0.00000     0.00000     0.00611     0.10604     0.12645
  47      -0.00000    -0.00000     0.00000     0.00000     0.00000     0.00000
  48       0.00000    -0.00000     0.00000     0.00000     0.00000     0.00000
  49       1.00000    -0.00000     0.00000     0.00000    -0.00000     0.00000
  50      -0.00000     1.00000     0.00000     0.00000     0.00000     0.00000
  51       0.00000     0.00000     1.00000     0.00000     0.00000     0.00000
  52       0.00000     0.00000     0.00000     1.00000     0.24836     0.00000
  53      -0.00000     0.00000     0.00000     0.24836     1.00000    -0.00000
  54       0.00000     0.00000     0.00000     0.00000    -0.00000     1.00000
  55       0.00000    -0.00000     0.00000     0.00000     0.00000    -0.00000
  56       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  57       0.45887     0.07655     0.00000     0.00000     0.00000     0.00000
  58      -0.00000     0.00000     0.00000     0.06141     0.48732    -0.45887
  59      -0.13400    -0.44525     0.00000     0.00000     0.00000     0.00000
  60      -0.00000     0.00000     0.00000     0.06131     0.48692     0.13400

           55          56          57          58          59          60  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.00272     0.00000     0.00000     0.00074     0.00000     0.00006
   2      -0.06907     0.00000     0.00002     0.02468     0.00000     0.00481
   3       0.02713     0.00000     0.00001    -0.02186    -0.00000    -0.00066
   4      -0.09229     0.00000    -0.00005     0.02972    -0.00000     0.00811
   5       0.00000     0.01908     0.00000     0.00000     0.00000     0.00000
   6      -0.00000     0.00000     0.00074     0.00000     0.00006     0.00000
   7      -0.00002     0.00000     0.02468     0.00002     0.00481     0.00000
   8       0.00000     0.00000     0.02186    -0.00001     0.00066     0.00000
   9      -0.00005     0.00000    -0.02972     0.00005    -0.00811     0.00000
  10       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  11      -0.00001     0.00000     0.00000     0.00000     0.00000     0.00000
  12      -0.00307     0.00000     0.00078     0.00068     0.00001     0.00019
  13       0.00277     0.00000     0.00005    -0.00085    -0.00000    -0.00012
  14      -0.00501     0.00000    -0.00148     0.00099    -0.00002     0.00038
  15       0.00000     0.00058     0.00000     0.00000     0.00000     0.00000
  16      -0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  17      -0.00039     0.00000     0.00068     0.00078     0.00019     0.00001
  18      -0.00019     0.00000     0.00085    -0.00005     0.00012     0.00000
  19      -0.00082     0.00000    -0.00099     0.00148    -0.00038     0.00002
  20       0.00000     0.00006     0.00000     0.00000     0.00000     0.00000
  21      -0.00000     0.00000     0.00076     0.00000     0.00000     0.00000
  22      -0.00006     0.00000     0.02519     0.00002     0.00083     0.00000
  23       0.00004     0.00000     0.00476    -0.00003    -0.00039    -0.00000
  24      -0.00014     0.00000    -0.03729     0.00005    -0.00153     0.00000
  25       0.00000     0.00001     0.00000     0.00000     0.00000     0.00000
  26      -0.00034     0.00000     0.00000     0.00076     0.00000     0.00000
  27      -0.02165     0.00000     0.00002     0.02519     0.00000     0.00083
  28      -0.00924     0.00000     0.00003    -0.00476     0.00000     0.00039
  29      -0.03340     0.00000    -0.00005     0.03729    -0.00000     0.00153
  30       0.00000     0.00478     0.00000     0.00000     0.00000     0.00000
  31      -0.00160     0.00000     0.00030     0.00024     0.00000     0.00025
  32      -0.00007     0.00000     0.00024     0.00030     0.00025     0.00000
  33      -0.00000     0.00000     0.08944     0.00000     0.00264     0.00000
  34      -0.03404     0.00000     0.00000     0.08944     0.00000     0.00264
  35      -0.00000     0.00000     0.00561     0.00000     0.00577     0.00000
  36      -0.00000     0.00000     0.09966     0.00000     0.10177     0.00000
  37      -0.00000     0.00000     0.11842    -0.00000     0.03569     0.00000
  38      -0.00000     0.00000    -0.04901     0.00000    -0.12555     0.00000
  39       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  40      -0.05283     0.00000     0.00000     0.00561     0.00000     0.00577
  41      -0.30328     0.00000     0.00000     0.09966     0.00000     0.10177
  42       0.28029     0.00000     0.00000    -0.11842    -0.00000    -0.03569
  43      -0.07629     0.00000    -0.00000     0.04901    -0.00000     0.12555
  44       0.00000     0.23549     0.00000     0.00000     0.00000     0.00000
  45      -0.00000     0.00000     0.01462     0.00000     0.05493     0.00000
  46      -0.04805     0.00000     0.00000     0.01462     0.00000     0.05493
  47       0.00000     0.00000     0.06141     0.00000     0.06131     0.00000
  48      -0.00000     0.00000     0.48732     0.00000     0.48692     0.00000
  49       0.00000     0.00000     0.45887    -0.00000    -0.13400    -0.00000
  50      -0.00000     0.00000     0.07655     0.00000    -0.44525     0.00000
  51       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  52       0.00000     0.00000     0.00000     0.06141     0.00000     0.06131
  53       0.00000     0.00000     0.00000     0.48732     0.00000     0.48692
  54      -0.00000     0.00000     0.00000    -0.45887     0.00000     0.13400
  55       1.00000     0.00000    -0.00000    -0.07655    -0.00000     0.44525
  56       0.00000     1.00000     0.00000     0.00000     0.00000     0.00000
  57      -0.00000     0.00000     1.00000     0.00000     0.14897     0.00000
  58      -0.07655     0.00000     0.00000     1.00000     0.00000     0.14897
  59      -0.00000     0.00000     0.14897     0.00000     1.00000     0.00000
  60       0.44525     0.00000     0.00000     0.14897     0.00000     1.00000

 Forming initial guess at       1.5s


      Superposition of Atomic Density Guess
      -------------------------------------

 Sum of atomic energies:        -376.44825176

 global array: Temp HCore[1:60,1:60],  handle: -994 

            1           2           3           4           5           6  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       1.00000     0.24836    -0.00000    -0.00000     0.00000     0.00000
   2       0.24836     1.00000     0.00000    -0.00000     0.00000     0.00030
   3      -0.00000     0.00000     1.00000     0.00000     0.00000    -0.00014
   4      -0.00000    -0.00000     0.00000     1.00000     0.00000    -0.00081
   5       0.00000     0.00000     0.00000     0.00000     1.00000     0.00000
   6       0.00000     0.00030    -0.00014    -0.00081     0.00000     1.00000
   7       0.00030     0.02187    -0.00590    -0.03524     0.00000     0.24836
   8       0.00014     0.00590     0.00661    -0.01021     0.00000     0.00000
   9       0.00081     0.03524    -0.01021    -0.05268     0.00000     0.00000
  10       0.00000     0.00000     0.00000     0.00000     0.00832     0.00000
  11       0.00000     0.03557     0.04482    -0.03839     0.00000     0.00000
  12       0.03557     0.35371     0.28849    -0.24714     0.00000     0.00159
  13      -0.04482    -0.28849    -0.10190     0.26261     0.00000    -0.00235
  14       0.03839     0.24714     0.26261    -0.02032     0.00000    -0.00288
  15       0.00000     0.00000     0.00000     0.00000     0.20465     0.00000
  16       0.00000     0.00159    -0.00235    -0.00288     0.00000     0.00000
  17       0.00159     0.05619    -0.05280    -0.06468     0.00000     0.03557
  18       0.00235     0.05280    -0.03131    -0.06691     0.00000     0.04482
  19       0.00288     0.06468    -0.06691    -0.05866     0.00000    -0.03839
  20       0.00000     0.00000     0.00000     0.00000     0.02331     0.00000
  21       0.00000     0.00157     0.00127    -0.00344     0.00000     0.00000
  22       0.00157     0.05578     0.02866    -0.07785     0.00000     0.03558
  23      -0.00127    -0.02866     0.00691     0.04403     0.00000    -0.05494
  24       0.00344     0.07785     0.04403    -0.09646     0.00000    -0.02157
  25       0.00000     0.00000     0.00000     0.00000     0.02312     0.00000
  26       0.00000     0.03558    -0.05494    -0.02157     0.00000     0.00000
  27       0.03558     0.35374    -0.35362    -0.13884     0.00000     0.00157
  28       0.05494     0.35362    -0.25587    -0.18083     0.00000     0.00127
  29       0.02157     0.13884    -0.18083     0.13368     0.00000    -0.00344
  30       0.00000     0.00000     0.00000     0.00000     0.20467     0.00000
  31       0.00509     0.09301     0.11685    -0.03020     0.00000     0.00008
  32       0.00008     0.00590    -0.00738    -0.00652     0.00000     0.00509
  33       0.00008     0.00588     0.00484    -0.00854     0.00000     0.00508
  34       0.00508     0.09284    -0.12012     0.00954     0.00000     0.00008
  35       0.00000     0.00000    -0.00000    -0.00000     0.00000     0.00000
  36       0.00000     0.00026    -0.00010    -0.00057     0.00000     0.02955
  37       0.00000     0.00010     0.00004    -0.00022     0.00000     0.00980
  38       0.00000     0.00057    -0.00022    -0.00117     0.00000     0.04831
  39       0.00000     0.00000     0.00000     0.00000     0.00008     0.00000
  40       0.00000     0.02955     0.00980     0.04831     0.00000     0.00000
  41       0.02955     0.31761     0.06996     0.34497     0.00000     0.00000
  42      -0.00980    -0.06996     0.15824    -0.09697     0.00000    -0.00000
  43      -0.04831    -0.34497    -0.09697    -0.30023     0.00000    -0.00000
  44       0.00000     0.00000     0.00000     0.00000     0.17791     0.00000
  45       0.00000     0.00008    -0.00007    -0.00016     0.00000     0.00487
  46       0.00487     0.09007     0.07314     0.09177     0.00000     0.00000
  47       0.00000     0.00000     0.00000    -0.00000     0.00000     0.00000
  48       0.00000     0.00001     0.00000    -0.00002     0.00000     0.00116
  49      -0.00000    -0.00000     0.00000     0.00000     0.00000    -0.00066
  50       0.00000     0.00002     0.00000    -0.00005     0.00000     0.00272
  51       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  52       0.00000     0.00116    -0.00066     0.00272     0.00000     0.00000
  53       0.00116     0.04688    -0.01682     0.06907     0.00000     0.00000
  54       0.00066     0.01682     0.01248     0.02713     0.00000     0.00000
  55      -0.00272    -0.06907     0.02713    -0.09229     0.00000    -0.00000
  56       0.00000     0.00000     0.00000     0.00000     0.01908     0.00000
  57       0.00000     0.00002     0.00001    -0.00005     0.00000     0.00074
  58       0.00074     0.02468    -0.02186     0.02972     0.00000     0.00000
  59       0.00000     0.00000    -0.00000    -0.00000     0.00000     0.00006
  60       0.00006     0.00481    -0.00066     0.00811     0.00000     0.00000

            7           8           9          10          11          12  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.00030     0.00014     0.00081     0.00000     0.00000     0.03557
   2       0.02187     0.00590     0.03524     0.00000     0.03557     0.35371
   3      -0.00590     0.00661    -0.01021     0.00000     0.04482     0.28849
   4      -0.03524    -0.01021    -0.05268     0.00000    -0.03839    -0.24714
   5       0.00000     0.00000     0.00000     0.00832     0.00000     0.00000
   6       0.24836     0.00000     0.00000     0.00000     0.00000     0.00159
   7       1.00000    -0.00000     0.00000     0.00000     0.00159     0.05619
   8      -0.00000     1.00000     0.00000     0.00000     0.00235     0.05280
   9       0.00000     0.00000     1.00000     0.00000     0.00288     0.06468
  10       0.00000     0.00000     0.00000     1.00000     0.00000     0.00000
  11       0.00159     0.00235     0.00288     0.00000     1.00000     0.24836
  12       0.05619     0.05280     0.06468     0.00000     0.24836     1.00000
  13      -0.05280    -0.03131    -0.06691     0.00000     0.00000     0.00000
  14      -0.06468    -0.06691    -0.05866     0.00000    -0.00000    -0.00000
  15       0.00000     0.00000     0.00000     0.02331     0.00000     0.00000
  16       0.03557    -0.04482     0.03839     0.00000     0.00000     0.00039
  17       0.35371    -0.28849     0.24714     0.00000     0.00039     0.02519
  18       0.28849    -0.10190     0.26261     0.00000     0.00097     0.03810
  19      -0.24714     0.26261    -0.02032     0.00000     0.00036     0.01415
  20       0.00000     0.00000     0.00000     0.20465     0.00000     0.00000
  21       0.03558     0.05494     0.02157     0.00000     0.00000     0.03729
  22       0.35374     0.35362     0.13884     0.00000     0.03729     0.36341
  23      -0.35362    -0.25587    -0.18083     0.00000     0.01014     0.06345
  24      -0.13884    -0.18083     0.13368     0.00000     0.06099     0.38176
  25       0.00000     0.00000     0.00000     0.20467     0.00000     0.00000
  26       0.00157    -0.00127     0.00344     0.00000     0.00000     0.00170
  27       0.05578    -0.02866     0.07785     0.00000     0.00170     0.05856
  28       0.02866     0.00691     0.04403     0.00000     0.00390     0.08539
  29      -0.07785     0.04403    -0.09646     0.00000    -0.00066    -0.01441
  30       0.00000     0.00000     0.00000     0.02312     0.00000     0.00000
  31       0.00590     0.00738     0.00652     0.00000     0.06102     0.48575
  32       0.09301    -0.11685     0.03020     0.00000     0.00001     0.00175
  33       0.09284     0.12012    -0.00954     0.00000     0.00527     0.09535
  34       0.00588    -0.00484     0.00854     0.00000     0.00008     0.00611
  35       0.02955    -0.00980    -0.04831     0.00000     0.00000     0.00000
  36       0.31761    -0.06996    -0.34497     0.00000     0.00000     0.00144
  37       0.06996     0.15824    -0.09697     0.00000     0.00000     0.00139
  38       0.34497    -0.09697    -0.30023     0.00000     0.00001     0.00253
  39       0.00000     0.00000     0.00000     0.17791     0.00000     0.00000
  40       0.00000     0.00000     0.00000     0.00000     0.00000     0.00126
  41       0.00026     0.00010     0.00057     0.00000     0.00126     0.04921
  42      -0.00010     0.00004    -0.00022     0.00000     0.00094     0.02306
  43      -0.00057    -0.00022    -0.00117     0.00000    -0.00287    -0.07056
  44       0.00000     0.00000     0.00000     0.00008     0.00000     0.00000
  45       0.09007    -0.07314    -0.09177     0.00000     0.00000     0.00019
  46       0.00008     0.00007     0.00016     0.00000     0.00132     0.03624
  47       0.00116     0.00066    -0.00272     0.00000     0.00000     0.00000
  48       0.04688     0.01682    -0.06907     0.00000     0.00000     0.00018
  49      -0.01682     0.01248     0.02713     0.00000     0.00000     0.00009
  50       0.06907     0.02713    -0.09229     0.00000     0.00000     0.00039
  51       0.00000     0.00000     0.00000     0.01908     0.00000     0.00000
  52       0.00000    -0.00000     0.00000     0.00000     0.00000     0.00000
  53       0.00001    -0.00000     0.00002     0.00000     0.00000     0.00174
  54       0.00000     0.00000     0.00000     0.00000     0.00000     0.00152
  55      -0.00002     0.00000    -0.00005     0.00000    -0.00001    -0.00307
  56       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  57       0.02468     0.02186    -0.02972     0.00000     0.00000     0.00078
  58       0.00002    -0.00001     0.00005     0.00000     0.00000     0.00068
  59       0.00481     0.00066    -0.00811     0.00000     0.00000     0.00001
  60       0.00000     0.00000     0.00000     0.00000     0.00000     0.00019

           13          14          15          16          17          18  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.04482     0.03839     0.00000     0.00000     0.00159     0.00235
   2      -0.28849     0.24714     0.00000     0.00159     0.05619     0.05280
   3      -0.10190     0.26261     0.00000    -0.00235    -0.05280    -0.03131
   4       0.26261    -0.02032     0.00000    -0.00288    -0.06468    -0.06691
   5       0.00000     0.00000     0.20465     0.00000     0.00000     0.00000
   6      -0.00235    -0.00288     0.00000     0.00000     0.03557     0.04482
   7      -0.05280    -0.06468     0.00000     0.03557     0.35371     0.28849
   8      -0.03131    -0.06691     0.00000    -0.04482    -0.28849    -0.10190
   9      -0.06691    -0.05866     0.00000     0.03839     0.24714     0.26261
  10       0.00000     0.00000     0.02331     0.00000     0.00000     0.00000
  11       0.00000    -0.00000     0.00000     0.00000     0.00039     0.00097
  12       0.00000    -0.00000     0.00000     0.00039     0.02519     0.03810
  13       1.00000     0.00000     0.00000    -0.00097    -0.03810    -0.05238
  14       0.00000     1.00000     0.00000    -0.00036    -0.01415    -0.02305
  15       0.00000     0.00000     1.00000     0.00000     0.00000     0.00000
  16      -0.00097    -0.00036     0.00000     1.00000     0.24836    -0.00000
  17      -0.03810    -0.01415     0.00000     0.24836     1.00000    -0.00000
  18      -0.05238    -0.02305     0.00000    -0.00000    -0.00000     1.00000
  19      -0.02305     0.00113     0.00000     0.00000     0.00000     0.00000
  20       0.00000     0.00000     0.00969     0.00000     0.00000     0.00000
  21      -0.01014    -0.06099     0.00000     0.00000     0.00170     0.00390
  22      -0.06345    -0.38176     0.00000     0.00170     0.05856     0.08539
  23       0.19756    -0.08733     0.00000    -0.00390    -0.08539    -0.11288
  24      -0.08733    -0.31332     0.00000     0.00066     0.01441     0.02316
  25       0.00000     0.00000     0.21207     0.00000     0.00000     0.00000
  26      -0.00390     0.00066     0.00000     0.00000     0.03729     0.01014
  27      -0.08539     0.01441     0.00000     0.03729     0.36341     0.06345
  28      -0.11288     0.02316     0.00000    -0.01014    -0.06345     0.19756
  29       0.02316     0.02049     0.00000    -0.06099    -0.38176    -0.08733
  30       0.00000     0.00000     0.02440     0.00000     0.00000     0.00000
  31       0.43567     0.16041     0.00000     0.00001     0.00175     0.00297
  32      -0.00297    -0.00110     0.00000     0.06102     0.48575    -0.43567
  33       0.03534    -0.11815     0.00000     0.00008     0.00611     0.00963
  34      -0.00963     0.00325     0.00000     0.00527     0.09535    -0.03534
  35      -0.00000    -0.00001     0.00000     0.00000     0.00126     0.00094
  36      -0.00139    -0.00253     0.00000     0.00126     0.04921     0.02306
  37      -0.00089    -0.00250     0.00000    -0.00094    -0.02306     0.00828
  38      -0.00250    -0.00407     0.00000     0.00287     0.07056     0.03624
  39       0.00000     0.00000     0.00048     0.00000     0.00000     0.00000
  40      -0.00094     0.00287     0.00000     0.00000     0.00000     0.00000
  41      -0.02306     0.07056     0.00000     0.00000     0.00144     0.00139
  42       0.00828     0.03624     0.00000    -0.00000    -0.00139    -0.00089
  43       0.03624    -0.09075     0.00000    -0.00001    -0.00253    -0.00250
  44       0.00000     0.00000     0.02013     0.00000     0.00000     0.00000
  45      -0.00024    -0.00030     0.00000     0.00132     0.03624    -0.00570
  46       0.00570     0.05196     0.00000     0.00000     0.00019     0.00024
  47      -0.00000    -0.00000     0.00000     0.00000     0.00000     0.00000
  48      -0.00009    -0.00039     0.00000     0.00000     0.00174     0.00152
  49       0.00002    -0.00019     0.00000    -0.00000    -0.00152    -0.00079
  50      -0.00019    -0.00082     0.00000     0.00001     0.00307     0.00277
  51       0.00000     0.00000     0.00006     0.00000     0.00000     0.00000
  52      -0.00000     0.00001     0.00000     0.00000     0.00000     0.00000
  53      -0.00152     0.00307     0.00000     0.00000     0.00018     0.00009
  54      -0.00079     0.00277     0.00000    -0.00000    -0.00009     0.00002
  55       0.00277    -0.00501     0.00000    -0.00000    -0.00039    -0.00019
  56       0.00000     0.00000     0.00058     0.00000     0.00000     0.00000
  57       0.00005    -0.00148     0.00000     0.00000     0.00068     0.00085
  58      -0.00085     0.00099     0.00000     0.00000     0.00078    -0.00005
  59      -0.00000    -0.00002     0.00000     0.00000     0.00019     0.00012
  60      -0.00012     0.00038     0.00000     0.00000     0.00001     0.00000

           19          20          21          22          23          24  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.00288     0.00000     0.00000     0.00157    -0.00127     0.00344
   2       0.06468     0.00000     0.00157     0.05578    -0.02866     0.07785
   3      -0.06691     0.00000     0.00127     0.02866     0.00691     0.04403
   4      -0.05866     0.00000    -0.00344    -0.07785     0.04403    -0.09646
   5       0.00000     0.02331     0.00000     0.00000     0.00000     0.00000
   6      -0.03839     0.00000     0.00000     0.03558    -0.05494    -0.02157
   7      -0.24714     0.00000     0.03558     0.35374    -0.35362    -0.13884
   8       0.26261     0.00000     0.05494     0.35362    -0.25587    -0.18083
   9      -0.02032     0.00000     0.02157     0.13884    -0.18083     0.13368
  10       0.00000     0.20465     0.00000     0.00000     0.00000     0.00000
  11       0.00036     0.00000     0.00000     0.03729     0.01014     0.06099
  12       0.01415     0.00000     0.03729     0.36341     0.06345     0.38176
  13      -0.02305     0.00000    -0.01014    -0.06345     0.19756    -0.08733
  14       0.00113     0.00000    -0.06099    -0.38176    -0.08733    -0.31332
  15       0.00000     0.00969     0.00000     0.00000     0.00000     0.00000
  16       0.00000     0.00000     0.00000     0.00170    -0.00390     0.00066
  17       0.00000     0.00000     0.00170     0.05856    -0.08539     0.01441
  18       0.00000     0.00000     0.00390     0.08539    -0.11288     0.02316
  19       1.00000     0.00000    -0.00066    -0.01441     0.02316     0.02049
  20       0.00000     1.00000     0.00000     0.00000     0.00000     0.00000
  21      -0.00066     0.00000     1.00000     0.24836    -0.00000    -0.00000
  22      -0.01441     0.00000     0.24836     1.00000     0.00000    -0.00000
  23       0.02316     0.00000    -0.00000     0.00000     1.00000     0.00000
  24       0.02049     0.00000    -0.00000    -0.00000     0.00000     1.00000
  25       0.00000     0.02440     0.00000     0.00000     0.00000     0.00000
  26       0.06099     0.00000     0.00000     0.00038    -0.00078     0.00065
  27       0.38176     0.00000     0.00038     0.02484    -0.03098     0.02550
  28      -0.08733     0.00000     0.00078     0.03098    -0.03207     0.03425
  29      -0.31332     0.00000    -0.00065    -0.02550     0.03425    -0.01864
  30       0.00000     0.21207     0.00000     0.00000     0.00000     0.00000
  31       0.00110     0.00000     0.00526     0.09520     0.07165     0.10018
  32      -0.16041     0.00000     0.00008     0.00611    -0.01016     0.00008
  33      -0.00325     0.00000     0.06126     0.48673     0.36054    -0.29343
  34       0.11815     0.00000     0.00001     0.00173    -0.00242     0.00199
  35      -0.00287     0.00000     0.00000     0.00105    -0.00162    -0.00199
  36      -0.07056     0.00000     0.00105     0.04432    -0.04274    -0.05240
  37       0.03624     0.00000     0.00162     0.04274    -0.02709    -0.05521
  38      -0.09075     0.00000     0.00199     0.05240    -0.05521    -0.04974
  39       0.00000     0.02013     0.00000     0.00000     0.00000     0.00000
  40       0.00001     0.00000     0.00000     0.00000    -0.00000     0.00001
  41       0.00253     0.00000     0.00000     0.00158    -0.00045     0.00311
  42      -0.00250     0.00000     0.00000     0.00045     0.00039     0.00092
  43      -0.00407     0.00000    -0.00001    -0.00311     0.00092    -0.00575
  44       0.00000     0.00048     0.00000     0.00000     0.00000     0.00000
  45      -0.05196     0.00000     0.00006     0.00515    -0.00667    -0.00554
  46       0.00030     0.00000     0.00001     0.00114     0.00027     0.00210
  47      -0.00001     0.00000     0.00000     0.00012    -0.00008    -0.00034
  48      -0.00307     0.00000     0.00012     0.01305    -0.00524    -0.02165
  49       0.00277     0.00000     0.00008     0.00524     0.00255    -0.00924
  50      -0.00501     0.00000     0.00034     0.02165    -0.00924    -0.03340
  51       0.00000     0.00058     0.00000     0.00000     0.00000     0.00000
  52       0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  53       0.00039     0.00000     0.00000     0.00002    -0.00002     0.00006
  54      -0.00019     0.00000     0.00000     0.00002    -0.00001     0.00004
  55      -0.00082     0.00000    -0.00000    -0.00006     0.00004    -0.00014
  56       0.00000     0.00006     0.00000     0.00000     0.00000     0.00000
  57      -0.00099     0.00000     0.00076     0.02519     0.00476    -0.03729
  58       0.00148     0.00000     0.00000     0.00002    -0.00003     0.00005
  59      -0.00038     0.00000     0.00000     0.00083    -0.00039    -0.00153
  60       0.00002     0.00000     0.00000     0.00000    -0.00000     0.00000

           25          26          27          28          29          30  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.00000     0.00000     0.03558     0.05494     0.02157     0.00000
   2       0.00000     0.03558     0.35374     0.35362     0.13884     0.00000
   3       0.00000    -0.05494    -0.35362    -0.25587    -0.18083     0.00000
   4       0.00000    -0.02157    -0.13884    -0.18083     0.13368     0.00000
   5       0.02312     0.00000     0.00000     0.00000     0.00000     0.20467
   6       0.00000     0.00000     0.00157     0.00127    -0.00344     0.00000
   7       0.00000     0.00157     0.05578     0.02866    -0.07785     0.00000
   8       0.00000    -0.00127    -0.02866     0.00691     0.04403     0.00000
   9       0.00000     0.00344     0.07785     0.04403    -0.09646     0.00000
  10       0.20467     0.00000     0.00000     0.00000     0.00000     0.02312
  11       0.00000     0.00000     0.00170     0.00390    -0.00066     0.00000
  12       0.00000     0.00170     0.05856     0.08539    -0.01441     0.00000
  13       0.00000    -0.00390    -0.08539    -0.11288     0.02316     0.00000
  14       0.00000     0.00066     0.01441     0.02316     0.02049     0.00000
  15       0.21207     0.00000     0.00000     0.00000     0.00000     0.02440
  16       0.00000     0.00000     0.03729    -0.01014    -0.06099     0.00000
  17       0.00000     0.03729     0.36341    -0.06345    -0.38176     0.00000
  18       0.00000     0.01014     0.06345     0.19756    -0.08733     0.00000
  19       0.00000     0.06099     0.38176    -0.08733    -0.31332     0.00000
  20       0.02440     0.00000     0.00000     0.00000     0.00000     0.21207
  21       0.00000     0.00000     0.00038     0.00078    -0.00065     0.00000
  22       0.00000     0.00038     0.02484     0.03098    -0.02550     0.00000
  23       0.00000    -0.00078    -0.03098    -0.03207     0.03425     0.00000
  24       0.00000     0.00065     0.02550     0.03425    -0.01864     0.00000
  25       1.00000     0.00000     0.00000     0.00000     0.00000     0.00954
  26       0.00000     1.00000     0.24836     0.00000     0.00000     0.00000
  27       0.00000     0.24836     1.00000     0.00000     0.00000     0.00000
  28       0.00000     0.00000     0.00000     1.00000     0.00000     0.00000
  29       0.00000     0.00000     0.00000     0.00000     1.00000     0.00000
  30       0.00954     0.00000     0.00000     0.00000     0.00000     1.00000
  31       0.00000     0.00008     0.00611     0.01016    -0.00008     0.00000
  32       0.00000     0.00526     0.09520    -0.07165    -0.10018     0.00000
  33       0.00000     0.00001     0.00173     0.00242    -0.00199     0.00000
  34       0.00000     0.06126     0.48673    -0.36054     0.29343     0.00000
  35       0.00000     0.00000     0.00000     0.00000    -0.00001     0.00000
  36       0.00000     0.00000     0.00158     0.00045    -0.00311     0.00000
  37       0.00000    -0.00000    -0.00045     0.00039     0.00092     0.00000
  38       0.00000     0.00001     0.00311     0.00092    -0.00575     0.00000
  39       0.01794     0.00000     0.00000     0.00000     0.00000     0.00053
  40       0.00000     0.00000     0.00105     0.00162     0.00199     0.00000
  41       0.00000     0.00105     0.04432     0.04274     0.05240     0.00000
  42       0.00000    -0.00162    -0.04274    -0.02709    -0.05521     0.00000
  43       0.00000    -0.00199    -0.05240    -0.05521    -0.04974     0.00000
  44       0.00053     0.00000     0.00000     0.00000     0.00000     0.01794
  45       0.00000     0.00001     0.00114    -0.00027    -0.00210     0.00000
  46       0.00000     0.00006     0.00515     0.00667     0.00554     0.00000
  47       0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  48       0.00000     0.00000     0.00002     0.00002    -0.00006     0.00000
  49       0.00000    -0.00000    -0.00002    -0.00001     0.00004     0.00000
  50       0.00000     0.00000     0.00006     0.00004    -0.00014     0.00000
  51       0.00478     0.00000     0.00000     0.00000     0.00000     0.00001
  52       0.00000     0.00000     0.00012     0.00008     0.00034     0.00000
  53       0.00000     0.00012     0.01305     0.00524     0.02165     0.00000
  54       0.00000    -0.00008    -0.00524     0.00255    -0.00924     0.00000
  55       0.00000    -0.00034    -0.02165    -0.00924    -0.03340     0.00000
  56       0.00001     0.00000     0.00000     0.00000     0.00000     0.00478
  57       0.00000     0.00000     0.00002     0.00003    -0.00005     0.00000
  58       0.00000     0.00076     0.02519    -0.00476     0.03729     0.00000
  59       0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  60       0.00000     0.00000     0.00083     0.00039     0.00153     0.00000

           31          32          33          34          35          36  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.00509     0.00008     0.00008     0.00508     0.00000     0.00000
   2       0.09301     0.00590     0.00588     0.09284     0.00000     0.00026
   3       0.11685    -0.00738     0.00484    -0.12012    -0.00000    -0.00010
   4      -0.03020    -0.00652    -0.00854     0.00954    -0.00000    -0.00057
   5       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
   6       0.00008     0.00509     0.00508     0.00008     0.00000     0.02955
   7       0.00590     0.09301     0.09284     0.00588     0.02955     0.31761
   8       0.00738    -0.11685     0.12012    -0.00484    -0.00980    -0.06996
   9       0.00652     0.03020    -0.00954     0.00854    -0.04831    -0.34497
  10       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  11       0.06102     0.00001     0.00527     0.00008     0.00000     0.00000
  12       0.48575     0.00175     0.09535     0.00611     0.00000     0.00144
  13       0.43567    -0.00297     0.03534    -0.00963    -0.00000    -0.00139
  14       0.16041    -0.00110    -0.11815     0.00325    -0.00001    -0.00253
  15       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  16       0.00001     0.06102     0.00008     0.00527     0.00000     0.00126
  17       0.00175     0.48575     0.00611     0.09535     0.00126     0.04921
  18       0.00297    -0.43567     0.00963    -0.03534     0.00094     0.02306
  19       0.00110    -0.16041    -0.00325     0.11815    -0.00287    -0.07056
  20       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  21       0.00526     0.00008     0.06126     0.00001     0.00000     0.00105
  22       0.09520     0.00611     0.48673     0.00173     0.00105     0.04432
  23       0.07165    -0.01016     0.36054    -0.00242    -0.00162    -0.04274
  24       0.10018     0.00008    -0.29343     0.00199    -0.00199    -0.05240
  25       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  26       0.00008     0.00526     0.00001     0.06126     0.00000     0.00000
  27       0.00611     0.09520     0.00173     0.48673     0.00000     0.00158
  28       0.01016    -0.07165     0.00242    -0.36054     0.00000     0.00045
  29      -0.00008    -0.10018    -0.00199     0.29343    -0.00001    -0.00311
  30       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  31       1.00000     0.00011     0.05049     0.00071     0.00000     0.00015
  32       0.00011     1.00000     0.00071     0.05049     0.00113     0.03262
  33       0.05049     0.00071     1.00000     0.00010     0.00087     0.02741
  34       0.00071     0.05049     0.00010     1.00000     0.00000     0.00017
  35       0.00000     0.00113     0.00087     0.00000     1.00000     0.24836
  36       0.00015     0.03262     0.02741     0.00017     0.24836     1.00000
  37       0.00019    -0.03181     0.03596    -0.00011    -0.00000    -0.00000
  38       0.00024     0.03532     0.01884     0.00034    -0.00000    -0.00000
  39       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  40       0.00113     0.00000     0.00000     0.00087     0.00000     0.00000
  41       0.03262     0.00015     0.00017     0.02741     0.00000     0.00000
  42       0.03181    -0.00019     0.00011    -0.03596    -0.00000    -0.00000
  43      -0.03532    -0.00024    -0.00034    -0.01884    -0.00000    -0.00000
  44       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  45       0.00001     0.06153     0.00248     0.00024     0.06070     0.48445
  46       0.06153     0.00001     0.00024     0.00248     0.00000     0.00000
  47       0.00000     0.00001     0.00089     0.00000     0.00000     0.04284
  48       0.00004     0.00116     0.02792     0.00000     0.04284     0.39315
  49       0.00003    -0.00144     0.02334    -0.00000    -0.04749    -0.27266
  50       0.00007     0.00160     0.03404     0.00000     0.05283     0.30328
  51       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  52       0.00001     0.00000     0.00000     0.00089     0.00000     0.00000
  53       0.00116     0.00004     0.00000     0.02792     0.00000     0.00000
  54       0.00144    -0.00003     0.00000    -0.02334    -0.00000    -0.00000
  55      -0.00160    -0.00007    -0.00000    -0.03404    -0.00000    -0.00000
  56       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  57       0.00030     0.00024     0.08944     0.00000     0.00561     0.09966
  58       0.00024     0.00030     0.00000     0.08944     0.00000     0.00000
  59       0.00000     0.00025     0.00264     0.00000     0.00577     0.10177
  60       0.00025     0.00000     0.00000     0.00264     0.00000     0.00000

           37          38          39          40          41          42  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.00000     0.00000     0.00000     0.00000     0.02955    -0.00980
   2       0.00010     0.00057     0.00000     0.02955     0.31761    -0.06996
   3       0.00004    -0.00022     0.00000     0.00980     0.06996     0.15824
   4      -0.00022    -0.00117     0.00000     0.04831     0.34497    -0.09697
   5       0.00000     0.00000     0.00008     0.00000     0.00000     0.00000
   6       0.00980     0.04831     0.00000     0.00000     0.00000    -0.00000
   7       0.06996     0.34497     0.00000     0.00000     0.00026    -0.00010
   8       0.15824    -0.09697     0.00000     0.00000     0.00010     0.00004
   9      -0.09697    -0.30023     0.00000     0.00000     0.00057    -0.00022
  10       0.00000     0.00000     0.17791     0.00000     0.00000     0.00000
  11       0.00000     0.00001     0.00000     0.00000     0.00126     0.00094
  12       0.00139     0.00253     0.00000     0.00126     0.04921     0.02306
  13      -0.00089    -0.00250     0.00000    -0.00094    -0.02306     0.00828
  14      -0.00250    -0.00407     0.00000     0.00287     0.07056     0.03624
  15       0.00000     0.00000     0.00048     0.00000     0.00000     0.00000
  16      -0.00094     0.00287     0.00000     0.00000     0.00000    -0.00000
  17      -0.02306     0.07056     0.00000     0.00000     0.00144    -0.00139
  18       0.00828     0.03624     0.00000     0.00000     0.00139    -0.00089
  19       0.03624    -0.09075     0.00000     0.00001     0.00253    -0.00250
  20       0.00000     0.00000     0.02013     0.00000     0.00000     0.00000
  21       0.00162     0.00199     0.00000     0.00000     0.00000     0.00000
  22       0.04274     0.05240     0.00000     0.00000     0.00158     0.00045
  23      -0.02709    -0.05521     0.00000    -0.00000    -0.00045     0.00039
  24      -0.05521    -0.04974     0.00000     0.00001     0.00311     0.00092
  25       0.00000     0.00000     0.01794     0.00000     0.00000     0.00000
  26      -0.00000     0.00001     0.00000     0.00000     0.00105    -0.00162
  27      -0.00045     0.00311     0.00000     0.00105     0.04432    -0.04274
  28       0.00039     0.00092     0.00000     0.00162     0.04274    -0.02709
  29       0.00092    -0.00575     0.00000     0.00199     0.05240    -0.05521
  30       0.00000     0.00000     0.00053     0.00000     0.00000     0.00000
  31       0.00019     0.00024     0.00000     0.00113     0.03262     0.03181
  32      -0.03181     0.03532     0.00000     0.00000     0.00015    -0.00019
  33       0.03596     0.01884     0.00000     0.00000     0.00017     0.00011
  34      -0.00011     0.00034     0.00000     0.00087     0.02741    -0.03596
  35      -0.00000    -0.00000     0.00000     0.00000     0.00000    -0.00000
  36      -0.00000    -0.00000     0.00000     0.00000     0.00000    -0.00000
  37       1.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  38       0.00000     1.00000     0.00000     0.00000     0.00000    -0.00000
  39       0.00000     0.00000     1.00000     0.00000     0.00000     0.00000
  40       0.00000     0.00000     0.00000     1.00000     0.24836     0.00000
  41       0.00000     0.00000     0.00000     0.24836     1.00000     0.00000
  42       0.00000    -0.00000     0.00000     0.00000     0.00000     1.00000
  43      -0.00000    -0.00000     0.00000     0.00000     0.00000     0.00000
  44       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  45      -0.45129    -0.10556     0.00000     0.00000     0.00000    -0.00000
  46       0.00000     0.00000     0.00000     0.06070     0.48445     0.45129
  47       0.04749    -0.05283     0.00000     0.00000     0.00000    -0.00000
  48       0.27266    -0.30328     0.00000     0.00000     0.00000    -0.00000
  49      -0.01650     0.28029     0.00000     0.00000     0.00000     0.00000
  50       0.28029    -0.07629     0.00000     0.00000     0.00000    -0.00000
  51       0.00000     0.00000     0.23549     0.00000     0.00000     0.00000
  52       0.00000     0.00000     0.00000     0.00000     0.04284    -0.04749
  53       0.00000     0.00000     0.00000     0.04284     0.39315    -0.27266
  54       0.00000    -0.00000     0.00000     0.04749     0.27266    -0.01650
  55      -0.00000    -0.00000     0.00000    -0.05283    -0.30328     0.28029
  56       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  57       0.11842    -0.04901     0.00000     0.00000     0.00000     0.00000
  58      -0.00000     0.00000     0.00000     0.00561     0.09966    -0.11842
  59       0.03569    -0.12555     0.00000     0.00000     0.00000    -0.00000
  60       0.00000     0.00000     0.00000     0.00577     0.10177    -0.03569

           43          44          45          46          47          48  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.04831     0.00000     0.00000     0.00487     0.00000     0.00000
   2      -0.34497     0.00000     0.00008     0.09007     0.00000     0.00001
   3      -0.09697     0.00000    -0.00007     0.07314     0.00000     0.00000
   4      -0.30023     0.00000    -0.00016     0.09177    -0.00000    -0.00002
   5       0.00000     0.17791     0.00000     0.00000     0.00000     0.00000
   6      -0.00000     0.00000     0.00487     0.00000     0.00000     0.00116
   7      -0.00057     0.00000     0.09007     0.00008     0.00116     0.04688
   8      -0.00022     0.00000    -0.07314     0.00007     0.00066     0.01682
   9      -0.00117     0.00000    -0.09177     0.00016    -0.00272    -0.06907
  10       0.00000     0.00008     0.00000     0.00000     0.00000     0.00000
  11      -0.00287     0.00000     0.00000     0.00132     0.00000     0.00000
  12      -0.07056     0.00000     0.00019     0.03624     0.00000     0.00018
  13       0.03624     0.00000    -0.00024     0.00570    -0.00000    -0.00009
  14      -0.09075     0.00000    -0.00030     0.05196    -0.00000    -0.00039
  15       0.00000     0.02013     0.00000     0.00000     0.00000     0.00000
  16      -0.00001     0.00000     0.00132     0.00000     0.00000     0.00000
  17      -0.00253     0.00000     0.03624     0.00019     0.00000     0.00174
  18      -0.00250     0.00000    -0.00570     0.00024     0.00000     0.00152
  19      -0.00407     0.00000    -0.05196     0.00030    -0.00001    -0.00307
  20       0.00000     0.00048     0.00000     0.00000     0.00000     0.00000
  21      -0.00001     0.00000     0.00006     0.00001     0.00000     0.00012
  22      -0.00311     0.00000     0.00515     0.00114     0.00012     0.01305
  23       0.00092     0.00000    -0.00667     0.00027    -0.00008    -0.00524
  24      -0.00575     0.00000    -0.00554     0.00210    -0.00034    -0.02165
  25       0.00000     0.00053     0.00000     0.00000     0.00000     0.00000
  26      -0.00199     0.00000     0.00001     0.00006     0.00000     0.00000
  27      -0.05240     0.00000     0.00114     0.00515     0.00000     0.00002
  28      -0.05521     0.00000    -0.00027     0.00667     0.00000     0.00002
  29      -0.04974     0.00000    -0.00210     0.00554    -0.00000    -0.00006
  30       0.00000     0.01794     0.00000     0.00000     0.00000     0.00000
  31      -0.03532     0.00000     0.00001     0.06153     0.00000     0.00004
  32      -0.00024     0.00000     0.06153     0.00001     0.00001     0.00116
  33      -0.00034     0.00000     0.00248     0.00024     0.00089     0.02792
  34      -0.01884     0.00000     0.00024     0.00248     0.00000     0.00000
  35      -0.00000     0.00000     0.06070     0.00000     0.00000     0.04284
  36      -0.00000     0.00000     0.48445     0.00000     0.04284     0.39315
  37      -0.00000     0.00000    -0.45129     0.00000     0.04749     0.27266
  38      -0.00000     0.00000    -0.10556     0.00000    -0.05283    -0.30328
  39       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  40       0.00000     0.00000     0.00000     0.06070     0.00000     0.00000
  41       0.00000     0.00000     0.00000     0.48445     0.00000     0.00000
  42       0.00000     0.00000    -0.00000     0.45129    -0.00000    -0.00000
  43       1.00000     0.00000    -0.00000     0.10556    -0.00000    -0.00000
  44       0.00000     1.00000     0.00000     0.00000     0.00000     0.00000
  45      -0.00000     0.00000     1.00000     0.00000     0.00611     0.10604
  46       0.10556     0.00000     0.00000     1.00000     0.00000     0.00000
  47      -0.00000     0.00000     0.00611     0.00000     1.00000     0.24836
  48      -0.00000     0.00000     0.10604     0.00000     0.24836     1.00000
  49      -0.00000     0.00000    -0.12645     0.00000    -0.00000     0.00000
  50      -0.00000     0.00000     0.04805     0.00000    -0.00000    -0.00000
  51       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  52       0.05283     0.00000     0.00000     0.00611     0.00000     0.00000
  53       0.30328     0.00000     0.00000     0.10604     0.00000     0.00000
  54       0.28029     0.00000    -0.00000     0.12645     0.00000     0.00000
  55      -0.07629     0.00000    -0.00000    -0.04805     0.00000    -0.00000
  56       0.00000     0.23549     0.00000     0.00000     0.00000     0.00000
  57      -0.00000     0.00000     0.01462     0.00000     0.06141     0.48732
  58       0.04901     0.00000     0.00000     0.01462     0.00000     0.00000
  59      -0.00000     0.00000     0.05493     0.00000     0.06131     0.48692
  60       0.12555     0.00000     0.00000     0.05493     0.00000     0.00000

           49          50          51          52          53          54  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.00000     0.00000     0.00000     0.00000     0.00116     0.00066
   2      -0.00000     0.00002     0.00000     0.00116     0.04688     0.01682
   3       0.00000     0.00000     0.00000    -0.00066    -0.01682     0.01248
   4       0.00000    -0.00005     0.00000     0.00272     0.06907     0.02713
   5       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
   6      -0.00066     0.00272     0.00000     0.00000     0.00000     0.00000
   7      -0.01682     0.06907     0.00000     0.00000     0.00001     0.00000
   8       0.01248     0.02713     0.00000    -0.00000    -0.00000     0.00000
   9       0.02713    -0.09229     0.00000     0.00000     0.00002     0.00000
  10       0.00000     0.00000     0.01908     0.00000     0.00000     0.00000
  11       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  12       0.00009     0.00039     0.00000     0.00000     0.00174     0.00152
  13       0.00002    -0.00019     0.00000    -0.00000    -0.00152    -0.00079
  14      -0.00019    -0.00082     0.00000     0.00001     0.00307     0.00277
  15       0.00000     0.00000     0.00006     0.00000     0.00000     0.00000
  16      -0.00000     0.00001     0.00000     0.00000     0.00000    -0.00000
  17      -0.00152     0.00307     0.00000     0.00000     0.00018    -0.00009
  18      -0.00079     0.00277     0.00000     0.00000     0.00009     0.00002
  19       0.00277    -0.00501     0.00000     0.00000     0.00039    -0.00019
  20       0.00000     0.00000     0.00058     0.00000     0.00000     0.00000
  21       0.00008     0.00034     0.00000     0.00000     0.00000     0.00000
  22       0.00524     0.02165     0.00000     0.00000     0.00002     0.00002
  23       0.00255    -0.00924     0.00000    -0.00000    -0.00002    -0.00001
  24      -0.00924    -0.03340     0.00000     0.00000     0.00006     0.00004
  25       0.00000     0.00000     0.00478     0.00000     0.00000     0.00000
  26      -0.00000     0.00000     0.00000     0.00000     0.00012    -0.00008
  27      -0.00002     0.00006     0.00000     0.00012     0.01305    -0.00524
  28      -0.00001     0.00004     0.00000     0.00008     0.00524     0.00255
  29       0.00004    -0.00014     0.00000     0.00034     0.02165    -0.00924
  30       0.00000     0.00000     0.00001     0.00000     0.00000     0.00000
  31       0.00003     0.00007     0.00000     0.00001     0.00116     0.00144
  32      -0.00144     0.00160     0.00000     0.00000     0.00004    -0.00003
  33       0.02334     0.03404     0.00000     0.00000     0.00000     0.00000
  34      -0.00000     0.00000     0.00000     0.00089     0.02792    -0.02334
  35      -0.04749     0.05283     0.00000     0.00000     0.00000    -0.00000
  36      -0.27266     0.30328     0.00000     0.00000     0.00000    -0.00000
  37      -0.01650     0.28029     0.00000     0.00000     0.00000     0.00000
  38       0.28029    -0.07629     0.00000     0.00000     0.00000    -0.00000
  39       0.00000     0.00000     0.23549     0.00000     0.00000     0.00000
  40       0.00000     0.00000     0.00000     0.00000     0.04284     0.04749
  41       0.00000     0.00000     0.00000     0.04284     0.39315     0.27266
  42       0.00000    -0.00000     0.00000    -0.04749    -0.27266    -0.01650
  43      -0.00000    -0.00000     0.00000     0.05283     0.30328     0.28029
  44       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  45      -0.12645     0.04805     0.00000     0.00000     0.00000    -0.00000
  46       0.00000     0.00000     0.00000     0.00611     0.10604     0.12645
  47      -0.00000    -0.00000     0.00000     0.00000     0.00000     0.00000
  48       0.00000    -0.00000     0.00000     0.00000     0.00000     0.00000
  49       1.00000    -0.00000     0.00000     0.00000    -0.00000     0.00000
  50      -0.00000     1.00000     0.00000     0.00000     0.00000     0.00000
  51       0.00000     0.00000     1.00000     0.00000     0.00000     0.00000
  52       0.00000     0.00000     0.00000     1.00000     0.24836     0.00000
  53      -0.00000     0.00000     0.00000     0.24836     1.00000    -0.00000
  54       0.00000     0.00000     0.00000     0.00000    -0.00000     1.00000
  55       0.00000    -0.00000     0.00000     0.00000     0.00000    -0.00000
  56       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  57       0.45887     0.07655     0.00000     0.00000     0.00000     0.00000
  58      -0.00000     0.00000     0.00000     0.06141     0.48732    -0.45887
  59      -0.13400    -0.44525     0.00000     0.00000     0.00000     0.00000
  60      -0.00000     0.00000     0.00000     0.06131     0.48692     0.13400

           55          56          57          58          59          60  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.00272     0.00000     0.00000     0.00074     0.00000     0.00006
   2      -0.06907     0.00000     0.00002     0.02468     0.00000     0.00481
   3       0.02713     0.00000     0.00001    -0.02186    -0.00000    -0.00066
   4      -0.09229     0.00000    -0.00005     0.02972    -0.00000     0.00811
   5       0.00000     0.01908     0.00000     0.00000     0.00000     0.00000
   6      -0.00000     0.00000     0.00074     0.00000     0.00006     0.00000
   7      -0.00002     0.00000     0.02468     0.00002     0.00481     0.00000
   8       0.00000     0.00000     0.02186    -0.00001     0.00066     0.00000
   9      -0.00005     0.00000    -0.02972     0.00005    -0.00811     0.00000
  10       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  11      -0.00001     0.00000     0.00000     0.00000     0.00000     0.00000
  12      -0.00307     0.00000     0.00078     0.00068     0.00001     0.00019
  13       0.00277     0.00000     0.00005    -0.00085    -0.00000    -0.00012
  14      -0.00501     0.00000    -0.00148     0.00099    -0.00002     0.00038
  15       0.00000     0.00058     0.00000     0.00000     0.00000     0.00000
  16      -0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  17      -0.00039     0.00000     0.00068     0.00078     0.00019     0.00001
  18      -0.00019     0.00000     0.00085    -0.00005     0.00012     0.00000
  19      -0.00082     0.00000    -0.00099     0.00148    -0.00038     0.00002
  20       0.00000     0.00006     0.00000     0.00000     0.00000     0.00000
  21      -0.00000     0.00000     0.00076     0.00000     0.00000     0.00000
  22      -0.00006     0.00000     0.02519     0.00002     0.00083     0.00000
  23       0.00004     0.00000     0.00476    -0.00003    -0.00039    -0.00000
  24      -0.00014     0.00000    -0.03729     0.00005    -0.00153     0.00000
  25       0.00000     0.00001     0.00000     0.00000     0.00000     0.00000
  26      -0.00034     0.00000     0.00000     0.00076     0.00000     0.00000
  27      -0.02165     0.00000     0.00002     0.02519     0.00000     0.00083
  28      -0.00924     0.00000     0.00003    -0.00476     0.00000     0.00039
  29      -0.03340     0.00000    -0.00005     0.03729    -0.00000     0.00153
  30       0.00000     0.00478     0.00000     0.00000     0.00000     0.00000
  31      -0.00160     0.00000     0.00030     0.00024     0.00000     0.00025
  32      -0.00007     0.00000     0.00024     0.00030     0.00025     0.00000
  33      -0.00000     0.00000     0.08944     0.00000     0.00264     0.00000
  34      -0.03404     0.00000     0.00000     0.08944     0.00000     0.00264
  35      -0.00000     0.00000     0.00561     0.00000     0.00577     0.00000
  36      -0.00000     0.00000     0.09966     0.00000     0.10177     0.00000
  37      -0.00000     0.00000     0.11842    -0.00000     0.03569     0.00000
  38      -0.00000     0.00000    -0.04901     0.00000    -0.12555     0.00000
  39       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  40      -0.05283     0.00000     0.00000     0.00561     0.00000     0.00577
  41      -0.30328     0.00000     0.00000     0.09966     0.00000     0.10177
  42       0.28029     0.00000     0.00000    -0.11842    -0.00000    -0.03569
  43      -0.07629     0.00000    -0.00000     0.04901    -0.00000     0.12555
  44       0.00000     0.23549     0.00000     0.00000     0.00000     0.00000
  45      -0.00000     0.00000     0.01462     0.00000     0.05493     0.00000
  46      -0.04805     0.00000     0.00000     0.01462     0.00000     0.05493
  47       0.00000     0.00000     0.06141     0.00000     0.06131     0.00000
  48      -0.00000     0.00000     0.48732     0.00000     0.48692     0.00000
  49       0.00000     0.00000     0.45887    -0.00000    -0.13400    -0.00000
  50      -0.00000     0.00000     0.07655     0.00000    -0.44525     0.00000
  51       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  52       0.00000     0.00000     0.00000     0.06141     0.00000     0.06131
  53       0.00000     0.00000     0.00000     0.48732     0.00000     0.48692
  54      -0.00000     0.00000     0.00000    -0.45887     0.00000     0.13400
  55       1.00000     0.00000    -0.00000    -0.07655    -0.00000     0.44525
  56       0.00000     1.00000     0.00000     0.00000     0.00000     0.00000
  57      -0.00000     0.00000     1.00000     0.00000     0.14897     0.00000
  58      -0.07655     0.00000     0.00000     1.00000     0.00000     0.14897
  59      -0.00000     0.00000     0.14897     0.00000     1.00000     0.00000
  60       0.44525     0.00000     0.00000     0.14897     0.00000     1.00000

      Non-variational initial energy
      ------------------------------

 Total energy =    -379.429467
 1-e energy   =   -1401.451096
 2-e energy   =     576.084617
 HOMO         =      -0.037645
 LUMO         =       0.163723


      Symmetry analysis of molecular orbitals - initial
      -------------------------------------------------

  Numbering of irreducible representations: 

     1 ag          2 au          3 bg          4 bu      

  Orbital symmetries:

     1 ag          2 bu          3 ag          4 bu          5 bu      
     6 ag          7 bu          8 ag          9 bu         10 ag      
    11 ag         12 bu         13 ag         14 bu         15 bu      
    16 ag         17 ag         18 bu         19 ag         20 ag      
    21 bu         22 bu         23 ag         24 bu         25 bu      
    26 ag         27 bu         28 au         29 bu         30 ag      
    31 ag         32 bg         33 au         34 bg         35 bg      
    36 au         37 au         38 bg         39 au         40 bg      
    41 ag         42 bu         43 bu         44 ag         45 bu      


 Starting SCF solution at       2.3s



 ----------------------------------------------
         Quadratically convergent ROHF

 Convergence threshold     :          1.000E-04
 Maximum no. of iterations :           30
 Final Fock-matrix accuracy:          1.000E-07
 ----------------------------------------------


 Integral file          = ./dvb.aoints.0
 Record size in doubles =    65536    No. of integs per rec  =    43688
 Max. records in memory =       19    Max. records in file   = ********
 No. of bits per label  =        8    No. of bits per value  =       64


 #quartets = 1.167D+05 #integrals = 3.473D+05 #direct =  0.0% #cached =100.0%


              iter       energy          gnorm     gmax       time
             ----- ------------------- --------- --------- --------
                 1     -379.7024515658  7.56D-01  1.81D-01      2.4
                 2     -379.7670218883  1.53D-01  4.40D-02      2.4
                 3     -379.7689554257  6.43D-03  2.31D-03      2.5
                 4     -379.7689624910  3.37D-05  9.25D-06      2.6


       Final RHF  results 
       ------------------ 

         Total SCF energy =   -379.768962491035
      One-electron energy =  -1400.222183962455
      Two-electron energy =    574.516209303975
 Nuclear repulsion energy =    445.937012167446

        Time for solution =      1.9s



       Symmetry analysis of molecular orbitals - final
       -----------------------------------------------

  Numbering of irreducible representations: 

     1 ag          2 au          3 bg          4 bu      

  Orbital symmetries:

     1 bu          2 ag          3 bu          4 ag          5 bu      
     6 ag          7 bu          8 ag          9 bu         10 ag      
    11 ag         12 bu         13 ag         14 bu         15 bu      
    16 ag         17 ag         18 bu         19 ag         20 ag      
    21 bu         22 bu         23 bu         24 ag         25 bu      
    26 bu         27 ag         28 au         29 bu         30 ag      
    31 ag         32 bg         33 au         34 bg         35 bg      
    36 au         37 au         38 bg         39 au         40 bg      
    41 ag         42 bu         43 ag         44 bu         45 ag      

             Final eigenvalues
             -----------------

              1      
    1  -11.0406
    2  -11.0405
    3  -11.0316
    4  -11.0316
    5  -11.0290
    6  -11.0288
    7  -11.0286
    8  -11.0286
    9  -11.0175
   10  -11.0175
   11   -1.0903
   12   -1.0203
   13   -0.9749
   14   -0.9503
   15   -0.9096
   16   -0.7999
   17   -0.7628
   18   -0.7276
   19   -0.6968
   20   -0.6281
   21   -0.6057
   22   -0.5729
   23   -0.5536
   24   -0.5532
   25   -0.5254
   26   -0.4967
   27   -0.4925
   28   -0.4637
   29   -0.4464
   30   -0.4217
   31   -0.4156
   32   -0.3770
   33   -0.3151
   34   -0.2784
   35   -0.2222
   36    0.1990
   37    0.2685
   38    0.3088
   39    0.3971
   40    0.5218
   41    0.5650
   42    0.5756
   43    0.6216
   44    0.6258
   45    0.6582

                       ROHF Final Molecular Orbital Analysis
                       -------------------------------------

 Vector    1  Occ=2.000000D+00  E=-1.104059D+01  Symmetry=bu
              MO Center= -2.9D-14, -2.5D-13,  7.4D-20, r^2= 2.1D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     1      0.701483   1 C  s                 6     -0.701483   2 C  s         

 Vector    2  Occ=2.000000D+00  E=-1.104052D+01  Symmetry=ag
              MO Center=  3.3D-14,  1.5D-13,  6.2D-19, r^2= 2.1D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     1      0.701542   1 C  s                 6      0.701542   2 C  s         

 Vector    3  Occ=2.000000D+00  E=-1.103159D+01  Symmetry=bu
              MO Center=  2.1D-14,  1.0D-13, -8.9D-33, r^2= 8.6D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    35      0.701357  11 C  s                40     -0.701357  12 C  s         

 Vector    4  Occ=2.000000D+00  E=-1.103159D+01  Symmetry=ag
              MO Center= -1.5D-12,  1.7D-12,  4.7D-18, r^2= 8.6D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    35      0.701320  11 C  s                40      0.701320  12 C  s         

 Vector    5  Occ=2.000000D+00  E=-1.102896D+01  Symmetry=bu
              MO Center= -8.9D-15,  7.6D-16, -3.8D-33, r^2= 2.0D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    21      0.594681   5 C  s                26     -0.594681   6 C  s         
    11      0.372717   3 C  s                16     -0.372717   4 C  s         

 Vector    6  Occ=2.000000D+00  E=-1.102883D+01  Symmetry=ag
              MO Center= -5.5D-15,  9.9D-17, -1.8D-32, r^2= 2.0D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    21      0.636098   5 C  s                26      0.636098   6 C  s         
    11      0.296533   3 C  s                16      0.296533   4 C  s         

 Vector    7  Occ=2.000000D+00  E=-1.102861D+01  Symmetry=bu
              MO Center=  5.9D-15, -2.6D-14, -4.4D-32, r^2= 2.0D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    11      0.594365   3 C  s                16     -0.594365   4 C  s         
    21     -0.372219   5 C  s                26      0.372219   6 C  s         

 Vector    8  Occ=2.000000D+00  E=-1.102859D+01  Symmetry=ag
              MO Center= -2.3D-15,  1.9D-15, -9.1D-19, r^2= 2.0D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    11      0.635860   3 C  s                16      0.635860   4 C  s         
    21     -0.296035   5 C  s                26     -0.296035   6 C  s         

 Vector    9  Occ=2.000000D+00  E=-1.101748D+01  Symmetry=bu
              MO Center=  6.1D-11, -6.4D-10, -4.1D-18, r^2= 1.5D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    47      0.701435  15 C  s                52     -0.701435  16 C  s         

 Vector   10  Occ=2.000000D+00  E=-1.101748D+01  Symmetry=ag
              MO Center= -6.0D-11,  6.4D-10,  7.0D-30, r^2= 1.5D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    47      0.701435  15 C  s                52      0.701435  16 C  s         

 Vector   11  Occ=2.000000D+00  E=-1.090299D+00  Symmetry=ag
              MO Center=  3.8D-16, -5.7D-16, -3.2D-30, r^2= 3.0D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     2      0.275368   1 C  s                 7      0.275368   2 C  s         
    12      0.247273   3 C  s                17      0.247273   4 C  s         
    22      0.247126   5 C  s                27      0.247126   6 C  s         

 Vector   12  Occ=2.000000D+00  E=-1.020254D+00  Symmetry=bu
              MO Center= -6.8D-16, -1.8D-14,  5.5D-17, r^2= 7.9D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    36      0.298699  11 C  s                41     -0.298699  12 C  s         
     2     -0.270806   1 C  s                 7      0.270806   2 C  s         
    48      0.213652  15 C  s                53     -0.213652  16 C  s         

 Vector   13  Occ=2.000000D+00  E=-9.749254D-01  Symmetry=ag
              MO Center=  3.5D-15,  3.7D-15, -5.6D-18, r^2= 1.1D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    36      0.314473  11 C  s                41      0.314473  12 C  s         
    48      0.310076  15 C  s                53      0.310076  16 C  s         

 Vector   14  Occ=2.000000D+00  E=-9.503033D-01  Symmetry=bu
              MO Center=  1.3D-15, -5.7D-15, -1.2D-16, r^2= 3.1D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    12      0.357133   3 C  s                17     -0.357133   4 C  s         
    22      0.325008   5 C  s                27     -0.325008   6 C  s         

 Vector   15  Occ=2.000000D+00  E=-9.096345D-01  Symmetry=bu
              MO Center=  3.5D-16,  7.5D-15,  2.3D-32, r^2= 8.8D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    48      0.292220  15 C  s                53     -0.292220  16 C  s         
     2      0.279079   1 C  s                 7     -0.279079   2 C  s         
    22     -0.200698   5 C  s                27      0.200698   6 C  s         

 Vector   16  Occ=2.000000D+00  E=-7.998830D-01  Symmetry=ag
              MO Center= -2.9D-15,  1.9D-15,  2.4D-17, r^2= 8.5D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    48      0.239926  15 C  s                53      0.239926  16 C  s         
    22      0.229429   5 C  s                27      0.229429   6 C  s         
     2     -0.212930   1 C  s                 7     -0.212930   2 C  s         
    14     -0.159170   3 C  py               19      0.159170   4 C  py        
    36     -0.159504  11 C  s                41     -0.159504  12 C  s         

 Vector   17  Occ=2.000000D+00  E=-7.628268D-01  Symmetry=ag
              MO Center=  3.7D-15,  2.4D-15, -2.0D-18, r^2= 5.0D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    12      0.324855   3 C  s                17      0.324855   4 C  s         
     3      0.189935   1 C  px                8     -0.189935   2 C  px        
    22     -0.180804   5 C  s                27     -0.180804   6 C  s         
    31      0.173636   7 H  s                32      0.173636   8 H  s         
    24      0.169743   5 C  py               29     -0.169743   6 C  py        

 Vector   18  Occ=2.000000D+00  E=-7.276317D-01  Symmetry=bu
              MO Center= -8.5D-17,  2.4D-15, -9.9D-18, r^2= 1.2D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    36      0.297522  11 C  s                41     -0.297522  12 C  s         
    48     -0.248206  15 C  s                53      0.248206  16 C  s         
    45      0.174840  13 H  s                46     -0.174840  14 H  s         
    57     -0.163892  17 H  s                58      0.163892  18 H  s         

 Vector   19  Occ=2.000000D+00  E=-6.967772D-01  Symmetry=ag
              MO Center= -9.3D-16,  0.0D+00, -1.1D-17, r^2= 7.9D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    23      0.194626   5 C  px               28     -0.194626   6 C  px        
    36      0.187351  11 C  s                41      0.187351  12 C  s         
    13      0.174310   3 C  px               18     -0.174310   4 C  px        
     2     -0.170808   1 C  s                 7     -0.170808   2 C  s         
    33      0.168856   9 H  s                34      0.168856  10 H  s         

 Vector   20  Occ=2.000000D+00  E=-6.280522D-01  Symmetry=ag
              MO Center=  5.1D-15, -3.5D-14,  7.8D-17, r^2= 9.3D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    49      0.204700  15 C  px               54     -0.204700  16 C  px        
    38      0.183205  11 C  py               43     -0.183205  12 C  py        
    57      0.178852  17 H  s                58      0.178852  18 H  s         
    45     -0.152733  13 H  s                46     -0.152733  14 H  s         

 Vector   21  Occ=2.000000D+00  E=-6.056780D-01  Symmetry=bu
              MO Center= -1.9D-15,  5.6D-14, -3.4D-18, r^2= 1.0D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    37      0.215048  11 C  px               42      0.215048  12 C  px        
    50      0.201798  15 C  py               55      0.201798  16 C  py        
    14      0.181913   3 C  py               19      0.181913   4 C  py        
    59     -0.179094  19 H  s                60      0.179094  20 H  s         
    45     -0.165299  13 H  s                46      0.165299  14 H  s         

 Vector   22  Occ=2.000000D+00  E=-5.729426D-01  Symmetry=bu
              MO Center= -1.0D-15,  2.1D-15,  1.3D-32, r^2= 7.0D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    33      0.234899   9 H  s                34     -0.234899  10 H  s         
    31     -0.225759   7 H  s                32      0.225759   8 H  s         
     2      0.223491   1 C  s                 7     -0.223491   2 C  s         
    13     -0.220802   3 C  px               18     -0.220802   4 C  px        
    24     -0.179464   5 C  py               29     -0.179464   6 C  py        

 Vector   23  Occ=2.000000D+00  E=-5.536035D-01  Symmetry=bu
              MO Center= -2.3D-17,  1.9D-15, -4.2D-33, r^2= 8.9D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    49      0.252837  15 C  px               54      0.252837  16 C  px        
    23      0.248952   5 C  px               28      0.248952   6 C  px        
     3     -0.221990   1 C  px                8     -0.221990   2 C  px        
    57      0.222772  17 H  s                58     -0.222772  18 H  s         
    38      0.178895  11 C  py               43      0.178895  12 C  py        

 Vector   24  Occ=2.000000D+00  E=-5.531658D-01  Symmetry=ag
              MO Center= -5.5D-16, -2.7D-14, -1.5D-18, r^2= 1.5D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    50      0.336239  15 C  py               55     -0.336239  16 C  py        
    59     -0.268357  19 H  s                60     -0.268357  20 H  s         
    37      0.248998  11 C  px               42     -0.248998  12 C  px        
    45     -0.151363  13 H  s                46     -0.151363  14 H  s         

 Vector   25  Occ=2.000000D+00  E=-5.253606D-01  Symmetry=bu
              MO Center= -5.8D-16, -9.2D-16,  8.6D-34, r^2= 4.4D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    13      0.299404   3 C  px               18      0.299404   4 C  px        
    31      0.258504   7 H  s                32     -0.258504   8 H  s         
    24     -0.232845   5 C  py               29     -0.232845   6 C  py        
    33      0.223596   9 H  s                34     -0.223596  10 H  s         
    23      0.179046   5 C  px               28      0.179046   6 C  px        

 Vector   26  Occ=2.000000D+00  E=-4.966990D-01  Symmetry=bu
              MO Center=  3.3D-15,  1.0D-14,  2.3D-17, r^2= 8.9D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    50     -0.238942  15 C  py               55     -0.238942  16 C  py        
    14      0.222972   3 C  py               19      0.222972   4 C  py        
    37     -0.201999  11 C  px               42     -0.201999  12 C  px        
    38      0.188759  11 C  py               43      0.188759  12 C  py        
    24     -0.184876   5 C  py               29     -0.184876   6 C  py        

 Vector   27  Occ=2.000000D+00  E=-4.925280D-01  Symmetry=ag
              MO Center= -5.2D-15, -1.4D-14, -4.3D-30, r^2= 1.2D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    49      0.296131  15 C  px               54     -0.296131  16 C  px        
    57      0.273185  17 H  s                58      0.273185  18 H  s         
    37     -0.209362  11 C  px               42      0.209362  12 C  px        
    45      0.202959  13 H  s                46      0.202959  14 H  s         
    31     -0.156851   7 H  s                32     -0.156851   8 H  s         

 Vector   28  Occ=2.000000D+00  E=-4.637308D-01  Symmetry=au
              MO Center=  5.8D-16,  8.3D-17, -7.4D-17, r^2= 3.6D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     5      0.331504   1 C  pz               10      0.331504   2 C  pz        
    15      0.302831   3 C  pz               20      0.302831   4 C  pz        
    25      0.301868   5 C  pz               30      0.301868   6 C  pz        
    39      0.165577  11 C  pz               44      0.165577  12 C  pz        

 Vector   29  Occ=2.000000D+00  E=-4.464302D-01  Symmetry=bu
              MO Center= -6.8D-16, -7.8D-16, -4.5D-17, r^2= 1.2D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    45      0.257252  13 H  s                46     -0.257252  14 H  s         
     4      0.243719   1 C  py                9      0.243719   2 C  py        
    57      0.226298  17 H  s                58     -0.226298  18 H  s         
    37     -0.214534  11 C  px               42     -0.214534  12 C  px        
    59     -0.211967  19 H  s                60      0.211967  20 H  s         

 Vector   30  Occ=2.000000D+00  E=-4.216550D-01  Symmetry=ag
              MO Center=  3.3D-15,  8.0D-15,  4.6D-19, r^2= 5.7D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    14     -0.268212   3 C  py               19      0.268212   4 C  py        
     4      0.260257   1 C  py                9     -0.260257   2 C  py        
    33     -0.253899   9 H  s                34     -0.253899  10 H  s         
    38      0.232935  11 C  py               43     -0.232935  12 C  py        
    24      0.223473   5 C  py               29     -0.223473   6 C  py        

 Vector   31  Occ=2.000000D+00  E=-4.156220D-01  Symmetry=ag
              MO Center=  5.1D-16, -1.8D-15,  3.4D-18, r^2= 6.3D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     3      0.278853   1 C  px                8     -0.278853   2 C  px        
    23      0.269038   5 C  px               28     -0.269038   6 C  px        
    31     -0.251625   7 H  s                32     -0.251625   8 H  s         
    13     -0.210356   3 C  px               18      0.210356   4 C  px        
    45     -0.183775  13 H  s                46     -0.183775  14 H  s         

 Vector   32  Occ=2.000000D+00  E=-3.769631D-01  Symmetry=bg
              MO Center= -1.1D-16,  1.8D-14,  3.1D-17, r^2= 8.6D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    39      0.383213  11 C  pz               44     -0.383213  12 C  pz        
     5     -0.318675   1 C  pz               10      0.318675   2 C  pz        
    51      0.306666  15 C  pz               56     -0.306666  16 C  pz        

 Vector   33  Occ=2.000000D+00  E=-3.151268D-01  Symmetry=au
              MO Center=  2.5D-14, -1.7D-14, -1.9D-17, r^2= 1.1D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    51      0.426295  15 C  pz               56      0.426295  16 C  pz        
    39      0.415175  11 C  pz               44      0.415175  12 C  pz        
    15     -0.164508   3 C  pz               20     -0.164508   4 C  pz        
    25     -0.164934   5 C  pz               30     -0.164934   6 C  pz        

 Vector   34  Occ=2.000000D+00  E=-2.783651D-01  Symmetry=bg
              MO Center= -2.6D-14,  3.6D-15,  4.0D-17, r^2= 2.7D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    15      0.459816   3 C  pz               20     -0.459816   4 C  pz        
    25      0.461493   5 C  pz               30     -0.461493   6 C  pz        

 Vector   35  Occ=2.000000D+00  E=-2.221904D-01  Symmetry=bg
              MO Center= -3.5D-17, -3.9D-15,  1.2D-17, r^2= 7.2D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     5      0.417993   1 C  pz               10     -0.417993   2 C  pz        
    51      0.358184  15 C  pz               56     -0.358184  16 C  pz        
    15      0.231889   3 C  pz               20     -0.231889   4 C  pz        
    25     -0.232000   5 C  pz               30      0.232000   6 C  pz        
    39      0.218349  11 C  pz               44     -0.218349  12 C  pz        

 Vector   36  Occ=0.000000D+00  E= 1.989924D-01  Symmetry=au
              MO Center= -1.1D-16, -5.3D-14,  1.3D-16, r^2= 7.3D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     5      0.471534   1 C  pz               10      0.471534   2 C  pz        
    51     -0.414928  15 C  pz               56     -0.414928  16 C  pz        
    25     -0.278569   5 C  pz               30     -0.278569   6 C  pz        
    15     -0.249973   3 C  pz               20     -0.249973   4 C  pz        
    39      0.246934  11 C  pz               44      0.246934  12 C  pz        

 Vector   37  Occ=0.000000D+00  E= 2.685138D-01  Symmetry=au
              MO Center=  2.3D-16, -2.0D-16,  2.1D-19, r^2= 2.7D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    15      0.578558   3 C  pz               20      0.578558   4 C  pz        
    25     -0.558106   5 C  pz               30     -0.558106   6 C  pz        

 Vector   38  Occ=0.000000D+00  E= 3.088252D-01  Symmetry=bg
              MO Center=  1.7D-16,  5.5D-14,  1.9D-17, r^2= 1.1D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    51     -0.531237  15 C  pz               56      0.531237  16 C  pz        
    39      0.524391  11 C  pz               44     -0.524391  12 C  pz        
    15      0.225543   3 C  pz               20     -0.225543   4 C  pz        
    25     -0.220434   5 C  pz               30      0.220434   6 C  pz        

 Vector   39  Occ=0.000000D+00  E= 3.970770D-01  Symmetry=au
              MO Center=  4.2D-17, -2.7D-15,  5.5D-18, r^2= 8.4D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    39      0.535070  11 C  pz               44      0.535070  12 C  pz        
     5     -0.473494   1 C  pz               10     -0.473494   2 C  pz        
    51     -0.407351  15 C  pz               56     -0.407351  16 C  pz        
    25      0.186775   5 C  pz               30      0.186775   6 C  pz        
    15      0.161862   3 C  pz               20      0.161862   4 C  pz        

 Vector   40  Occ=0.000000D+00  E= 5.217566D-01  Symmetry=bg
              MO Center=  9.7D-17,  1.8D-16,  2.6D-17, r^2= 3.8D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     5      0.538711   1 C  pz               10     -0.538711   2 C  pz        
    15     -0.469482   3 C  pz               20      0.469482   4 C  pz        
    25      0.471487   5 C  pz               30     -0.471487   6 C  pz        
    39      0.278750  11 C  pz               44     -0.278750  12 C  pz        
    51     -0.158475  15 C  pz               56      0.158475  16 C  pz        

 Vector   41  Occ=0.000000D+00  E= 5.650160D-01  Symmetry=ag
              MO Center=  3.8D-15, -4.1D-14,  1.8D-17, r^2= 8.7D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    33      0.434798   9 H  s                34      0.434798  10 H  s         
    31      0.420942   7 H  s                32      0.420942   8 H  s         
     2     -0.380055   1 C  s                 7     -0.380055   2 C  s         
    59      0.353828  19 H  s                60      0.353828  20 H  s         
    38      0.323940  11 C  py               43     -0.323940  12 C  py        

 Vector   42  Occ=0.000000D+00  E= 5.755620D-01  Symmetry=bu
              MO Center=  3.3D-15,  5.1D-15, -3.4D-17, r^2= 1.0D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    45      0.448702  13 H  s                46     -0.448702  14 H  s         
    13      0.355546   3 C  px               18      0.355546   4 C  px        
    37      0.350909  11 C  px               42      0.350909  12 C  px        
    57     -0.321562  17 H  s                58      0.321562  18 H  s         
    31     -0.318904   7 H  s                32      0.318904   8 H  s         

 Vector   43  Occ=0.000000D+00  E= 6.215596D-01  Symmetry=ag
              MO Center=  5.3D-15, -1.2D-15, -4.4D-17, r^2= 1.2D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    45      0.589566  13 H  s                46      0.589566  14 H  s         
    12      0.397886   3 C  s                17      0.397886   4 C  s         
    36     -0.394579  11 C  s                41     -0.394579  12 C  s         
    57     -0.381363  17 H  s                58     -0.381363  18 H  s         
    37      0.350692  11 C  px               42     -0.350692  12 C  px        

 Vector   44  Occ=0.000000D+00  E= 6.258003D-01  Symmetry=bu
              MO Center= -8.2D-15,  2.4D-14,  7.5D-17, r^2= 8.4D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    36      0.529760  11 C  s                41     -0.529760  12 C  s         
     4      0.453566   1 C  py                9      0.453566   2 C  py        
    33      0.408895   9 H  s                34     -0.408895  10 H  s         
    59      0.389457  19 H  s                60     -0.389457  20 H  s         
    48     -0.337620  15 C  s                53      0.337620  16 C  s         

 Vector   45  Occ=0.000000D+00  E= 6.582325D-01  Symmetry=ag
              MO Center= -8.6D-16,  6.2D-15, -8.0D-17, r^2= 1.2D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    48      0.683576  15 C  s                53      0.683576  16 C  s         
    22      0.582877   5 C  s                27      0.582877   6 C  s         
    57     -0.541814  17 H  s                58     -0.541814  18 H  s         
    12     -0.457382   3 C  s                17     -0.457382   4 C  s         
    59     -0.330810  19 H  s                60     -0.330810  20 H  s         

 Vector   46  Occ=0.000000D+00  E= 6.593956D-01  Symmetry=bu
              MO Center= -1.2D-14,  5.9D-15,  1.6D-18, r^2= 1.0D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    22      0.611116   5 C  s                27     -0.611116   6 C  s         
    48      0.533506  15 C  s                53     -0.533506  16 C  s         
     2      0.492301   1 C  s                 7     -0.492301   2 C  s         
    12     -0.461393   3 C  s                17      0.461393   4 C  s         
    57     -0.460445  17 H  s                58      0.460445  18 H  s         

 Vector   47  Occ=0.000000D+00  E= 6.771779D-01  Symmetry=bu
              MO Center=  1.4D-14,  3.7D-14,  2.4D-17, r^2= 9.1D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    31      0.598268   7 H  s                32     -0.598268   8 H  s         
    36     -0.467282  11 C  s                41      0.467282  12 C  s         
    45      0.438025  13 H  s                46     -0.438025  14 H  s         
    12     -0.361066   3 C  s                17      0.361066   4 C  s         
    59      0.328681  19 H  s                60     -0.328681  20 H  s         

 Vector   48  Occ=0.000000D+00  E= 6.941860D-01  Symmetry=ag
              MO Center= -2.4D-16, -3.9D-16, -1.5D-17, r^2= 7.3D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     2      0.796664   1 C  s                 7      0.796664   2 C  s         
    36     -0.570541  11 C  s                41     -0.570541  12 C  s         
    22     -0.469182   5 C  s                27     -0.469182   6 C  s         
    12     -0.444286   3 C  s                17     -0.444286   4 C  s         
    48      0.390409  15 C  s                53      0.390409  16 C  s         

 Vector   49  Occ=0.000000D+00  E= 7.067096D-01  Symmetry=bu
              MO Center= -3.6D-15, -3.8D-14, -5.3D-19, r^2= 1.1D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    48      0.702329  15 C  s                53     -0.702329  16 C  s         
    57     -0.514860  17 H  s                58      0.514860  18 H  s         
    33      0.488194   9 H  s                34     -0.488194  10 H  s         
    36     -0.430466  11 C  s                41      0.430466  12 C  s         
    22     -0.425207   5 C  s                27      0.425207   6 C  s         

 Vector   50  Occ=0.000000D+00  E= 7.401371D-01  Symmetry=ag
              MO Center=  1.3D-15, -2.1D-15,  1.8D-17, r^2= 1.0D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    12      0.727765   3 C  s                17      0.727765   4 C  s         
    22     -0.614468   5 C  s                27     -0.614468   6 C  s         
    59     -0.456852  19 H  s                60     -0.456852  20 H  s         
    48      0.397621  15 C  s                53      0.397621  16 C  s         
    50     -0.372517  15 C  py               55      0.372517  16 C  py        

 Vector   51  Occ=0.000000D+00  E= 8.022252D-01  Symmetry=ag
              MO Center=  4.7D-16,  8.6D-16, -1.7D-17, r^2= 6.8D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     4      0.586839   1 C  py                9     -0.586839   2 C  py        
    36     -0.485996  11 C  s                41     -0.485996  12 C  s         
     2     -0.462721   1 C  s                 7     -0.462721   2 C  s         
    13     -0.446670   3 C  px               18      0.446670   4 C  px        
    49     -0.358149  15 C  px               54      0.358149  16 C  px        

 Vector   52  Occ=0.000000D+00  E= 8.256549D-01  Symmetry=bu
              MO Center=  3.1D-15, -5.8D-15, -1.6D-17, r^2= 7.8D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    12      0.642782   3 C  s                17     -0.642782   4 C  s         
     3     -0.555346   1 C  px                8     -0.555346   2 C  px        
    50      0.490164  15 C  py               55      0.490164  16 C  py        
    24     -0.479529   5 C  py               29     -0.479529   6 C  py        
    59      0.356459  19 H  s                60     -0.356459  20 H  s         

 Vector   53  Occ=0.000000D+00  E= 8.606143D-01  Symmetry=ag
              MO Center= -5.7D-16, -2.7D-15, -3.3D-18, r^2= 5.6D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    13      0.531368   3 C  px               18     -0.531368   4 C  px        
    23     -0.518376   5 C  px               28      0.518376   6 C  px        
    33      0.509444   9 H  s                34      0.509444  10 H  s         
    31     -0.441690   7 H  s                32     -0.441690   8 H  s         
    24      0.395281   5 C  py               29     -0.395281   6 C  py        

 Vector   54  Occ=0.000000D+00  E= 8.877568D-01  Symmetry=bu
              MO Center= -1.2D-15, -5.2D-16, -2.0D-17, r^2= 5.2D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    14      0.716776   3 C  py               19      0.716776   4 C  py        
    22      0.610590   5 C  s                27     -0.610590   6 C  s         
    36     -0.434047  11 C  s                41      0.434047  12 C  s         
    24      0.382161   5 C  py               29      0.382161   6 C  py        
     2     -0.361718   1 C  s                 7      0.361718   2 C  s         

 Vector   55  Occ=0.000000D+00  E= 9.210085D-01  Symmetry=bu
              MO Center= -1.3D-15,  1.4D-15, -1.7D-17, r^2= 1.0D+01
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     2      0.648636   1 C  s                 7     -0.648636   2 C  s         
    49     -0.507370  15 C  px               54     -0.507370  16 C  px        
    38      0.482570  11 C  py               43      0.482570  12 C  py        
    23     -0.393564   5 C  px               28     -0.393564   6 C  px        
    57      0.345389  17 H  s                58     -0.345389  18 H  s         

 Vector   56  Occ=0.000000D+00  E= 9.399496D-01  Symmetry=ag
              MO Center=  1.4D-17,  3.7D-15, -5.4D-18, r^2= 9.1D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    37      0.556681  11 C  px               42     -0.556681  12 C  px        
    50     -0.539847  15 C  py               55      0.539847  16 C  py        
    14      0.392199   3 C  py               19     -0.392199   4 C  py        
     4     -0.359948   1 C  py                9      0.359948   2 C  py        
    24      0.326779   5 C  py               29     -0.326779   6 C  py        

 Vector   57  Occ=0.000000D+00  E= 9.902851D-01  Symmetry=ag
              MO Center= -2.0D-15, -1.7D-14, -1.5D-19, r^2= 9.4D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    38      0.680160  11 C  py               43     -0.680160  12 C  py        
    49     -0.583682  15 C  px               54      0.583682  16 C  px        
    24     -0.429950   5 C  py               29      0.429950   6 C  py        
     4     -0.411894   1 C  py                9      0.411894   2 C  py        
    14     -0.365147   3 C  py               19      0.365147   4 C  py        

 Vector   58  Occ=0.000000D+00  E= 1.027265D+00  Symmetry=bu
              MO Center=  1.3D-15,  1.7D-14, -4.6D-17, r^2= 9.5D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
    37      0.608350  11 C  px               42      0.608350  12 C  px        
    50     -0.536814  15 C  py               55     -0.536814  16 C  py        
    48     -0.526962  15 C  s                53      0.526962  16 C  s         
     3     -0.468612   1 C  px                8     -0.468612   2 C  px        
    38     -0.458225  11 C  py               43     -0.458225  12 C  py        

 Vector   59  Occ=0.000000D+00  E= 1.107700D+00  Symmetry=ag
              MO Center= -2.8D-16,  1.8D-15, -1.8D-18, r^2= 5.1D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     3      0.712025   1 C  px                8     -0.712025   2 C  px        
    14     -0.548009   3 C  py               19      0.548009   4 C  py        
    23     -0.444243   5 C  px               28      0.444243   6 C  px        
    24     -0.423224   5 C  py               29      0.423224   6 C  py        
    37      0.414788  11 C  px               42     -0.414788  12 C  px        

 Vector   60  Occ=0.000000D+00  E= 1.124935D+00  Symmetry=bu
              MO Center= -1.7D-16,  8.1D-16,  4.6D-18, r^2= 3.4D+00
   Bfn.  Coefficient  Atom+Function         Bfn.  Coefficient  Atom+Function  
  ----- ------------  ---------------      ----- ------------  ---------------
     4      0.662430   1 C  py                9      0.662430   2 C  py        
    13     -0.566300   3 C  px               18     -0.566300   4 C  px        
    23      0.494107   5 C  px               28      0.494107   6 C  px        
    22     -0.411545   5 C  s                27      0.411545   6 C  s         
    24     -0.394345   5 C  py               29     -0.394345   6 C  py        


                                 Final MO vectors
                                 ----------------


 global array: scf_init: MOs[1:60,1:60],  handle: -1000 

            1           2           3           4           5           6  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.70148     0.70154    -0.00965     0.00998     0.00164    -0.00338
   2       0.02526     0.02518     0.00379    -0.00374     0.00165    -0.00632
   3      -0.00000     0.00004     0.00047    -0.00047    -0.00361     0.00164
   4      -0.00066    -0.00045     0.00294    -0.00293     0.00008     0.00193
   5       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
   6      -0.70148     0.70154     0.00965     0.00998    -0.00164    -0.00338
   7      -0.02526     0.02518    -0.00379    -0.00374    -0.00165    -0.00632
   8      -0.00000    -0.00004     0.00047     0.00047    -0.00361    -0.00164
   9      -0.00066     0.00045     0.00294     0.00293     0.00008    -0.00193
  10      -0.00000     0.00000     0.00000     0.00000     0.00000    -0.00000
  11       0.00581     0.00321     0.00369    -0.00628     0.37272     0.29653
  12      -0.00477    -0.00461     0.00007    -0.00019     0.00915     0.00633
  13       0.00242     0.00243    -0.00000     0.00006     0.00007     0.00034
  14      -0.00200    -0.00203     0.00003    -0.00001     0.00237     0.00275
  15       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  16      -0.00581     0.00321    -0.00369    -0.00628    -0.37272     0.29653
  17       0.00477    -0.00461    -0.00007    -0.00019    -0.00915     0.00633
  18       0.00242    -0.00243    -0.00000    -0.00006     0.00007    -0.00034
  19      -0.00200     0.00203     0.00003     0.00001     0.00237    -0.00275
  20      -0.00000     0.00000     0.00000     0.00000     0.00000    -0.00000
  21      -0.00580     0.00327    -0.00243    -0.00515     0.59468     0.63610
  22       0.00473    -0.00456     0.00002    -0.00009     0.01884     0.02091
  23      -0.00291     0.00292     0.00002     0.00007    -0.00077    -0.00054
  24      -0.00110     0.00113    -0.00000    -0.00002    -0.00110    -0.00094
  25      -0.00000     0.00000     0.00000     0.00000     0.00000    -0.00000
  26       0.00580     0.00327     0.00243    -0.00515    -0.59468     0.63610
  27      -0.00473    -0.00456    -0.00002    -0.00009    -0.01884     0.02091
  28      -0.00291    -0.00292     0.00002    -0.00007    -0.00077     0.00054
  29      -0.00110    -0.00113    -0.00000     0.00002    -0.00110     0.00094
  30      -0.00000     0.00000     0.00000     0.00000     0.00000    -0.00000
  31       0.00006    -0.00002    -0.00001     0.00001    -0.00239    -0.00203
  32      -0.00006    -0.00002     0.00001     0.00001     0.00239    -0.00203
  33      -0.00005    -0.00003    -0.00009    -0.00009    -0.00393    -0.00436
  34       0.00005    -0.00003     0.00009    -0.00009     0.00393    -0.00436
  35       0.00891    -0.00924     0.70136     0.70132     0.00014     0.00744
  36       0.00449    -0.00455     0.02500     0.02499     0.00007     0.00041
  37       0.00063    -0.00064     0.00051     0.00051    -0.00003     0.00004
  38       0.00288    -0.00292    -0.00065    -0.00065     0.00005    -0.00002
  39       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  40      -0.00891    -0.00924    -0.70136     0.70132    -0.00014     0.00744
  41      -0.00449    -0.00455    -0.02500     0.02499    -0.00007     0.00041
  42       0.00063     0.00064     0.00051    -0.00051    -0.00003    -0.00004
  43       0.00288     0.00292    -0.00065     0.00065     0.00005     0.00002
  44       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  45      -0.00009     0.00009    -0.00478    -0.00478    -0.00000    -0.00013
  46       0.00009     0.00009     0.00478    -0.00478     0.00000    -0.00013
  47       0.00052    -0.00049     0.01784     0.01784    -0.00075    -0.00094
  48      -0.00018     0.00019    -0.00474    -0.00474    -0.00004    -0.00017
  49      -0.00004     0.00004     0.00211     0.00211    -0.00004    -0.00001
  50      -0.00010     0.00010    -0.00239    -0.00239    -0.00003    -0.00011
  51       0.00000     0.00000     0.00000     0.00000     0.00000     0.00000
  52      -0.00052    -0.00049    -0.01784     0.01784     0.00075    -0.00094
  53       0.00018     0.00019     0.00474    -0.00474     0.00004    -0.00017
  54      -0.00004    -0.00004     0.00211    -0.00211    -0.00004     0.00001
  55      -0.00010    -0.00010    -0.00239     0.00239    -0.00003     0.00011
  56      -0.00000     0.00000     0.00000     0.00000     0.00000    -0.00000
  57       0.00010    -0.00010    -0.00006    -0.00006     0.00009     0.00010
  58      -0.00010    -0.00010     0.00006    -0.00006    -0.00009     0.00010
  59       0.00002    -0.00002    -0.00004    -0.00004    -0.00001    -0.00001
  60      -0.00002    -0.00002     0.00004    -0.00004     0.00001    -0.00001

            7           8           9          10          11          12  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.00716    -0.00117    -0.00027     0.00024    -0.10669     0.10127
   2      -0.00713    -0.00230    -0.00027     0.00027     0.27537    -0.27081
   3      -0.00043    -0.00336    -0.00005     0.00005    -0.00529    -0.00407
   4       0.00237     0.00137    -0.00012     0.00012    -0.03821    -0.03177
   5      -0.00000    -0.00000    -0.00000     0.00000     0.00000    -0.00000
   6       0.00716    -0.00117     0.00027     0.00024    -0.10669    -0.10127
   7       0.00713    -0.00230     0.00027     0.00027     0.27537     0.27081
   8      -0.00043     0.00336    -0.00005    -0.00005     0.00529    -0.00407
   9       0.00237    -0.00137    -0.00012    -0.00012     0.03821    -0.03177
  10      -0.00000    -0.00000     0.00000    -0.00000    -0.00000     0.00000
  11       0.59436     0.63586    -0.00026     0.00041    -0.09665     0.03774
  12       0.02429     0.02493     0.00001    -0.00007     0.24727    -0.10004
  13      -0.00099    -0.00071    -0.00001     0.00002    -0.05226     0.02862
  14      -0.00193    -0.00161     0.00006    -0.00002    -0.01452    -0.05673
  15      -0.00000    -0.00000     0.00000    -0.00000    -0.00000     0.00000
  16      -0.59436     0.63586     0.00026     0.00041    -0.09665    -0.03774
  17      -0.02429     0.02493    -0.00001    -0.00007     0.24727     0.10004
  18      -0.00099     0.00071    -0.00001    -0.00002     0.05226     0.02862
  19      -0.00193     0.00161     0.00006     0.00002     0.01452    -0.05673
  20      -0.00000    -0.00000     0.00000    -0.00000    -0.00000     0.00000
  21      -0.37222    -0.29604     0.00107     0.00108    -0.09646    -0.04167
  22      -0.01788    -0.01502     0.00000    -0.00001     0.24713     0.11107
  23      -0.00002    -0.00025     0.00001     0.00000    -0.04467    -0.04526
  24      -0.00292    -0.00308     0.00009     0.00008     0.03103    -0.04400
  25      -0.00000    -0.00000     0.00000    -0.00000    -0.00000     0.00000
  26       0.37222    -0.29604    -0.00107     0.00108    -0.09646     0.04167
  27       0.01788    -0.01502    -0.00000    -0.00001     0.24713    -0.11107
  28      -0.00002     0.00025     0.00001    -0.00000     0.04467    -0.04526
  29      -0.00292     0.00308     0.00009    -0.00008    -0.03103    -0.04400
  30      -0.00000    -0.00000     0.00000    -0.00000    -0.00000     0.00000
  31      -0.00405    -0.00433     0.00000    -0.00000     0.04417    -0.02580
  32       0.00405    -0.00433    -0.00000    -0.00000     0.04417     0.02580
  33       0.00261     0.00202     0.00005     0.00006     0.04439     0.02948
  34      -0.00261     0.00202    -0.00005     0.00006     0.04439    -0.02948
  35      -0.00456     0.00356    -0.01740    -0.01739    -0.04969    -0.11307
  36      -0.00046     0.00018    -0.00604    -0.00604     0.12875     0.29870
  37      -0.00007     0.00001    -0.00218    -0.00218     0.01431     0.03768
  38      -0.00009    -0.00002     0.00239     0.00239     0.02732     0.00637
  39      -0.00000    -0.00000    -0.00000     0.00000     0.00000     0.00000
  40       0.00456     0.00356     0.01740    -0.01739    -0.04969     0.11307
  41       0.00046     0.00018     0.00604    -0.00604     0.12875    -0.29870
  42      -0.00007    -0.00001    -0.00218     0.00218    -0.01431     0.03768
  43      -0.00009     0.00002     0.00239    -0.00239    -0.02732     0.00637
  44      -0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  45       0.00010    -0.00006     0.00017     0.00017     0.02537     0.06663
  46      -0.00010    -0.00006    -0.00017     0.00017     0.02537    -0.06663
  47       0.00066     0.00018     0.70143     0.70143    -0.02518    -0.08141
  48       0.00014    -0.00004     0.02536     0.02536     0.06484     0.21365
  49       0.00000     0.00003    -0.00077    -0.00077    -0.01330    -0.03922
  50       0.00008    -0.00003     0.00082     0.00082     0.02040     0.05117
  51      -0.00000    -0.00000    -0.00000     0.00000     0.00000    -0.00000
  52      -0.00066     0.00018    -0.70143     0.70143    -0.02518     0.08141
  53      -0.00014    -0.00004    -0.02536     0.02536     0.06484    -0.21365
  54       0.00000    -0.00003    -0.00077     0.00077     0.01330    -0.03922
  55       0.00008     0.00003     0.00082    -0.00082    -0.02040     0.05117
  56      -0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  57      -0.00007    -0.00006    -0.00473    -0.00473     0.01401     0.04892
  58       0.00007    -0.00006     0.00473    -0.00473     0.01401    -0.04892
  59       0.00001    -0.00000    -0.00475    -0.00475     0.01084     0.04446
  60      -0.00001    -0.00000     0.00475    -0.00475     0.01084    -0.04446

           13          14          15          16          17          18  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.00297    -0.01206    -0.10028     0.07233     0.05043    -0.01130
   2       0.01021     0.03299     0.27908    -0.21293    -0.15131     0.03251
   3       0.01072     0.12512    -0.01858    -0.11392     0.18994    -0.05062
   4       0.09341    -0.02334    -0.05879    -0.07380    -0.06338    -0.13855
   5      -0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
   6      -0.00297     0.01206     0.10028     0.07233     0.05043     0.01130
   7       0.01021    -0.03299    -0.27908    -0.21293    -0.15131    -0.03251
   8      -0.01072     0.12512    -0.01858     0.11392    -0.18994    -0.05062
   9      -0.09341    -0.02334    -0.05879     0.07380     0.06338    -0.13855
  10      -0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  11       0.04598    -0.13091    -0.04228    -0.00068    -0.10905    -0.04827
  12      -0.12241     0.35713     0.11798     0.00038     0.32485     0.14794
  13       0.01557    -0.00206    -0.03981     0.03447     0.07474    -0.00499
  14       0.03503    -0.05907     0.09190    -0.15917     0.04222     0.00882
  15      -0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  16       0.04598     0.13091     0.04228    -0.00068    -0.10905     0.04827
  17      -0.12241    -0.35713    -0.11798     0.00038     0.32485    -0.14794
  18      -0.01557    -0.00206    -0.03981    -0.03447    -0.07474    -0.00499
  19      -0.03503    -0.05907     0.09190     0.15917    -0.04222     0.00882
  20      -0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  21       0.04178    -0.11920     0.07212    -0.07935     0.06026     0.03028
  22      -0.11047     0.32501    -0.20070     0.22943    -0.18080    -0.09235
  23       0.00187     0.03044     0.05768     0.06813     0.08309     0.03409
  24      -0.04440     0.06952     0.04833     0.03027     0.16974     0.07638
  25      -0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  26       0.04178     0.11920    -0.07212    -0.07935     0.06026    -0.03028
  27      -0.11047    -0.32501     0.20070     0.22943    -0.18080     0.09235
  28      -0.00187     0.03044     0.05768    -0.06813    -0.08309     0.03409
  29       0.04440     0.06952     0.04833    -0.03027    -0.16974     0.07638
  30      -0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  31      -0.02382     0.09808     0.03404    -0.01381     0.17364     0.05184
  32      -0.02382    -0.09808    -0.03404    -0.01381     0.17364    -0.05184
  33      -0.01812     0.08988    -0.05447     0.10625    -0.09277    -0.05588
  34      -0.01812    -0.08988     0.05447     0.10625    -0.09277     0.05588
  35      -0.11765     0.00033    -0.05074     0.05255     0.00696    -0.09654
  36       0.31447    -0.00141     0.13620    -0.15950    -0.02294     0.29752
  37       0.04856     0.01960     0.04017     0.07656    -0.04227    -0.11268
  38      -0.05856    -0.01676    -0.12811    -0.13284    -0.07422     0.04537
  39      -0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  40      -0.11765    -0.00033     0.05074     0.05255     0.00696     0.09654
  41       0.31447     0.00141    -0.13620    -0.15950    -0.02294    -0.29752
  42      -0.04856     0.01960     0.04017    -0.07656     0.04227    -0.11268
  43       0.05856    -0.01676    -0.12811     0.13284     0.07422     0.04537
  44      -0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  45       0.07614    -0.00904     0.03781    -0.08110     0.03153     0.17484
  46       0.07614     0.00904    -0.03781    -0.08110     0.03153    -0.17484
  47      -0.11635    -0.01271    -0.10674    -0.08250    -0.03462     0.08032
  48       0.31008     0.03382     0.29222     0.23993     0.10374    -0.24821
  49      -0.05070     0.00083    -0.03515     0.03354    -0.01185    -0.11853
  50       0.05563     0.00584     0.02111    -0.03806    -0.04423     0.09244
  51      -0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  52      -0.11635     0.01271     0.10674    -0.08250    -0.03462    -0.08032
  53       0.31008    -0.03382    -0.29222     0.23993     0.10374     0.24821
  54       0.05070     0.00083    -0.03515    -0.03354     0.01185    -0.11853
  55      -0.05563     0.00584     0.02111     0.03806     0.04423     0.09244
  56      -0.00000     0.00000     0.00000    -0.00000    -0.00000    -0.00000
  57       0.07436     0.01269     0.07688     0.10484     0.02247    -0.16389
  58       0.07436    -0.01269    -0.07688     0.10484     0.02247     0.16389
  59       0.07480     0.00781     0.08811     0.10145     0.06533    -0.13085
  60       0.07480    -0.00781    -0.08811     0.10145     0.06533     0.13085

           19          20          21          22          23          24  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.05635    -0.02870     0.02569    -0.06597    -0.01971     0.01990
   2      -0.17081     0.09582    -0.08867     0.22349     0.06676    -0.06515
   3      -0.01908     0.04971     0.11788     0.10050    -0.22199    -0.01364
   4       0.13510     0.13632    -0.13269    -0.03061    -0.13927    -0.00811
   5      -0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
   6       0.05635    -0.02870    -0.02569     0.06597     0.01971     0.01990
   7      -0.17081     0.09582     0.08867    -0.22349    -0.06676    -0.06515
   8       0.01908    -0.04971     0.11788     0.10050    -0.22199     0.01364
   9      -0.13510    -0.13632    -0.13269    -0.03061    -0.13927     0.00811
  10      -0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  11      -0.00739    -0.01171    -0.02327     0.04508    -0.00178    -0.02313
  12       0.02548     0.04483     0.07841    -0.15396     0.00340     0.07690
  13       0.17431     0.14312     0.02854    -0.22080     0.00235    -0.00636
  14      -0.09610     0.13702     0.18191     0.06810    -0.11758    -0.08071
  15      -0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  16      -0.00739    -0.01171     0.02327    -0.04508     0.00178    -0.02313
  17       0.02548     0.04483    -0.07841     0.15396    -0.00340     0.07690
  18      -0.17431    -0.14312     0.02854    -0.22080     0.00235     0.00636
  19       0.09610    -0.13702     0.18191     0.06810    -0.11758     0.08071
  20      -0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  21      -0.04991     0.01688     0.04175    -0.04083     0.01136     0.01619
  22       0.15823    -0.04801    -0.13643     0.14102    -0.03587    -0.05945
  23       0.19463     0.09267    -0.10371     0.11539     0.24895    -0.03894
  24      -0.02349    -0.13871    -0.09327    -0.17946     0.06138     0.13432
  25      -0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  26      -0.04991     0.01688    -0.04175     0.04083    -0.01136     0.01619
  27       0.15823    -0.04801     0.13643    -0.14102     0.03587    -0.05945
  28      -0.19463    -0.09267    -0.10371     0.11539     0.24895     0.03894
  29       0.02349     0.13871    -0.09327    -0.17946     0.06138    -0.13432
  30      -0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  31       0.09884     0.14691     0.11132    -0.22576    -0.03144     0.00351
  32       0.09884     0.14691    -0.11132     0.22576     0.03144     0.00351
  33       0.16886     0.10361    -0.07136     0.23490     0.12912    -0.11659
  34       0.16886     0.10361     0.07136    -0.23490    -0.12912    -0.11659
  35      -0.06065     0.03501    -0.01410    -0.01560    -0.00245    -0.02553
  36       0.18735    -0.11049     0.04410     0.04398     0.01483     0.07453
  37      -0.07122     0.11003     0.21505     0.04703    -0.04675     0.24900
  38      -0.01009     0.18321     0.10305    -0.11921     0.17890    -0.08633
  39      -0.00000     0.00000    -0.00000     0.00000    -0.00000     0.00000
  40      -0.06065     0.03501     0.01410     0.01560     0.00245    -0.02553
  41       0.18735    -0.11049    -0.04410    -0.04398    -0.01483     0.07453
  42       0.07122    -0.11003     0.21505     0.04703    -0.04675    -0.24900
  43       0.01009    -0.18321     0.10305    -0.11921     0.17890     0.08633
  44      -0.00000     0.00000    -0.00000     0.00000    -0.00000     0.00000
  45       0.12516    -0.15273    -0.16530     0.01754     0.01423    -0.15136
  46       0.12516    -0.15273     0.16530    -0.01754    -0.01423    -0.15136
  47       0.05078    -0.01416     0.00664     0.01166     0.00119    -0.00364
  48      -0.16147     0.05373    -0.02492    -0.04742     0.00610    -0.00095
  49      -0.08644     0.20470     0.09073    -0.06668     0.25284    -0.01509
  50       0.08198     0.01235     0.20180     0.14421     0.03561     0.33624
  51      -0.00000     0.00000    -0.00000     0.00000    -0.00000     0.00000
  52       0.05078    -0.01416    -0.00664    -0.01166    -0.00119    -0.00364
  53      -0.16147     0.05373     0.02492     0.04742    -0.00610    -0.00095
  54       0.08644    -0.20470     0.09073    -0.06668     0.25284     0.01509
  55      -0.08198    -0.01235     0.20180     0.14421     0.03561    -0.33624
  56      -0.00000     0.00000    -0.00000     0.00000    -0.00000     0.00000
  57      -0.10616     0.17885     0.08017    -0.03906     0.22277     0.02576
  58      -0.10616     0.17885    -0.08017     0.03906    -0.22277     0.02576
  59      -0.10015    -0.02920    -0.17909    -0.11802    -0.09032    -0.26836
  60      -0.10015    -0.02920     0.17909     0.11802     0.09032    -0.26836

           25          26          27          28          29          30  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.00257     0.00260     0.02328     0.00000    -0.00983    -0.00210
   2      -0.00864    -0.00952    -0.08354    -0.00000     0.04304     0.01635
   3      -0.08356     0.17616     0.08391    -0.00000     0.09381    -0.16359
   4       0.07383    -0.17697     0.00418     0.00000     0.24372     0.26026
   5      -0.00000     0.00000     0.00000     0.33150    -0.00000    -0.00000
   6      -0.00257    -0.00260     0.02328     0.00000     0.00983    -0.00210
   7       0.00864     0.00952    -0.08354    -0.00000    -0.04304     0.01635
   8      -0.08356     0.17616    -0.08391    -0.00000     0.09381     0.16359
   9       0.07383    -0.17697    -0.00418     0.00000     0.24372    -0.26026
  10      -0.00000     0.00000     0.00000     0.33150     0.00000     0.00000
  11       0.02569    -0.01703     0.00423     0.00000     0.00744     0.00407
  12      -0.08248     0.06113    -0.02149    -0.00000    -0.02348    -0.01323
  13       0.29940    -0.11128    -0.12658     0.00000     0.06660     0.15890
  14       0.15374     0.22297    -0.13207    -0.00000     0.03473    -0.26821
  15      -0.00000     0.00000     0.00000     0.30283    -0.00000    -0.00000
  16      -0.02569     0.01703     0.00423    -0.00000    -0.00744     0.00407
  17       0.08248    -0.06113    -0.02149     0.00000     0.02348    -0.01323
  18       0.29940    -0.11128     0.12658     0.00000     0.06660    -0.15890
  19       0.15374     0.22297     0.13207    -0.00000     0.03473     0.26821
  20      -0.00000     0.00000     0.00000     0.30283    -0.00000     0.00000
  21       0.01847     0.00605    -0.00713    -0.00000    -0.01378    -0.00966
  22      -0.05932    -0.01702     0.02414     0.00000     0.04753     0.02840
  23       0.17905    -0.07790     0.06229     0.00000    -0.14407    -0.11753
  24      -0.23285    -0.18488     0.13677     0.00000    -0.01059     0.22347
  25      -0.00000     0.00000     0.00000     0.30187     0.00000     0.00000
  26      -0.01847    -0.00605    -0.00713     0.00000     0.01378    -0.00966
  27       0.05932     0.01702     0.02414    -0.00000    -0.04753     0.02840
  28       0.17905    -0.07790    -0.06229     0.00000    -0.14407     0.11753
  29      -0.23285    -0.18488    -0.13677     0.00000    -0.01059    -0.22347
  30      -0.00000     0.00000     0.00000     0.30187     0.00000    -0.00000
  31       0.25850    -0.00250    -0.15685    -0.00000     0.04885     0.05277
  32      -0.25850     0.00250    -0.15685    -0.00000    -0.04885     0.05277
  33       0.22360     0.03999    -0.00010    -0.00000    -0.05941    -0.25390
  34      -0.22360    -0.03999    -0.00010     0.00000     0.05941    -0.25390
  35      -0.00158     0.00086    -0.01510    -0.00000     0.00351    -0.01752
  36       0.00361     0.01230     0.06315     0.00000    -0.01123     0.07388
  37      -0.02371    -0.20200    -0.20936     0.00000    -0.21453     0.02592
  38      -0.05915     0.18876     0.08025    -0.00000    -0.17918     0.23293
  39      -0.00000     0.00000     0.00000     0.16558     0.00000     0.00000
  40       0.00158    -0.00086    -0.01510    -0.00000    -0.00351    -0.01752
  41      -0.00361    -0.01230     0.06315     0.00000     0.01123     0.07388
  42      -0.02371    -0.20200     0.20936     0.00000    -0.21453    -0.02592
  43      -0.05915     0.18876    -0.08025    -0.00000    -0.17918    -0.23293
  44      -0.00000    -0.00000    -0.00000     0.16558     0.00000    -0.00000
  45       0.02240     0.14844     0.20296    -0.00000     0.25725    -0.04644
  46      -0.02240    -0.14844     0.20296     0.00000    -0.25725    -0.04644
  47       0.00434     0.01891     0.00989    -0.00000     0.00268     0.00872
  48      -0.01686    -0.05201    -0.02602     0.00000    -0.01229    -0.02347
  49      -0.07124     0.12590     0.29613    -0.00000     0.19454     0.03662
  50      -0.01404    -0.23894     0.05034     0.00000     0.14136    -0.13811
  51      -0.00000     0.00000     0.00000     0.09914     0.00000     0.00000
  52      -0.00434    -0.01891     0.00989     0.00000    -0.00268     0.00872
  53       0.01686     0.05201    -0.02602    -0.00000     0.01229    -0.02347
  54      -0.07124     0.12590    -0.29613    -0.00000     0.19454    -0.03662
  55      -0.01404    -0.23894    -0.05034     0.00000     0.14136     0.13811
  56      -0.00000    -0.00000    -0.00000     0.09914     0.00000    -0.00000
  57      -0.05652     0.05847     0.27318    -0.00000     0.22630    -0.03215
  58       0.05652    -0.05847     0.27318     0.00000    -0.22630    -0.03215
  59       0.02227     0.15354    -0.14587    -0.00000    -0.21197     0.12146
  60      -0.02227    -0.15354    -0.14587     0.00000     0.21197     0.12146

           31          32          33          34          35          36  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.00629    -0.00000    -0.00000    -0.00000     0.00000    -0.00000
   2       0.03168     0.00000     0.00000     0.00000    -0.00000     0.00000
   3       0.27885    -0.00000     0.00000    -0.00000     0.00000    -0.00000
   4       0.12972     0.00000    -0.00000     0.00000    -0.00000     0.00000
   5      -0.00000    -0.31868    -0.03965    -0.00225     0.41799     0.47153
   6      -0.00629     0.00000    -0.00000     0.00000    -0.00000    -0.00000
   7       0.03168    -0.00000     0.00000    -0.00000     0.00000     0.00000
   8      -0.27885    -0.00000     0.00000    -0.00000    -0.00000     0.00000
   9      -0.12972     0.00000    -0.00000     0.00000    -0.00000    -0.00000
  10       0.00000     0.31868    -0.03965     0.00225    -0.41799     0.47153
  11      -0.01149     0.00000    -0.00000     0.00000    -0.00000     0.00000
  12       0.03512    -0.00000     0.00000    -0.00000     0.00000    -0.00000
  13      -0.21036     0.00000    -0.00000     0.00000    -0.00000     0.00000
  14      -0.08519    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  15      -0.00000    -0.12429    -0.16451     0.45982     0.23189    -0.24997
  16      -0.01149    -0.00000     0.00000    -0.00000     0.00000    -0.00000
  17       0.03512     0.00000    -0.00000     0.00000    -0.00000     0.00000
  18       0.21036    -0.00000    -0.00000     0.00000     0.00000    -0.00000
  19       0.08519    -0.00000     0.00000    -0.00000     0.00000    -0.00000
  20       0.00000     0.12429    -0.16451    -0.45982    -0.23189    -0.24997
  21       0.00666    -0.00000     0.00000    -0.00000    -0.00000     0.00000
  22      -0.02027     0.00000    -0.00000     0.00000     0.00000    -0.00000
  23       0.26904    -0.00000     0.00000     0.00000     0.00000     0.00000
  24       0.12357     0.00000    -0.00000     0.00000     0.00000     0.00000
  25       0.00000     0.11940    -0.16493     0.46149    -0.23200    -0.27857
  26       0.00666    -0.00000    -0.00000     0.00000     0.00000     0.00000
  27      -0.02027     0.00000     0.00000    -0.00000    -0.00000    -0.00000
  28      -0.26904     0.00000    -0.00000     0.00000    -0.00000     0.00000
  29      -0.12357     0.00000    -0.00000     0.00000    -0.00000     0.00000
  30      -0.00000    -0.11940    -0.16493    -0.46149     0.23200    -0.27857
  31      -0.25163     0.00000    -0.00000    -0.00000    -0.00000     0.00000
  32      -0.25163    -0.00000     0.00000     0.00000    -0.00000    -0.00000
  33       0.12318     0.00000     0.00000    -0.00000     0.00000     0.00000
  34       0.12318    -0.00000    -0.00000     0.00000    -0.00000     0.00000
  35      -0.01308     0.00000    -0.00000     0.00000    -0.00000    -0.00000
  36       0.04729    -0.00000     0.00000    -0.00000     0.00000     0.00000
  37       0.14120     0.00000     0.00000     0.00000     0.00000     0.00000
  38       0.14327    -0.00000     0.00000    -0.00000     0.00000    -0.00000
  39       0.00000     0.38321     0.41518     0.00019     0.21835     0.24693
  40      -0.01308    -0.00000     0.00000    -0.00000     0.00000     0.00000
  41       0.04729     0.00000    -0.00000     0.00000    -0.00000    -0.00000
  42      -0.14120     0.00000    -0.00000     0.00000     0.00000     0.00000
  43      -0.14327    -0.00000     0.00000    -0.00000     0.00000     0.00000
  44      -0.00000    -0.38321     0.41518    -0.00019    -0.21835     0.24693
  45      -0.18377    -0.00000    -0.00000    -0.00000    -0.00000    -0.00000
  46      -0.18377     0.00000     0.00000     0.00000     0.00000     0.00000
  47      -0.00303    -0.00000     0.00000    -0.00000     0.00000     0.00000
  48       0.01380     0.00000    -0.00000     0.00000     0.00000    -0.00000
  49      -0.10128    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  50      -0.05574     0.00000    -0.00000     0.00000    -0.00000     0.00000
  51       0.00000     0.30667     0.42629     0.00262     0.35818    -0.41493
  52      -0.00303     0.00000    -0.00000     0.00000    -0.00000     0.00000
  53       0.01380    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  54       0.10128    -0.00000     0.00000    -0.00000    -0.00000     0.00000
  55       0.05574     0.00000    -0.00000     0.00000    -0.00000     0.00000
  56      -0.00000    -0.30667     0.42629    -0.00262    -0.35818    -0.41493
  57      -0.11731    -0.00000     0.00000    -0.00000    -0.00000     0.00000
  58      -0.11731     0.00000     0.00000     0.00000     0.00000     0.00000
  59       0.10240    -0.00000     0.00000    -0.00000     0.00000     0.00000
  60       0.10240     0.00000    -0.00000     0.00000    -0.00000    -0.00000

           37          38          39          40          41          42  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.00000     0.00000     0.00000    -0.00000     0.06347    -0.02959
   2       0.00000    -0.00000    -0.00000     0.00000    -0.38006     0.17692
   3      -0.00000     0.00000    -0.00000    -0.00000    -0.08842     0.28350
   4       0.00000    -0.00000    -0.00000     0.00000    -0.26802     0.11184
   5      -0.02229    -0.03791    -0.47349     0.53871    -0.00000    -0.00000
   6       0.00000    -0.00000    -0.00000     0.00000     0.06347     0.02959
   7      -0.00000     0.00000     0.00000    -0.00000    -0.38006    -0.17692
   8      -0.00000     0.00000    -0.00000    -0.00000     0.08842     0.28350
   9       0.00000    -0.00000    -0.00000     0.00000     0.26802     0.11184
  10      -0.02229     0.03791    -0.47349    -0.53871     0.00000     0.00000
  11       0.00000     0.00000    -0.00000     0.00000     0.02915     0.00433
  12      -0.00000    -0.00000     0.00000    -0.00000    -0.18291    -0.02043
  13       0.00000    -0.00000    -0.00000     0.00000    -0.30919     0.35555
  14      -0.00000    -0.00000    -0.00000    -0.00000    -0.06525     0.00144
  15       0.57856     0.22554     0.16186    -0.46948    -0.00000     0.00000
  16      -0.00000     0.00000     0.00000    -0.00000     0.02915    -0.00433
  17       0.00000    -0.00000    -0.00000     0.00000    -0.18291     0.02043
  18       0.00000    -0.00000    -0.00000     0.00000     0.30919     0.35555
  19      -0.00000    -0.00000    -0.00000    -0.00000     0.06525     0.00144
  20       0.57856    -0.22554     0.16186     0.46948     0.00000     0.00000
  21      -0.00000     0.00000     0.00000    -0.00000     0.04839    -0.01440
  22       0.00000     0.00000    -0.00000     0.00000    -0.29828     0.08933
  23      -0.00000     0.00000     0.00000    -0.00000    -0.20794     0.29130
  24       0.00000     0.00000     0.00000     0.00000     0.13598    -0.00660
  25      -0.55811    -0.22043     0.18678     0.47149     0.00000     0.00000
  26       0.00000    -0.00000    -0.00000     0.00000     0.04839     0.01440
  27      -0.00000     0.00000     0.00000    -0.00000    -0.29828    -0.08933
  28      -0.00000     0.00000     0.00000    -0.00000     0.20794     0.29130
  29       0.00000    -0.00000     0.00000     0.00000    -0.13598    -0.00660
  30      -0.55811     0.22043     0.18678    -0.47149    -0.00000     0.00000
  31       0.00000     0.00000    -0.00000     0.00000     0.42094    -0.31890
  32      -0.00000     0.00000     0.00000    -0.00000     0.42094     0.31890
  33      -0.00000    -0.00000     0.00000    -0.00000     0.43480    -0.27655
  34       0.00000     0.00000    -0.00000     0.00000     0.43480     0.27655
  35       0.00000    -0.00000    -0.00000     0.00000    -0.04826     0.01371
  36      -0.00000     0.00000     0.00000    -0.00000     0.27669    -0.08345
  37      -0.00000     0.00000     0.00000     0.00000     0.23991     0.35091
  38      -0.00000     0.00000     0.00000    -0.00000     0.32394     0.19909
  39       0.00330     0.52439     0.53507     0.27875     0.00000     0.00000
  40      -0.00000     0.00000     0.00000    -0.00000    -0.04826    -0.01371
  41       0.00000    -0.00000    -0.00000     0.00000     0.27669     0.08345
  42      -0.00000     0.00000     0.00000     0.00000    -0.23991     0.35091
  43      -0.00000    -0.00000     0.00000    -0.00000    -0.32394     0.19909
  44       0.00330    -0.52439     0.53507    -0.27875     0.00000    -0.00000
  45       0.00000    -0.00000    -0.00000     0.00000     0.14038     0.44870
  46      -0.00000     0.00000     0.00000    -0.00000     0.14038    -0.44870
  47      -0.00000    -0.00000    -0.00000    -0.00000     0.04112     0.00135
  48       0.00000     0.00000     0.00000     0.00000    -0.24262    -0.01356
  49       0.00000     0.00000    -0.00000     0.00000     0.13846     0.30201
  50       0.00000    -0.00000    -0.00000     0.00000     0.15018     0.17216
  51       0.00408    -0.53124    -0.40735    -0.15847     0.00000     0.00000
  52       0.00000     0.00000     0.00000     0.00000     0.04112    -0.00135
  53      -0.00000     0.00000    -0.00000    -0.00000    -0.24262     0.01356
  54       0.00000    -0.00000    -0.00000     0.00000    -0.13846     0.30201
  55       0.00000    -0.00000    -0.00000     0.00000    -0.15018     0.17216
  56       0.00408     0.53124    -0.40735     0.15847    -0.00000    -0.00000
  57       0.00000    -0.00000    -0.00000     0.00000    -0.09878    -0.32156
  58      -0.00000     0.00000     0.00000    -0.00000    -0.09878     0.32156
  59      -0.00000    -0.00000     0.00000    -0.00000     0.35383     0.27911
  60       0.00000     0.00000    -0.00000     0.00000     0.35383    -0.27911

           43          44          45          46          47          48  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.02013    -0.05520     0.04545    -0.08266    -0.01775    -0.12947
   2      -0.12342     0.32508    -0.27865     0.49230     0.11409     0.79666
   3      -0.11292    -0.08096     0.24740    -0.11636    -0.10657    -0.04376
   4       0.07806     0.45357    -0.15053     0.03228    -0.25761    -0.01346
   5      -0.00000    -0.00000     0.00000     0.00000    -0.00000     0.00000
   6       0.02013     0.05520     0.04545     0.08266     0.01775    -0.12947
   7      -0.12342    -0.32508    -0.27865    -0.49230    -0.11409     0.79666
   8       0.11292    -0.08096    -0.24740    -0.11636    -0.10657     0.04376
   9      -0.07806     0.45357     0.15053     0.03228    -0.25761     0.01346
  10       0.00000    -0.00000     0.00000    -0.00000    -0.00000     0.00000
  11      -0.06409     0.02329     0.07352     0.07623     0.05737     0.07005
  12       0.39789    -0.14490    -0.45738    -0.46139    -0.36107    -0.44429
  13       0.00442    -0.11705    -0.06012    -0.11270    -0.32214    -0.01333
  14       0.11326     0.22045     0.14682     0.02798    -0.31927    -0.29602
  15      -0.00000     0.00000    -0.00000    -0.00000     0.00000     0.00000
  16      -0.06409    -0.02329     0.07352    -0.07623    -0.05737     0.07005
  17       0.39789     0.14490    -0.45738     0.46139     0.36107    -0.44429
  18      -0.00442    -0.11705     0.06012    -0.11270    -0.32214     0.01333
  19      -0.11326     0.22045    -0.14682     0.02798    -0.31927     0.29602
  20      -0.00000     0.00000    -0.00000    -0.00000    -0.00000     0.00000
  21      -0.01478    -0.00096    -0.09399    -0.09960    -0.00456     0.07402
  22       0.09710    -0.00079     0.58288     0.61112     0.01637    -0.46918
  23       0.17068    -0.26071    -0.02469    -0.00945    -0.20446     0.22673
  24      -0.20090     0.32797     0.02348    -0.11109    -0.10993     0.23946
  25      -0.00000     0.00000    -0.00000     0.00000    -0.00000     0.00000
  26      -0.01478     0.00096    -0.09399     0.09960     0.00456     0.07402
  27       0.09710     0.00079     0.58288    -0.61112    -0.01637    -0.46918
  28      -0.17068    -0.26071     0.02469    -0.00945    -0.20446    -0.22673
  29       0.20090     0.32797    -0.02348    -0.11109    -0.10993    -0.23946
  30      -0.00000     0.00000    -0.00000     0.00000     0.00000     0.00000
  31      -0.28653     0.10132     0.24361     0.33817     0.59827     0.29547
  32      -0.28653    -0.10132     0.24361    -0.33817    -0.59827     0.29547
  33      -0.27463     0.40890    -0.20615    -0.32759     0.04960     0.22015
  34      -0.27463    -0.40890    -0.20615     0.32759    -0.04960     0.22015
  35       0.06458    -0.08931    -0.01632    -0.04073     0.07342     0.09307
  36      -0.39458     0.52976     0.10814     0.26016    -0.46728    -0.57054
  37       0.35069     0.07786    -0.12426    -0.14864     0.22392     0.11487
  38       0.07394     0.31854     0.23556     0.19090    -0.06187    -0.09824
  39       0.00000     0.00000    -0.00000    -0.00000    -0.00000    -0.00000
  40       0.06458     0.08931    -0.01632     0.04073    -0.07342     0.09307
  41      -0.39458    -0.52976     0.10814    -0.26016     0.46728    -0.57054
  42      -0.35069     0.07786     0.12426    -0.14864     0.22392    -0.11487
  43      -0.07394     0.31854    -0.23556     0.19090    -0.06187     0.09824
  44       0.00000    -0.00000     0.00000     0.00000     0.00000    -0.00000
  45       0.58957    -0.13077    -0.12647    -0.19585     0.43802     0.36479
  46       0.58957     0.13077    -0.12647     0.19585    -0.43802     0.36479
  47      -0.01775     0.05639    -0.10758    -0.08349     0.02086    -0.06336
  48       0.09880    -0.33762     0.68358     0.53351    -0.14155     0.39041
  49       0.29962     0.11191     0.24914     0.26319     0.03161    -0.02922
  50       0.24406     0.16612    -0.07396    -0.11940     0.29095    -0.06522
  51       0.00000    -0.00000    -0.00000     0.00000     0.00000    -0.00000
  52      -0.01775    -0.05639    -0.10758     0.08349    -0.02086    -0.06336
  53       0.09880     0.33762     0.68358    -0.53351     0.14155     0.39041
  54      -0.29962     0.11191    -0.24914     0.26319     0.03161     0.02922
  55      -0.24406     0.16612     0.07396    -0.11940     0.29095     0.06522
  56      -0.00000     0.00000    -0.00000     0.00000     0.00000    -0.00000
  57      -0.38136    -0.00205    -0.54181    -0.46045    -0.02785    -0.17333
  58      -0.38136     0.00205    -0.54181     0.46045     0.02785    -0.17333
  59       0.26202     0.38946    -0.33081    -0.29263     0.32868    -0.26736
  60       0.26202    -0.38946    -0.33081     0.29263    -0.32868    -0.26736

           49          50          51          52          53          54  
       ----------- ----------- ----------- ----------- ----------- -----------
   1       0.06033     0.04020     0.06829     0.00273    -0.00046     0.05152
   2      -0.36327    -0.25411    -0.46272    -0.00821    -0.00320    -0.36172
   3      -0.13936    -0.34438     0.12169    -0.55535     0.21367    -0.26311
   4       0.11475     0.04817     0.58684     0.05618     0.04558     0.00401
   5       0.00000     0.00000    -0.00000     0.00000     0.00000    -0.00000
   6      -0.06033     0.04020     0.06829    -0.00273    -0.00046    -0.05152
   7       0.36327    -0.25411    -0.46272     0.00821    -0.00320     0.36172
   8      -0.13936     0.34438    -0.12169    -0.55535    -0.21367    -0.26311
   9       0.11475    -0.04817    -0.58684     0.05618    -0.04558     0.00401
  10       0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  11      -0.05816    -0.11353    -0.01377    -0.09440     0.00433     0.03473
  12       0.35719     0.72776     0.09182     0.64278    -0.03563    -0.23914
  13      -0.14747    -0.07672    -0.44667     0.01637     0.53137    -0.19353
  14       0.12248    -0.10733     0.16074     0.09831     0.19721     0.71678
  15      -0.00000    -0.00000    -0.00000     0.00000    -0.00000    -0.00000
  16       0.05816    -0.11353    -0.01377     0.09440     0.00433    -0.03473
  17      -0.35719     0.72776     0.09182    -0.64278    -0.03563     0.23914
  18      -0.14747     0.07672     0.44667     0.01637    -0.53137    -0.19353
  19       0.12248     0.10733    -0.16074     0.09831    -0.19721     0.71678
  20      -0.00000    -0.00000    -0.00000    -0.00000    -0.00000    -0.00000
  21       0.06824     0.09547    -0.04797    -0.03443    -0.00315    -0.08760
  22      -0.42521    -0.61447     0.31578     0.24290     0.02893     0.61059
  23      -0.18151    -0.15947    -0.32475    -0.19597    -0.51838     0.30197
  24       0.14947    -0.17955     0.01505    -0.47953     0.39528     0.38216
  25      -0.00000    -0.00000    -0.00000    -0.00000    -0.00000    -0.00000
  26      -0.06824     0.09547    -0.04797     0.03443    -0.00315     0.08760
  27       0.42521    -0.61447     0.31578    -0.24290     0.02893    -0.61059
  28      -0.18151     0.15947     0.32475    -0.19597     0.51838     0.30197
  29       0.14947     0.17955    -0.01505    -0.47953    -0.39528     0.38216
  30      -0.00000    -0.00000    -0.00000     0.00000    -0.00000     0.00000
  31      -0.07756    -0.24355     0.24171    -0.29864    -0.44169     0.06170
  32       0.07756    -0.24355     0.24171     0.29864    -0.44169    -0.06170
  33       0.48819     0.33971     0.05277    -0.20881     0.50944    -0.25391
  34      -0.48819     0.33971     0.05277     0.20881     0.50944     0.25391
  35       0.07002    -0.03282     0.07315     0.02688     0.05204     0.06209
  36      -0.43047     0.23057    -0.48600    -0.19861    -0.36324    -0.43405
  37       0.05929    -0.03730     0.15697    -0.27581    -0.14090     0.07786
  38       0.12366     0.07466     0.02314     0.04918     0.16297     0.10502
  39       0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  40      -0.07002    -0.03282     0.07315    -0.02688     0.05204    -0.06209
  41       0.43047     0.23057    -0.48600     0.19861    -0.36324     0.43405
  42       0.05929     0.03730    -0.15697    -0.27581     0.14090     0.07786
  43       0.12366    -0.07466    -0.02314     0.04918    -0.16297     0.10502
  44       0.00000     0.00000     0.00000    -0.00000     0.00000    -0.00000
  45       0.29662    -0.08716     0.31097    -0.15158     0.08064     0.25884
  46      -0.29662    -0.08716     0.31097     0.15158     0.08064    -0.25884
  47      -0.11043    -0.06100    -0.01913    -0.00996    -0.04167    -0.00937
  48       0.70233     0.39762     0.12122     0.07893     0.29027     0.06216
  49       0.14091     0.13476    -0.35815     0.02242    -0.09607    -0.30666
  50      -0.01939    -0.37252    -0.13206     0.49016     0.29204     0.09797
  51      -0.00000     0.00000     0.00000    -0.00000     0.00000    -0.00000
  52       0.11043    -0.06100    -0.01913     0.00996    -0.04167     0.00937
  53      -0.70233     0.39762     0.12122    -0.07893     0.29027    -0.06216
  54       0.14091    -0.13476     0.35815     0.02242     0.09607    -0.30666
  55      -0.01939     0.37252     0.13206     0.49016    -0.29204     0.09797
  56       0.00000     0.00000     0.00000     0.00000     0.00000    -0.00000
  57      -0.51486    -0.28603     0.24499    -0.10535    -0.12843     0.22847
  58       0.51486    -0.28603     0.24499     0.10535    -0.12843    -0.22847
  59      -0.31645    -0.45685    -0.25488     0.35646     0.08062    -0.02831
  60       0.31645    -0.45685    -0.25488    -0.35646     0.08062     0.02831

           55          56          57          58          59          60  
       ----------- ----------- ----------- ----------- ----------- -----------
   1      -0.09450     0.01420     0.01758     0.01953    -0.00474     0.04242
   2       0.64864    -0.08483    -0.11210    -0.13942     0.03202    -0.32153
   3      -0.18965    -0.10986     0.10062    -0.46861     0.71202     0.16190
   4       0.05544    -0.35995    -0.41189     0.13349    -0.05426     0.66243
   5       0.00000     0.00000    -0.00000    -0.00000    -0.00000    -0.00000
   6       0.09450     0.01420     0.01758    -0.01953    -0.00474    -0.04242
   7      -0.64864    -0.08483    -0.11210     0.13942     0.03202     0.32153
   8      -0.18965     0.10986    -0.10062    -0.46861    -0.71202     0.16190
   9       0.05544     0.35995     0.41189     0.13349     0.05426     0.66243
  10       0.00000    -0.00000     0.00000    -0.00000    -0.00000     0.00000
  11      -0.00878     0.02820    -0.01808    -0.04629     0.00719    -0.05089
  12       0.07504    -0.20151     0.13189     0.33903    -0.04976     0.37542
  13       0.27126     0.26937     0.11482    -0.19548     0.24459    -0.56630
  14      -0.13846     0.39220    -0.36515     0.13846    -0.54801    -0.23999
  15      -0.00000     0.00000    -0.00000    -0.00000     0.00000    -0.00000
  16       0.00878     0.02820    -0.01808     0.04629     0.00719     0.05089
  17      -0.07504    -0.20151     0.13189    -0.33903    -0.04976    -0.37542
  18       0.27126    -0.26937    -0.11482    -0.19548    -0.24459    -0.56630
  19      -0.13846    -0.39220     0.36515     0.13846     0.54801    -0.23999
  20      -0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  21      -0.02893    -0.03159     0.01601    -0.02227    -0.00734     0.05551
  22       0.19142     0.22096    -0.11842     0.16775     0.04971    -0.41154
  23      -0.39356     0.15680     0.05191    -0.05616    -0.44424     0.49411
  24      -0.20793     0.32678    -0.42995    -0.21552    -0.42322    -0.39434
  25      -0.00000     0.00000     0.00000     0.00000    -0.00000     0.00000
  26       0.02893    -0.03159     0.01601     0.02227    -0.00734    -0.05551
  27      -0.19142     0.22096    -0.11842    -0.16775     0.04971     0.41154
  28      -0.39356    -0.15680    -0.05191    -0.05616     0.44424     0.49411
  29      -0.20793    -0.32678     0.42995    -0.21552     0.42322    -0.39434
  30      -0.00000     0.00000    -0.00000    -0.00000     0.00000    -0.00000
  31      -0.14981    -0.21765    -0.04766    -0.02392    -0.00844     0.26961
  32       0.14981    -0.21765    -0.04766     0.02392    -0.00844    -0.26961
  33       0.02254    -0.03523    -0.20429    -0.10576     0.03848    -0.27726
  34      -0.02254    -0.03523    -0.20429     0.10576     0.03848     0.27726
  35       0.01769    -0.04334     0.03640    -0.05834    -0.02416    -0.01409
  36      -0.14423     0.30721    -0.29712     0.45190     0.19749     0.08798
  37       0.29735     0.55668    -0.09970     0.60835     0.41479     0.02777
  38       0.48257     0.14504     0.68016    -0.45823    -0.30091     0.36504
  39       0.00000    -0.00000     0.00000    -0.00000     0.00000     0.00000
  40      -0.01769    -0.04334     0.03640     0.05834    -0.02416     0.01409
  41       0.14423     0.30721    -0.29712    -0.45190     0.19749    -0.08798
  42       0.29735    -0.55668     0.09970     0.60835    -0.41479     0.02777
  43       0.48257    -0.14504    -0.68016    -0.45823     0.30091     0.36504
  44       0.00000    -0.00000     0.00000    -0.00000    -0.00000    -0.00000
  45       0.32793     0.30837     0.14608     0.17887     0.15782     0.04879
  46      -0.32793     0.30837     0.14608    -0.17887     0.15782    -0.04879
  47      -0.01772     0.03266    -0.04635     0.06846     0.03822    -0.00886
  48       0.12954    -0.24177     0.35554    -0.52696    -0.30561     0.07838
  49      -0.50737    -0.13252    -0.58368     0.38883     0.24000    -0.21693
  50      -0.23524    -0.53985     0.18340    -0.53681    -0.30265    -0.00326
  51      -0.00000    -0.00000     0.00000     0.00000    -0.00000    -0.00000
  52       0.01772     0.03266    -0.04635    -0.06846     0.03822     0.00886
  53      -0.12954    -0.24177     0.35554     0.52696    -0.30561    -0.07838
  54      -0.50737     0.13252     0.58368     0.38883    -0.24000    -0.21693
  55      -0.23524     0.53985    -0.18340    -0.53681     0.30265    -0.00326
  56       0.00000    -0.00000    -0.00000    -0.00000     0.00000    -0.00000
  57       0.34539     0.26547     0.27254    -0.01144    -0.03139     0.13677
  58      -0.34539     0.26547     0.27254     0.01144    -0.03139    -0.13677
  59      -0.33103    -0.32048    -0.12287    -0.09634    -0.04651    -0.06633
  60       0.33103    -0.32048    -0.12287     0.09634    -0.04651     0.06633

 center of mass
 --------------
 x =   0.00000000 y =   0.00000000 z =   0.00000000

 moments of inertia (a.u.)
 ------------------
        2631.731379210404           0.000000000000           0.000000000000
           0.000000000000         390.819001468288           0.000000000000
           0.000000000000           0.000000000000        3022.550380678692

  Mulliken analysis of the total density
  --------------------------------------

    Atom       Charge   Shell Charges
 -----------   ------   -------------------------------------------------------
    1 C    6     6.00   1.99  1.14  2.87
    2 C    6     6.00   1.99  1.14  2.87
    3 C    6     6.06   1.99  1.15  2.92
    4 C    6     6.06   1.99  1.15  2.92
    5 C    6     6.06   1.99  1.15  2.92
    6 C    6     6.06   1.99  1.15  2.92
    7 H    1     0.94   0.94
    8 H    1     0.94   0.94
    9 H    1     0.94   0.94
   10 H    1     0.94   0.94
   11 C    6     6.06   1.99  1.15  2.91
   12 C    6     6.06   1.99  1.15  2.91
   13 H    1     0.94   0.94
   14 H    1     0.94   0.94
   15 C    6     6.12   1.99  1.16  2.97
   16 C    6     6.12   1.99  1.16  2.97
   17 H    1     0.94   0.94
   18 H    1     0.94   0.94
   19 H    1     0.94   0.94
   20 H    1     0.94   0.94

       Multipole analysis of the density wrt the origin
       ------------------------------------------------

     L   x y z        total         open         nuclear
     -   - - -        -----         ----         -------
     0   0 0 0     -0.000000      0.000000     70.000000

     1   1 0 0     -0.000000      0.000000      0.000000
     1   0 1 0     -0.000000      0.000000      0.000000
     1   0 0 1      0.000000      0.000000      0.000000

     2   2 0 0    -38.360869      0.000000    244.795872
     2   1 1 0      0.065434      0.000000     -5.631027
     2   1 0 1      0.000000      0.000000      0.000000
     2   0 2 0    -39.006221      0.000000   1496.963300
     2   0 1 1      0.000000      0.000000      0.000000
     2   0 0 2    -43.564269      0.000000      0.000000


 Parallel integral file used       8 records with       0 large values


          -------------
          Dipole Moment
          -------------

 Center of charge (in au) is the expansion point
         X =       0.0000000 Y =       0.0000000 Z =       0.0000000

   Dipole moment        0.0000000000 A.U.
             DMX        0.0000000000 DMXEFC        0.0000000000
             DMY       -0.0000000000 DMYEFC        0.0000000000
             DMZ        0.0000000000 DMZEFC        0.0000000000
   -EFC- dipole         0.0000000000 A.U.
   Total dipole         0.0000000000 A.U.

   Dipole moment        0.0000000000 Debye(s)
             DMX        0.0000000000 DMXEFC        0.0000000000
             DMY       -0.0000000000 DMYEFC        0.0000000000
             DMZ        0.0000000000 DMZEFC        0.0000000000
   -EFC- dipole         0.0000000000 DEBYE(S)
   Total dipole         0.0000000000 DEBYE(S)

 1 a.u. = 2.541766 Debyes 

          -----------------
          Quadrupole Moment
          -----------------

 Center of charge (in au) is the expansion point
         X =       0.0000000 Y =       0.0000000 Z =       0.0000000

 < R**2 > = ********** a.u.  ( 1 a.u. = 0.280023 10**(-16) cm**2 ) 
 ( also called diamagnetic susceptibility ) 

   Second moments in atomic units

   Component  Electronic+nuclear     Point charges             Total
  --------------------------------------------------------------------------
      XX          -38.3608685337          0.0000000000        -38.3608685337
      YY          -39.0062210270          0.0000000000        -39.0062210270
      ZZ          -43.5642691494          0.0000000000        -43.5642691494
      XY            0.0654337040          0.0000000000          0.0654337040
      XZ            0.0000000000          0.0000000000          0.0000000000
      YZ            0.0000000000          0.0000000000          0.0000000000

   Second moments in buckingham(s)

   Component  Electronic+nuclear     Point charges             Total
  --------------------------------------------------------------------------
      XX          -51.5919540605          0.0000000000        -51.5919540605
      YY          -52.4598957277          0.0000000000        -52.4598957277
      ZZ          -58.5900647861          0.0000000000        -58.5900647861
      XY            0.0880025082          0.0000000000          0.0880025082
      XZ            0.0000000000          0.0000000000          0.0000000000
      YZ            0.0000000000          0.0000000000          0.0000000000

   Quadrupole moments in atomic units

   Component  Electronic+nuclear     Point charges             Total
  --------------------------------------------------------------------------
      XX            2.9243765545          0.0000000000          2.9243765545
      YY            1.9563478145          0.0000000000          1.9563478145
      ZZ           -4.8807243691          0.0000000000         -4.8807243691
      XY            0.0981505560          0.0000000000          0.0981505560
      XZ            0.0000000000          0.0000000000          0.0000000000
      YZ            0.0000000000          0.0000000000          0.0000000000

   Quadrupole moments in buckingham(s)

   Component  Electronic+nuclear     Point charges             Total
  --------------------------------------------------------------------------
      XX            3.9330261963          0.0000000000          3.9330261963
      YY            2.6311136956          0.0000000000          2.6311136956
      ZZ           -6.5641398919          0.0000000000         -6.5641398919
      XY            0.1320037624          0.0000000000          0.1320037624
      XZ            0.0000000000          0.0000000000          0.0000000000
      YZ            0.0000000000          0.0000000000          0.0000000000

 1 a.u. = 1.344911 Buckinghams = 1.344911 10**(-26) esu*cm**2 

          ---------------
          Octupole Moment
          ---------------

 Center of charge (in au) is the expansion point
         X =       0.0000000 Y =       0.0000000 Z =       0.0000000

   Third moments in atomic units

   Component  Electronic+nuclear     Point charges             Total
  --------------------------------------------------------------------------
      XXX           0.0000000000          0.0000000000          0.0000000000
      YYY           0.0000000000          0.0000000000          0.0000000000
      ZZZ           0.0000000000          0.0000000000          0.0000000000
      XXY          -0.0000000000          0.0000000000         -0.0000000000
      XXZ          -0.0000000000          0.0000000000         -0.0000000000
      YYX           0.0000000000          0.0000000000          0.0000000000
      YYZ          -0.0000000000          0.0000000000         -0.0000000000
      ZZX           0.0000000000          0.0000000000          0.0000000000
      ZZY          -0.0000000000          0.0000000000         -0.0000000000
      XYZ          -0.0000000000          0.0000000000         -0.0000000000

   Third moments in 10**(-34) esu*cm**3

   Component  Electronic+nuclear     Point charges             Total
  --------------------------------------------------------------------------
      XXX           0.0000000000          0.0000000000          0.0000000000
      YYY           0.0000000000          0.0000000000          0.0000000000
      ZZZ           0.0000000000          0.0000000000          0.0000000000
      XXY          -0.0000000000          0.0000000000         -0.0000000000
      XXZ          -0.0000000000          0.0000000000         -0.0000000000
      YYX           0.0000000000          0.0000000000          0.0000000000
      YYZ          -0.0000000000          0.0000000000         -0.0000000000
      ZZX           0.0000000000          0.0000000000          0.0000000000
      ZZY          -0.0000000000          0.0000000000         -0.0000000000
      XYZ          -0.0000000000          0.0000000000         -0.0000000000

   Octupole moments in atomic units

   Component  Electronic+nuclear     Point charges             Total
  --------------------------------------------------------------------------
      XXX           0.0000000000          0.0000000000          0.0000000000
      YYY           0.0000000000          0.0000000000          0.0000000000
      ZZZ           0.0000000000          0.0000000000          0.0000000000
      XXY          -0.0000000000          0.0000000000         -0.0000000000
      XXZ          -0.0000000000          0.0000000000         -0.0000000000
      YYX          -0.0000000000          0.0000000000         -0.0000000000
      YYZ          -0.0000000000          0.0000000000         -0.0000000000
      ZZX          -0.0000000000          0.0000000000         -0.0000000000
      ZZY          -0.0000000000          0.0000000000         -0.0000000000
      XYZ          -0.0000000000          0.0000000000         -0.0000000000

   Octupole moments in 10**(-34) esu*cm**3

   Component  Electronic+nuclear     Point charges             Total
  --------------------------------------------------------------------------
      XXX           0.0000000000          0.0000000000          0.0000000000
      YYY           0.0000000000          0.0000000000          0.0000000000
      ZZZ           0.0000000000          0.0000000000          0.0000000000
      XXY          -0.0000000000          0.0000000000         -0.0000000000
      XXZ          -0.0000000000          0.0000000000         -0.0000000000
      YYX          -0.0000000000          0.0000000000         -0.0000000000
      YYZ          -0.0000000000          0.0000000000         -0.0000000000
      ZZX          -0.0000000000          0.0000000000         -0.0000000000
      ZZY          -0.0000000000          0.0000000000         -0.0000000000
      XYZ          -0.0000000000          0.0000000000         -0.0000000000

 1 a.u. = 0.711688 10**(-34) esu*cm**3 


          ----------------------------
          Mulliken population analysis
          ----------------------------

 Total      S,P,D,... shell population
 --------------------------------
    Atom          S        P
 --------------------------------------------------------------------------------------
     1 C      3.13046   2.86772
     2 C      3.13046   2.86772
     3 C      3.14136   2.91829
     4 C      3.14136   2.91829
     5 C      3.13936   2.92108
     6 C      3.13936   2.92108
     7 H      0.94130   0.00000
     8 H      0.94130   0.00000
     9 H      0.93940   0.00000
    10 H      0.93940   0.00000
    11 C      3.14423   2.91102
    12 C      3.14423   2.91102
    13 H      0.94236   0.00000
    14 H      0.94236   0.00000
    15 C      3.15536   2.96852
    16 C      3.15536   2.96852
    17 H      0.94099   0.00000
    18 H      0.94099   0.00000
    19 H      0.93855   0.00000
    20 H      0.93855   0.00000

          ----- Total      gross population on atoms ----

              1  C    6.0     5.99819
              2  C    6.0     5.99819
              3  C    6.0     6.05964
              4  C    6.0     6.05964
              5  C    6.0     6.06044
              6  C    6.0     6.06044
              7  H    1.0     0.94130
              8  H    1.0     0.94130
              9  H    1.0     0.93940
             10  H    1.0     0.93940
             11  C    6.0     6.05525
             12  C    6.0     6.05525
             13  H    1.0     0.94236
             14  H    1.0     0.94236
             15  C    6.0     6.12388
             16  C    6.0     6.12388
             17  H    1.0     0.94099
             18  H    1.0     0.94099
             19  H    1.0     0.93855
             20  H    1.0     0.93855

          ----- Bond indices -----
  1- 1   0.00000  1- 2   0.10626  1- 3   1.38193  1- 4   0.00279  1- 5   0.00275  1- 6   1.38295  1- 7   0.00424  1- 8   0.00578
  2- 1   0.10626  2- 2   0.00000  2- 3   0.00279  2- 4   1.38193  2- 5   1.38295  2- 6   0.00275  2- 7   0.00578  2- 8   0.00424
  3- 1   1.38193  3- 2   0.00279  3- 3   0.00000  3- 4   0.10295  3- 5   1.45716  3- 6   0.00319  3- 7   0.96964  3- 8   0.00013
  4- 1   0.00279  4- 2   1.38193  4- 3   0.10295  4- 4   0.00000  4- 5   0.00319  4- 6   1.45716  4- 7   0.00013  4- 8   0.96964
  5- 1   0.00275  5- 2   1.38295  5- 3   1.45716  5- 4   0.00319  5- 5   0.00000  5- 6   0.10403  5- 7   0.00361  5- 8   0.00552
  6- 1   1.38295  6- 2   0.00275  6- 3   0.00319  6- 4   1.45716  6- 5   0.10403  6- 6   0.00000  6- 7   0.00552  6- 8   0.00361
  7- 1   0.00424  7- 2   0.00578  7- 3   0.96964  7- 4   0.00013  7- 5   0.00361  7- 6   0.00552  7- 7   0.00000  7- 8   0.00004
  8- 1   0.00578  8- 2   0.00424  8- 3   0.00013  8- 4   0.96964  8- 5   0.00552  8- 6   0.00361  8- 7   0.00004  8- 8   0.00000
  9- 1   0.00576  9- 2   0.00399  9- 3   0.00355  9- 4   0.00556  9- 5   0.96856  9- 6   0.00012  9- 7   0.00242  9- 8   0.00090
 10- 1   0.00399 10- 2   0.00576 10- 3   0.00556 10- 4   0.00355 10- 5   0.00012 10- 6   0.96856 10- 7   0.00090 10- 8   0.00242
 11- 1   0.00009 11- 2   1.04125 11- 3   0.00604 11- 4   0.00482 11- 5   0.00419 11- 6   0.00560 11- 7   0.00073 11- 8   0.00219
 12- 1   1.04125 12- 2   0.00009 12- 3   0.00482 12- 4   0.00604 12- 5   0.00560 12- 6   0.00419 12- 7   0.00219 12- 8   0.00073
 13- 1   0.00002 13- 2   0.00530 13- 3   0.00056 13- 4   0.00153 13- 5   0.00486 13- 6   0.00004 13- 7   0.00019 13- 8   0.00103
 14- 1   0.00530 14- 2   0.00002 14- 3   0.00153 14- 4   0.00056 14- 5   0.00004 14- 6   0.00486 14- 7   0.00103 14- 8   0.00019
 15- 1   0.01730 15- 2   0.00290 15- 3   0.00022 15- 4   0.03251 15- 5   0.03040 15- 6   0.00057 15- 7   0.00001 15- 8   0.00006
 16- 1   0.00290 16- 2   0.01730 16- 3   0.03251 16- 4   0.00022 16- 5   0.00057 16- 6   0.03040 16- 7   0.00006 16- 8   0.00001
 17- 1   0.00000 17- 2   0.00360 17- 3   0.00007 17- 4   0.00009 17- 5   0.00012 17- 6   0.00001 17- 7   0.00001 17- 8   0.00001
 18- 1   0.00360 18- 2   0.00000 18- 3   0.00009 18- 4   0.00007 18- 5   0.00001 18- 6   0.00012 18- 7   0.00001 18- 8   0.00001
 19- 1   0.00002 19- 2   0.00807 19- 3   0.00000 19- 4   0.00060 19- 5   0.00028 19- 6   0.00015 19- 7   0.00001 19- 8   0.00004
 20- 1   0.00807 20- 2   0.00002 20- 3   0.00060 20- 4   0.00000 20- 5   0.00015 20- 6   0.00028 20- 7   0.00004 20- 8   0.00001
  1- 9   0.00576  1-10   0.00399  1-11   0.00009  1-12   1.04125  1-13   0.00002  1-14   0.00530  1-15   0.01730  1-16   0.00290
  2- 9   0.00399  2-10   0.00576  2-11   1.04125  2-12   0.00009  2-13   0.00530  2-14   0.00002  2-15   0.00290  2-16   0.01730
  3- 9   0.00355  3-10   0.00556  3-11   0.00604  3-12   0.00482  3-13   0.00056  3-14   0.00153  3-15   0.00022  3-16   0.03251
  4- 9   0.00556  4-10   0.00355  4-11   0.00482  4-12   0.00604  4-13   0.00153  4-14   0.00056  4-15   0.03251  4-16   0.00022
  5- 9   0.96856  5-10   0.00012  5-11   0.00419  5-12   0.00560  5-13   0.00486  5-14   0.00004  5-15   0.03040  5-16   0.00057
  6- 9   0.00012  6-10   0.96856  6-11   0.00560  6-12   0.00419  6-13   0.00004  6-14   0.00486  6-15   0.00057  6-16   0.03040
  7- 9   0.00242  7-10   0.00090  7-11   0.00073  7-12   0.00219  7-13   0.00019  7-14   0.00103  7-15   0.00001  7-16   0.00006
  8- 9   0.00090  8-10   0.00242  8-11   0.00219  8-12   0.00073  8-13   0.00103  8-14   0.00019  8-15   0.00006  8-16   0.00001
  9- 9   0.00000  9-10   0.00005  9-11   0.00246  9-12   0.00071  9-13   0.00006  9-14   0.00002  9-15   0.00014  9-16   0.00011
 10- 9   0.00005 10-10   0.00000 10-11   0.00071 10-12   0.00246 10-13   0.00002 10-14   0.00006 10-15   0.00011 10-16   0.00014
 11- 9   0.00246 11-10   0.00071 11-11   0.00000 11-12   0.00016 11-13   0.96770 11-14   0.00000 11-15   1.93049 11-16   0.00000
 12- 9   0.00071 12-10   0.00246 12-11   0.00016 12-12   0.00000 12-13   0.00000 12-14   0.96770 12-15   0.00000 12-16   1.93049
 13- 9   0.00006 13-10   0.00002 13-11   0.96770 13-12   0.00000 13-13   0.00000 13-14   0.00000 13-15   0.00271 13-16   0.00000
 14- 9   0.00002 14-10   0.00006 14-11   0.00000 14-12   0.96770 14-13   0.00000 14-14   0.00000 14-15   0.00000 14-16   0.00271
 15- 9   0.00014 15-10   0.00011 15-11   1.93049 15-12   0.00000 15-13   0.00271 15-14   0.00000 15-15   0.00000 15-16   0.00361
 16- 9   0.00011 16-10   0.00014 16-11   0.00000 16-12   1.93049 16-13   0.00000 16-14   0.00271 16-15   0.00361 16-16   0.00000
 17- 9   0.00181 17-10   0.00001 17-11   0.00302 17-12   0.00000 17-13   0.00911 17-14  -0.00000 17-15   0.97382 17-16   0.00000
 18- 9   0.00001 18-10   0.00181 18-11   0.00000 18-12   0.00302 18-13  -0.00000 18-14   0.00911 18-15   0.00000 18-16   0.97382
 19- 9   0.00007 19-10   0.00004 19-11   0.00273 19-12   0.00000 19-13   0.00355 19-14   0.00000 19-15   0.97585 19-16   0.00000
 20- 9   0.00004 20-10   0.00007 20-11   0.00000 20-12   0.00273 20-13   0.00000 20-14   0.00355 20-15   0.00000 20-16   0.97585
  1-17   0.00000  1-18   0.00360  1-19   0.00002  1-20   0.00807
  2-17   0.00360  2-18   0.00000  2-19   0.00807  2-20   0.00002
  3-17   0.00007  3-18   0.00009  3-19   0.00000  3-20   0.00060
  4-17   0.00009  4-18   0.00007  4-19   0.00060  4-20   0.00000
  5-17   0.00012  5-18   0.00001  5-19   0.00028  5-20   0.00015
  6-17   0.00001  6-18   0.00012  6-19   0.00015  6-20   0.00028
  7-17   0.00001  7-18   0.00001  7-19   0.00001  7-20   0.00004
  8-17   0.00001  8-18   0.00001  8-19   0.00004  8-20   0.00001
  9-17   0.00181  9-18   0.00001  9-19   0.00007  9-20   0.00004
 10-17   0.00001 10-18   0.00181 10-19   0.00004 10-20   0.00007
 11-17   0.00302 11-18   0.00000 11-19   0.00273 11-20   0.00000
 12-17   0.00000 12-18   0.00302 12-19   0.00000 12-20   0.00273
 13-17   0.00911 13-18  -0.00000 13-19   0.00355 13-20   0.00000
 14-17  -0.00000 14-18   0.00911 14-19   0.00000 14-20   0.00355
 15-17   0.97382 15-18   0.00000 15-19   0.97585 15-20   0.00000
 16-17   0.00000 16-18   0.97382 16-19   0.00000 16-20   0.97585
 17-17   0.00000 17-18   0.00000 17-19   0.00483 17-20  -0.00000
 18-17   0.00000 18-18   0.00000 18-19  -0.00000 18-20   0.00483
 19-17   0.00483 19-18  -0.00000 19-19   0.00000 19-20   0.00000
 20-17  -0.00000 20-18   0.00483 20-19   0.00000 20-20   0.00000

 Large bond indices
 ------------------
  1   C -  2   C    0.10626
  1   C -  3   C    1.38193
  1   C -  6   C    1.38295
  1   C - 12   C    1.04125
  2   C -  4   C    1.38193
  2   C -  5   C    1.38295
  2   C - 11   C    1.04125
  3   C -  4   C    0.10295
  3   C -  5   C    1.45716
  3   C -  7   H    0.96964
  4   C -  6   C    1.45716
  4   C -  8   H    0.96964
  5   C -  6   C    0.10403
  5   C -  9   H    0.96856
  6   C - 10   H    0.96856
 11   C - 13   H    0.96770
 11   C - 15   C    1.93049
 12   C - 14   H    0.96770
 12   C - 16   C    1.93049
 15   C - 17   H    0.97382
 15   C - 19   H    0.97585
 16   C - 18   H    0.97382
 16   C - 20   H    0.97585

                                                                Free electrons             Valency
                              Number of         Sum of          + Bond indices         - Bond indices    
                Valency     Free electrons    Bond indices     =Mulliken charge     = Net spin population
     1  C       3.97499        2.02320          3.97499           5.99819                 0.00000
     2  C       3.97499        2.02320          3.97499           5.99819                -0.00000
     3  C       3.97333        2.08632          3.97333           6.05964                -0.00000
     4  C       3.97333        2.08632          3.97333           6.05964                 0.00000
     5  C       3.97410        2.08634          3.97410           6.06044                -0.00000
     6  C       3.97410        2.08634          3.97410           6.06044                 0.00000
     7  H       0.99655       -0.05526          0.99655           0.94130                 0.00000
     8  H       0.99655       -0.05526          0.99655           0.94130                 0.00000
     9  H       0.99633       -0.05693          0.99633           0.93940                 0.00000
    10  H       0.99633       -0.05693          0.99633           0.93940                 0.00000
    11  C       3.97218        2.08307          3.97218           6.05525                -0.00000
    12  C       3.97218        2.08307          3.97218           6.05525                 0.00000
    13  H       0.99668       -0.05431          0.99668           0.94236                -0.00000
    14  H       0.99668       -0.05431          0.99668           0.94236                -0.00000
    15  C       3.97069        2.15320          3.97069           6.12388                 0.00000
    16  C       3.97069        2.15320          3.97069           6.12388                 0.00000
    17  H       0.99652       -0.05553          0.99652           0.94099                -0.00000
    18  H       0.99652       -0.05553          0.99652           0.94099                -0.00000
    19  H       0.99622       -0.05768          0.99622           0.93855                -0.00000
    20  H       0.99622       -0.05768          0.99622           0.93855                -0.00000

 Task  times  cpu:        2.7s     wall:        3.6s
 Summary of allocated global arrays
-----------------------------------
  No active global arrays



                         GA Statistics for process    0
                         ------------------------------

       create   destroy   get      put      acc     scatter   gather  read&inc
calls:  749      749     3.09e+04 6043     3.18e+04  420        0     8127     
number of processes/call 1.00e+00 1.00e+00 1.00e+00 1.00e+00 0.00e+00
bytes total:             1.26e+07 7.29e+06 3.97e+06 3.09e+04 0.00e+00 6.50e+04
bytes remote:            0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00
Max memory consumed for GA by this process: 427200 bytes
MA_summarize_allocated_blocks: starting scan ...
MA_summarize_allocated_blocks: scan completed: 0 heap blocks, 0 stack blocks
MA usage statistics:

	allocation statistics:
					      heap	     stack
					      ----	     -----
	current number of blocks	         0	         0
	maximum number of blocks	        18	        14
	current total bytes		         0	         0
	maximum total bytes		   9986520	  22510808
	maximum total K-bytes		      9987	     22511
	maximum total M-bytes		        10	        23


                                NWChem Input Module
                                -------------------





                                     CITATION
                                     --------
                Please cite the following reference when publishing
                           results obtained with NWChem:

                 M. Valiev, E.J. Bylaska, N. Govind, K. Kowalski,
              T.P. Straatsma, H.J.J. van Dam, D. Wang, J. Nieplocha,
                        E. Apra, T.L. Windus, W.A. de Jong
                 "NWChem: a comprehensive and scalable open-source
                  solution for large scale molecular simulations"
                      Comput. Phys. Commun. 181, 1477 (2010)
                           doi:10.1016/j.cpc.2010.04.018

                                      AUTHORS
                                      -------
          E. Apra, E. J. Bylaska, W. A. de Jong, N. Govind, K. Kowalski,
       T. P. Straatsma, M. Valiev, H. J. J. van Dam, D. Wang, T. L. Windus,
        J. Hammond, J. Autschbach, K. Bhaskaran-Nair, J. Brabec, K. Lopata,
        S. Krishnamoorthy, W. Ma, M. Klemm, O. Villa, Y. Chen, V. Anisimov,
    F. Aquino, S. Hirata, M. T. Hackler, T. Risthaus, M. Malagoli, A. Marenich,
   A. Otero-de-la-Roza, J. Mullin, P. Nichols, R. Peverati, J. Pittner, Y. Zhao,
         P.-D. Fan, A. Fonari, R. J. Harrison, M. Dupuis, D. Silverstein,
    D. M. A. Smith, J. Nieplocha, V. Tipparaju, M. Krishnan, B. E. Van Kuiken,
        A. Vazquez-Mayagoitia, L. Jensen, M. Swart, Q. Wu, T. Van Voorhis,
     A. A. Auer, M. Nooijen, L. D. Crosby, E. Brown, G. Cisneros, G. I. Fann,
   H. Fruchtl, J. Garza, K. Hirao, R. A. Kendall, J. A. Nichols, K. Tsemekhman,
    K. Wolinski, J. Anchell, D. E. Bernholdt, P. Borowski, T. Clark, D. Clerc,
   H. Dachsel, M. J. O. Deegan, K. Dyall, D. Elwood, E. Glendening, M. Gutowski,
   A. C. Hess, J. Jaffe, B. G. Johnson, J. Ju, R. Kobayashi, R. Kutteh, Z. Lin,
   R. Littlefield, X. Long, B. Meng, T. Nakajima, S. Niu, L. Pollack, M. Rosing,
   K. Glaesemann, G. Sandrone, M. Stave, H. Taylor, G. Thomas, J. H. van Lenthe,
                               A. T. Wong, Z. Zhang.

 Total times  cpu:        2.8s     wall:        5.5s