File: dvb_raman.fchk

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Notitle                                                                 
Freq      RB3LYP                                                      STO-3G              
Number of atoms                            I               20
Info1-9                                    I   N=           9
          83          83           0           0           0         100
           6          18        -502
Charge                                     I                0
Multiplicity                               I                1
Number of electrons                        I               70
Number of alpha electrons                  I               35
Number of beta electrons                   I               35
Number of basis functions                  I               60
Number of independent functions            I               60
Number of point charges in /Mol/           I                0
Number of translation vectors              I                0
Atomic numbers                             I   N=          20
           6           6           6           6           6           1
           1           1           6           6           1           1
           1           6           1           6           1           1
           6           1
Nuclear charges                            R   N=          20
  6.00000000E+00  6.00000000E+00  6.00000000E+00  6.00000000E+00  6.00000000E+00
  1.00000000E+00  1.00000000E+00  1.00000000E+00  6.00000000E+00  6.00000000E+00
  1.00000000E+00  1.00000000E+00  1.00000000E+00  6.00000000E+00  1.00000000E+00
  6.00000000E+00  1.00000000E+00  1.00000000E+00  6.00000000E+00  1.00000000E+00
Current cartesian coordinates              R   N=          60
  5.09245181E-01 -2.66467888E+00 -6.16297582E-32 -2.01208948E+00 -1.73987026E+00
  0.00000000E+00 -2.50470684E+00  8.63658865E-01  2.46519033E-32 -5.09245181E-01
  2.66467888E+00  1.23259516E-32  2.01208948E+00  1.73987026E+00  1.23259516E-32
 -3.59885866E+00 -3.07571066E+00 -1.23259516E-32 -4.46877151E+00  1.53666346E+00
  0.00000000E+00  3.59885866E+00  3.07571066E+00  1.23259516E-32 -1.14088779E+00
  5.42335670E+00  1.23259516E-31  5.09245181E-01  7.35472327E+00  4.93038066E-32
  2.56089320E+00  7.07138071E+00  2.04148574E-32 -3.17833820E+00  5.83926410E+00
  1.23259516E-31 -1.39893764E-01  9.32196137E+00  2.71170936E-31  1.14088779E+00
 -5.42335670E+00  0.00000000E+00  3.17833820E+00 -5.83926410E+00 -1.23259516E-31
 -5.09245181E-01 -7.35472327E+00 -1.23259516E-31 -2.56089320E+00 -7.07138071E+00
 -1.19022471E-31  1.39893764E-01 -9.32196137E+00  1.47911420E-31  2.50470684E+00
 -8.63658865E-01  0.00000000E+00  4.46877151E+00 -1.53666346E+00  0.00000000E+00
Force Field                                I                0
Int Atom Types                             I   N=          20
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0
MM charges                                 R   N=          20
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
Integer atomic weights                     I   N=          20
          12          12          12          12          12           1
           1           1          12          12           1           1
           1          12           1          12           1           1
          12           1
Real atomic weights                        R   N=          20
  1.20000000E+01  1.20000000E+01  1.20000000E+01  1.20000000E+01  1.20000000E+01
  1.00782504E+00  1.00782504E+00  1.00782504E+00  1.20000000E+01  1.20000000E+01
  1.00782504E+00  1.00782504E+00  1.00782504E+00  1.20000000E+01  1.00782504E+00
  1.20000000E+01  1.00782504E+00  1.00782504E+00  1.20000000E+01  1.00782504E+00
Atom fragment info                         I   N=          20
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0
Atom residue num                           I   N=          20
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0
Nuclear spins                              I   N=          20
           0           0           0           0           0           1
           1           1           0           0           1           1
           1           0           1           0           1           1
           0           1
Nuclear ZEff                               R   N=          20
 -3.60000000E+00 -3.60000000E+00 -3.60000000E+00 -3.60000000E+00 -3.60000000E+00
 -1.00000000E+00 -1.00000000E+00 -1.00000000E+00 -3.60000000E+00 -3.60000000E+00
 -1.00000000E+00 -1.00000000E+00 -1.00000000E+00 -3.60000000E+00 -1.00000000E+00
 -3.60000000E+00 -1.00000000E+00 -1.00000000E+00 -3.60000000E+00 -1.00000000E+00
Nuclear QMom                               R   N=          20
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
Nuclear GFac                               R   N=          20
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  2.79284600E+00  2.79284600E+00  2.79284600E+00  0.00000000E+00  0.00000000E+00
  2.79284600E+00  2.79284600E+00  2.79284600E+00  0.00000000E+00  2.79284600E+00
  0.00000000E+00  2.79284600E+00  2.79284600E+00  0.00000000E+00  2.79284600E+00
MicOpt                                     I   N=          20
          -1          -1          -1          -1          -1          -1
          -1          -1          -1          -1          -1          -1
          -1          -1          -1          -1          -1          -1
          -1          -1
Number of contracted shells                I               30
Number of primitive shells                 I               90
Pure/Cartesian d shells                    I                0
Pure/Cartesian f shells                    I                0
Highest angular momentum                   I                1
Largest degree of contraction              I                3
Shell types                                I   N=          30
           0          -1           0          -1           0          -1
           0          -1           0          -1           0           0
           0           0          -1           0          -1           0
           0           0           0          -1           0           0
          -1           0           0           0          -1           0
Number of primitives per shell             I   N=          30
           3           3           3           3           3           3
           3           3           3           3           3           3
           3           3           3           3           3           3
           3           3           3           3           3           3
           3           3           3           3           3           3
Shell to atom map                          I   N=          30
           1           1           2           2           3           3
           4           4           5           5           6           7
           8           9           9          10          10          11
          12          13          14          14          15          16
          16          17          18          19          19          20
Primitive exponents                        R   N=          90
  7.16168373E+01  1.30450963E+01  3.53051216E+00  2.94124936E+00  6.83483096E-01
  2.22289916E-01  7.16168373E+01  1.30450963E+01  3.53051216E+00  2.94124936E+00
  6.83483096E-01  2.22289916E-01  7.16168373E+01  1.30450963E+01  3.53051216E+00
  2.94124936E+00  6.83483096E-01  2.22289916E-01  7.16168373E+01  1.30450963E+01
  3.53051216E+00  2.94124936E+00  6.83483096E-01  2.22289916E-01  7.16168373E+01
  1.30450963E+01  3.53051216E+00  2.94124936E+00  6.83483096E-01  2.22289916E-01
  3.42525091E+00  6.23913730E-01  1.68855404E-01  3.42525091E+00  6.23913730E-01
  1.68855404E-01  3.42525091E+00  6.23913730E-01  1.68855404E-01  7.16168373E+01
  1.30450963E+01  3.53051216E+00  2.94124936E+00  6.83483096E-01  2.22289916E-01
  7.16168373E+01  1.30450963E+01  3.53051216E+00  2.94124936E+00  6.83483096E-01
  2.22289916E-01  3.42525091E+00  6.23913730E-01  1.68855404E-01  3.42525091E+00
  6.23913730E-01  1.68855404E-01  3.42525091E+00  6.23913730E-01  1.68855404E-01
  7.16168373E+01  1.30450963E+01  3.53051216E+00  2.94124936E+00  6.83483096E-01
  2.22289916E-01  3.42525091E+00  6.23913730E-01  1.68855404E-01  7.16168373E+01
  1.30450963E+01  3.53051216E+00  2.94124936E+00  6.83483096E-01  2.22289916E-01
  3.42525091E+00  6.23913730E-01  1.68855404E-01  3.42525091E+00  6.23913730E-01
  1.68855404E-01  7.16168373E+01  1.30450963E+01  3.53051216E+00  2.94124936E+00
  6.83483096E-01  2.22289916E-01  3.42525091E+00  6.23913730E-01  1.68855404E-01
Contraction coefficients                   R   N=          90
  1.54328967E-01  5.35328142E-01  4.44634542E-01 -9.99672292E-02  3.99512826E-01
  7.00115469E-01  1.54328967E-01  5.35328142E-01  4.44634542E-01 -9.99672292E-02
  3.99512826E-01  7.00115469E-01  1.54328967E-01  5.35328142E-01  4.44634542E-01
 -9.99672292E-02  3.99512826E-01  7.00115469E-01  1.54328967E-01  5.35328142E-01
  4.44634542E-01 -9.99672292E-02  3.99512826E-01  7.00115469E-01  1.54328967E-01
  5.35328142E-01  4.44634542E-01 -9.99672292E-02  3.99512826E-01  7.00115469E-01
  1.54328967E-01  5.35328142E-01  4.44634542E-01  1.54328967E-01  5.35328142E-01
  4.44634542E-01  1.54328967E-01  5.35328142E-01  4.44634542E-01  1.54328967E-01
  5.35328142E-01  4.44634542E-01 -9.99672292E-02  3.99512826E-01  7.00115469E-01
  1.54328967E-01  5.35328142E-01  4.44634542E-01 -9.99672292E-02  3.99512826E-01
  7.00115469E-01  1.54328967E-01  5.35328142E-01  4.44634542E-01  1.54328967E-01
  5.35328142E-01  4.44634542E-01  1.54328967E-01  5.35328142E-01  4.44634542E-01
  1.54328967E-01  5.35328142E-01  4.44634542E-01 -9.99672292E-02  3.99512826E-01
  7.00115469E-01  1.54328967E-01  5.35328142E-01  4.44634542E-01  1.54328967E-01
  5.35328142E-01  4.44634542E-01 -9.99672292E-02  3.99512826E-01  7.00115469E-01
  1.54328967E-01  5.35328142E-01  4.44634542E-01  1.54328967E-01  5.35328142E-01
  4.44634542E-01  1.54328967E-01  5.35328142E-01  4.44634542E-01 -9.99672292E-02
  3.99512826E-01  7.00115469E-01  1.54328967E-01  5.35328142E-01  4.44634542E-01
P(S=P) Contraction coefficients            R   N=          90
  0.00000000E+00  0.00000000E+00  0.00000000E+00  1.55916275E-01  6.07683719E-01
  3.91957393E-01  0.00000000E+00  0.00000000E+00  0.00000000E+00  1.55916275E-01
  6.07683719E-01  3.91957393E-01  0.00000000E+00  0.00000000E+00  0.00000000E+00
  1.55916275E-01  6.07683719E-01  3.91957393E-01  0.00000000E+00  0.00000000E+00
  0.00000000E+00  1.55916275E-01  6.07683719E-01  3.91957393E-01  0.00000000E+00
  0.00000000E+00  0.00000000E+00  1.55916275E-01  6.07683719E-01  3.91957393E-01
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  1.55916275E-01  6.07683719E-01  3.91957393E-01
  0.00000000E+00  0.00000000E+00  0.00000000E+00  1.55916275E-01  6.07683719E-01
  3.91957393E-01  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  1.55916275E-01  6.07683719E-01
  3.91957393E-01  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  1.55916275E-01  6.07683719E-01  3.91957393E-01
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  1.55916275E-01
  6.07683719E-01  3.91957393E-01  0.00000000E+00  0.00000000E+00  0.00000000E+00
Coordinates of each shell                  R   N=          90
  5.09245181E-01 -2.66467888E+00 -3.12754701E-32  5.09245181E-01 -2.66467888E+00
 -3.12754701E-32 -2.01208948E+00 -1.73987026E+00 -2.76457861E-32 -2.01208948E+00
 -1.73987026E+00 -2.76457861E-32 -2.50470684E+00  8.63658865E-01  2.92719356E-33
 -2.50470684E+00  8.63658865E-01  2.92719356E-33 -5.09245181E-01  2.66467888E+00
  8.57618714E-33 -5.09245181E-01  2.66467888E+00  8.57618714E-33  2.01208948E+00
  1.73987026E+00  4.17239254E-32  2.01208948E+00  1.73987026E+00  4.17239254E-32
 -3.59885866E+00 -3.07571066E+00 -4.90009003E-32 -4.46877151E+00  1.53666346E+00
  5.17037414E-33  3.59885866E+00  3.07571066E+00  7.44047276E-32 -1.14088779E+00
  5.42335670E+00  6.33324006E-32 -1.14088779E+00  5.42335670E+00  6.33324006E-32
  5.09245181E-01  7.35472327E+00  9.22231962E-32  5.09245181E-01  7.35472327E+00
  9.22231962E-32  2.56089320E+00  7.07138071E+00  9.50528581E-32 -3.17833820E+00
  5.83926410E+00  6.21804762E-32 -1.39893764E-01  9.32196137E+00  1.14470964E-31
  1.14088779E+00 -5.42335670E+00 -1.58458567E-32  1.14088779E+00 -5.42335670E+00
 -1.58458567E-32  3.17833820E+00 -5.83926410E+00  1.29828102E-32 -5.09245181E-01
 -7.35472327E+00 -5.31731460E-32 -5.09245181E-01 -7.35472327E+00 -5.31731460E-32
 -2.56089320E+00 -7.07138071E+00 -8.30375555E-32  1.39893764E-01 -9.32196137E+00
 -5.52956178E-32  2.50470684E+00 -8.63658865E-01  3.32684105E-32  2.50470684E+00
 -8.63658865E-01  3.32684105E-32  4.46877151E+00 -1.53666346E+00  5.93819071E-32
Constraint Structure                       R   N=          60
  5.09245181E-01 -2.66467888E+00 -3.12754701E-32 -2.01208948E+00 -1.73987026E+00
 -2.76457861E-32 -2.50470684E+00  8.63658865E-01  2.92719356E-33 -5.09245181E-01
  2.66467888E+00  8.57618714E-33  2.01208948E+00  1.73987026E+00  4.17239254E-32
 -3.59885866E+00 -3.07571066E+00 -4.90009003E-32 -4.46877151E+00  1.53666346E+00
  5.17037414E-33  3.59885866E+00  3.07571066E+00  7.44047276E-32 -1.14088779E+00
  5.42335670E+00  6.33324006E-32  5.09245181E-01  7.35472327E+00  9.22231962E-32
  2.56089320E+00  7.07138071E+00  9.50528581E-32 -3.17833820E+00  5.83926410E+00
  6.21804762E-32 -1.39893764E-01  9.32196137E+00  1.14470964E-31  1.14088779E+00
 -5.42335670E+00 -1.58458567E-32  3.17833820E+00 -5.83926410E+00  1.29828102E-32
 -5.09245181E-01 -7.35472327E+00 -5.31731460E-32 -2.56089320E+00 -7.07138071E+00
 -8.30375555E-32  1.39893764E-01 -9.32196137E+00 -5.52956178E-32  2.50470684E+00
 -8.63658865E-01  3.32684105E-32  4.46877151E+00 -1.53666346E+00  5.93819071E-32
Num ILSW                                   I              100
ILSW                                       I   N=         100
           0           0           0           0           2           0
           0           0           0           0         402          -1
           0           0           0           0           0           0
           0           0           0           0           1           0
           1           0           0           0           0           0
           0           0      100000           0          -1           0
           0           0           0           0           0           0
           0           0           0           1           0           0
           0           0           1           0           0           0
           0           0           4          40           0           0
           0           0           5           0           0           0
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0
Num RLSW                                   I               40
RLSW                                       R   N=          40
  8.00000000E-01  7.20000000E-01  1.00000000E+00  8.10000000E-01  2.00000000E-01
  0.00000000E+00  0.00000000E+00  1.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  1.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  1.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  1.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  1.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  1.00000000E+00  1.00000000E+00
MxBond                                     I                3
NBond                                      I   N=          20
           3           3           3           3           3           1
           1           1           3           3           1           1
           1           3           1           3           1           1
           3           1
IBond                                      I   N=          60
           2          14          19           1           3           6
           2           4           7           3           5           9
           4           8          19           2           0           0
           3           0           0           5           0           0
           4          10          12           9          11          13
          10           0           0           9           0           0
          10           0           0           1          15          16
          14           0           0          14          17          18
          16           0           0          16           0           0
           1           5          20          19           0           0
RBond                                      R   N=          60
  1.50000000E+00  1.00000000E+00  1.50000000E+00  1.50000000E+00  1.50000000E+00
  1.00000000E+00  1.50000000E+00  1.50000000E+00  1.00000000E+00  1.50000000E+00
  1.50000000E+00  1.00000000E+00  1.50000000E+00  1.00000000E+00  1.50000000E+00
  1.00000000E+00  0.00000000E+00  0.00000000E+00  1.00000000E+00  0.00000000E+00
  0.00000000E+00  1.00000000E+00  0.00000000E+00  0.00000000E+00  1.00000000E+00
  2.00000000E+00  1.00000000E+00  2.00000000E+00  1.00000000E+00  1.00000000E+00
  1.00000000E+00  0.00000000E+00  0.00000000E+00  1.00000000E+00  0.00000000E+00
  0.00000000E+00  1.00000000E+00  0.00000000E+00  0.00000000E+00  1.00000000E+00
  1.00000000E+00  2.00000000E+00  1.00000000E+00  0.00000000E+00  0.00000000E+00
  2.00000000E+00  1.00000000E+00  1.00000000E+00  1.00000000E+00  0.00000000E+00
  0.00000000E+00  1.00000000E+00  0.00000000E+00  0.00000000E+00  1.50000000E+00
  1.50000000E+00  1.00000000E+00  1.00000000E+00  0.00000000E+00  0.00000000E+00
Virial Ratio                               R      2.017190276320693E+00
SCF Energy                                 R     -3.823082665796809E+02
Total Energy                               R     -3.823082665796809E+02
RMS Force                                  R      1.616197629418586E-05
RMS Density                                R      3.543009383833903E-09
External E-field                           R   N=          35
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
IOpCl                                      I                0
IROHF                                      I                0
Alpha Orbital Energies                     R   N=          60
 -1.00202096E+01 -1.00201622E+01 -1.00081157E+01 -1.00081147E+01 -1.00067891E+01
 -1.00067846E+01 -1.00060521E+01 -1.00059144E+01 -9.99233024E+00 -9.99233016E+00
 -8.09506061E-01 -7.53985809E-01 -7.17965539E-01 -6.99781034E-01 -6.67505484E-01
 -5.88691348E-01 -5.58922466E-01 -5.31666747E-01 -5.10168316E-01 -4.57444573E-01
 -4.39364800E-01 -4.10598063E-01 -3.97956321E-01 -3.96069607E-01 -3.73965768E-01
 -3.51150566E-01 -3.47294941E-01 -3.24506519E-01 -3.11253734E-01 -2.92784331E-01
 -2.87457965E-01 -2.63546361E-01 -2.12447430E-01 -1.95050018E-01 -1.53084114E-01
  3.74216500E-02  9.03643378E-02  1.10612276E-01  1.82203544E-01  2.72526502E-01
  3.32229804E-01  3.40727279E-01  3.79364528E-01  3.81454162E-01  4.10968740E-01
  4.11951251E-01  4.26761994E-01  4.39639701E-01  4.52761952E-01  4.78263094E-01
  5.26242392E-01  5.45823696E-01  5.76012357E-01  5.99439570E-01  6.24983129E-01
  6.39713262E-01  6.82794873E-01  7.17243827E-01  7.79557625E-01  7.94579008E-01
Alpha MO coefficients                      R   N=        3600
  6.99293900E-01  3.15673159E-02 -5.32799981E-05  9.12425796E-04  0.00000000E+00
 -1.91483903E-02 -7.71298165E-03 -4.20385000E-03  1.23238264E-03  0.00000000E+00
  1.85786397E-02  7.72503712E-03  3.46073811E-03  2.71859443E-03  0.00000000E+00
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  1.91483903E-02  7.71298165E-03 -4.20385000E-03  1.23238264E-03  0.00000000E+00
  3.32654800E-04 -3.32908476E-04 -3.32654800E-04  2.74413994E-02  6.72591925E-03
  1.00511770E-03 -3.94792741E-03  0.00000000E+00 -1.80414371E-04 -4.74536651E-04
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  2.87435043E-05 -2.74413994E-02 -6.72591925E-03  1.00511770E-03 -3.94792741E-03
  0.00000000E+00  3.25994760E-04  1.80414371E-04  4.74536651E-04 -1.13126589E-05
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 -2.01375581E-02  1.50679460E-01 -4.57267929E-02  2.14264350E-01  0.00000000E+00
  1.05789866E-01  1.82013507E-02 -1.05789866E-01 -6.13986973E-02  4.65576136E-01
  5.97565757E-01  4.77427293E-01  0.00000000E+00  7.10374759E-02 -5.36143612E-01
  3.80187958E-01  5.50043692E-01  0.00000000E+00 -1.13304522E-02  1.73735754E-01
 -9.36251330E-02  6.13986973E-02 -4.65576136E-01  5.97565757E-01  4.77427293E-01
  0.00000000E+00 -1.73735754E-01 -7.10374759E-02  5.36143612E-01  3.80187958E-01
  5.50043692E-01  0.00000000E+00  1.13304522E-02  9.36251330E-02 -4.64032895E-02
  3.35440582E-01 -1.96276015E-01 -1.32429716E-01  0.00000000E+00 -1.82013507E-02
 -4.98601201E-03  3.29873782E-02  7.00281329E-01  6.58834751E-02  0.00000000E+00
 -7.07883750E-03  4.80594804E-02  4.46424575E-01 -4.02631171E-01  0.00000000E+00
  7.08459353E-03 -4.89761682E-02 -2.24624231E-01 -5.41565706E-01  0.00000000E+00
 -4.98601201E-03  3.29873782E-02 -7.00281329E-01 -6.58834751E-02  0.00000000E+00
 -7.07883750E-03  4.80594804E-02 -4.46424575E-01  4.02631171E-01  0.00000000E+00
  4.17405119E-02 -6.60394917E-03  4.17405119E-02 -2.70662275E-02  2.15366412E-01
  4.21070501E-01  3.30643211E-01  0.00000000E+00  4.14808623E-02 -3.24470234E-01
  2.47417636E-01  3.24877381E-01  0.00000000E+00 -3.39925466E-02  1.58361168E-01
 -4.71837936E-02 -2.70662275E-02  2.15366412E-01 -4.21070501E-01 -3.30643211E-01
  0.00000000E+00  1.58361168E-01  4.14808623E-02 -3.24470234E-01 -2.47417636E-01
 -3.24877381E-01  0.00000000E+00 -3.39925466E-02 -4.71837936E-02  7.08459353E-03
 -4.89761682E-02  2.24624231E-01  5.41565706E-01  0.00000000E+00 -6.60394917E-03
 -4.43898297E-02  3.30318084E-01 -1.86526782E-01  6.53443815E-01  0.00000000E+00
  5.72774658E-02 -4.18029202E-01 -4.91926619E-01 -4.00912711E-01  0.00000000E+00
 -5.13601218E-02  3.72352843E-01  5.71785347E-01 -2.27208440E-01  0.00000000E+00
  4.43898297E-02 -3.30318084E-01 -1.86526782E-01  6.53443815E-01  0.00000000E+00
 -5.72774658E-02  4.18029202E-01 -4.91926619E-01 -4.00912711E-01  0.00000000E+00
 -2.75589660E-01  2.69652129E-01  2.75589660E-01  1.25429926E-02 -7.68421679E-02
 -2.55407293E-02  3.62508191E-01  0.00000000E+00  1.01194091E-02 -8.59139058E-02
  2.20128184E-01  1.10044883E-02  0.00000000E+00 -1.35640169E-01 -4.54923905E-02
  6.41797038E-02 -1.25429926E-02  7.68421679E-02 -2.55407293E-02  3.62508191E-01
  0.00000000E+00  4.54923905E-02 -1.01194091E-02  8.59139058E-02  2.20128184E-01
  1.10044883E-02  0.00000000E+00  1.35640169E-01 -6.41797038E-02  5.13601218E-02
 -3.72352843E-01  5.71785347E-01 -2.27208440E-01  0.00000000E+00 -2.69652129E-01
Total SCF Density                          R   N=        1830
  2.06611640E+00 -2.06251547E-01  8.42029584E-01  2.34880957E-04  3.43909272E-03
  6.03781228E-01  1.23086026E-03 -1.89619612E-02  2.97008070E-03  5.96752099E-01
  3.55834947E-35 -5.04684442E-34  3.80345952E-33  1.65682640E-32  7.72475793E-01
  2.48336181E-02 -6.53067990E-02  1.06999971E-01 -3.58493007E-02 -3.34784450E-34
  2.06661314E+00 -6.58599361E-02  9.14669131E-02 -2.74319020E-01  8.82379333E-02
  0.00000000E+00 -2.04098814E-01  8.26293860E-01 -1.05425282E-01  2.70565441E-01
 -4.15154410E-01  1.46400980E-01 -2.18460625E-33  3.89017779E-03 -1.94815854E-02
  6.12008107E-01  3.97145769E-02 -9.75467812E-02  1.59240819E-01 -2.71519647E-02
 -4.00511145E-33  3.39353670E-03 -2.02685889E-02  1.28873277E-02  6.08183789E-01
  4.51686435E-34 -1.03781477E-33  1.85770134E-33  1.49249640E-34  4.72630173E-01
  1.18089352E-34 -6.82181244E-34  4.12920046E-33  1.69464232E-32  7.98970624E-01
 -4.63727099E-03  1.44030139E-02 -1.57546571E-02  1.46948818E-02  3.10443334E-34
  2.54938803E-02 -6.67355188E-02  1.85532449E-02 -1.14066079E-01 -3.04909601E-33
  2.06693263E+00  1.40854533E-02 -3.45972147E-02  5.16967804E-02 -5.92080276E-02
  0.00000000E+00 -6.66221858E-02  8.88120277E-02 -3.81074862E-02  2.90673754E-01
  0.00000000E+00 -2.05642436E-01  8.32475714E-01  1.41757585E-02 -5.97724696E-02
  4.94237004E-02 -1.72031629E-02  2.60742553E-34 -2.42970095E-02  7.04016868E-02
  4.14374779E-03  8.82692627E-02 -2.45314404E-33  4.46938542E-03 -2.41093610E-02
  6.16342923E-01 -1.97395379E-02  6.83460848E-02 -5.87798398E-02  5.54121618E-02
  4.78028014E-34  1.13367809E-01 -2.86367968E-01  8.76380675E-02 -4.46038490E-01
 -4.49743074E-33 -2.70448661E-03  1.62561491E-02 -7.84872225E-03  6.02490867E-01
 -4.60079471E-34  1.52709242E-33 -1.32556722E-33  1.43074448E-33 -5.64105308E-02
  2.99433193E-33 -7.50807100E-33  2.45603863E-33 -1.18261586E-32  5.30727170E-01
 -4.74598709E-35  3.02252732E-34  3.58083485E-33  1.66607434E-32  7.98965830E-01
 -4.16955443E-03  1.46330823E-02 -2.39801763E-03  1.23072722E-02  3.26543470E-34
 -4.52360880E-03  1.36114406E-02  6.21078233E-03  2.30890009E-02  6.78613195E-34
  2.45985420E-02 -6.51833615E-02 -8.36804924E-02 -7.47632096E-02 -2.58915819E-33
  2.06611640E+00  1.46330823E-02 -5.09726975E-02  9.36125520E-03 -4.61066973E-02
 -6.10500942E-34  1.38462418E-02 -3.27533043E-02 -3.14529351E-02 -8.31045019E-02
 -1.24930667E-33 -6.49530726E-02  9.09777548E-02  2.19397908E-01  1.87042099E-01
  3.26972785E-33 -2.06251547E-01  8.42029584E-01  2.39801763E-03 -9.36125520E-03
 -5.46299725E-02 -1.82490613E-02  6.46390696E-35 -9.08635416E-03  2.56810044E-02
  2.49530789E-02  4.62047145E-02  8.07911205E-34  8.53606307E-02 -2.20203362E-01
 -2.56686844E-01 -2.47953852E-01 -4.95564589E-33 -2.34880957E-04 -3.43909272E-03
  6.03781228E-01 -1.23072722E-02  4.61066973E-02 -1.82490613E-02  3.88720716E-02
  1.94089746E-33 -1.99352791E-02  7.52830067E-02  6.14145055E-03  8.34512974E-02
  1.44705419E-33  7.46328672E-02 -1.90540728E-01 -2.40143561E-01 -1.91165467E-01
 -5.56993649E-33 -1.23086026E-03  1.89619612E-02  2.97008070E-03  5.96752099E-01
 -3.26543470E-34  6.10500942E-34  5.50673917E-34  1.69788004E-33 -3.15454651E-01
 -6.08871874E-34  1.12306224E-33  3.42678002E-34  1.52535272E-33 -5.86157632E-02
  2.59589801E-33 -3.32072427E-33 -5.57371085E-33 -5.23081986E-33  4.71439714E-01
 -3.55834947E-35  5.04684442E-34  3.80345952E-33  1.65682640E-32  7.72475793E-01
 -4.52360880E-03  1.38462418E-02  9.08635416E-03  1.99352791E-02  6.08871874E-34
 -4.15780288E-03  1.42216170E-02  9.11273269E-03  7.58799829E-03  2.66602476E-34
 -5.16349307E-03  1.75476822E-02  2.26334932E-02  7.49211181E-03  3.47271339E-34
  2.48336181E-02 -6.53067990E-02 -1.06999971E-01  3.58493007E-02  3.34784450E-34
  2.06661314E+00  1.36114406E-02 -3.27533043E-02 -2.56810044E-02 -7.52830067E-02
 -1.12306224E-33  1.42216170E-02 -4.77857750E-02 -3.40716012E-02 -2.71992817E-02
 -4.82155387E-34  1.76234648E-02 -5.05178867E-02 -8.89670458E-02 -2.23878531E-02
 -5.84596420E-34 -6.58599361E-02  9.14669131E-02  2.74319020E-01 -8.82379333E-02
  0.00000000E+00 -2.04098814E-01  8.26293860E-01 -6.21078233E-03  3.14529351E-02
  2.49530789E-02  6.14145055E-03  2.52366119E-34 -9.11273269E-03  3.40716012E-02
  8.12987305E-04  4.34118799E-02  1.09847274E-33 -2.42054001E-02  9.25951026E-02
  8.94458795E-02  4.32091583E-02  9.51680362E-34  1.05425282E-01 -2.70565441E-01
 -4.15154410E-01  1.46400980E-01 -2.18460625E-33 -3.89017779E-03  1.94815854E-02
  6.12008107E-01 -2.30890009E-02  8.31045019E-02  4.62047145E-02  8.34512974E-02
  1.57050866E-33 -7.58799829E-03  2.71992817E-02  4.34118799E-02 -1.10084111E-02
  1.46308750E-33 -1.67740681E-03  1.33077526E-02 -1.05131391E-02  1.26448217E-02
  3.73602941E-34 -3.97145769E-02  9.75467812E-02  1.59240819E-01 -2.71519647E-02
 -4.00511145E-33 -3.39353670E-03  2.02685889E-02  1.28873277E-02  6.08183789E-01
 -6.78613195E-34  1.24930667E-33  8.98223087E-34  1.40189825E-33 -5.86157632E-02
 -2.66602476E-34  4.82155387E-34  1.59246094E-33  1.21609340E-33 -3.20616674E-01
 -1.95697475E-34  4.69865243E-34  2.83615337E-34  5.00704692E-34 -4.99016852E-02
 -4.51686435E-34  1.03781477E-33  1.85770134E-33  1.49249640E-34  4.72630173E-01
 -1.18089352E-34  6.82181244E-34  4.12920046E-33  1.69464232E-32  7.98970624E-01
  2.61115362E-02 -9.73974918E-02  1.30460369E-01  1.28259056E-02  1.15972996E-33
 -1.13958037E-01  2.87389554E-01 -4.19990402E-01 -3.53500565E-01 -1.23921602E-32
  2.81952761E-02 -1.04059607E-01  3.49200611E-02  1.19580395E-01  3.53158137E-33
 -1.81816901E-02  7.03203796E-02 -7.29349891E-02 -6.70288823E-02 -2.30843479E-33
 -2.18795584E-03  7.31747518E-03 -2.66020375E-03 -6.58888181E-03 -1.99126808E-34
  5.86984993E-01 -1.83891150E-02  7.07534395E-02 -9.23707425E-02  3.45757110E-02
  3.89623066E-34  2.83695418E-02 -1.04621244E-01  7.73218549E-02 -9.80273762E-02
 -2.24209885E-33 -1.13774802E-01  2.87587809E-01 -5.20609660E-01  1.76108180E-01
  1.67557230E-33  2.67758757E-02 -1.00858564E-01  1.26968214E-01  3.78531763E-02
  1.83229898E-33 -1.80032241E-02  6.85476938E-02 -9.08517302E-02  2.74859916E-02
  2.02362741E-34 -7.49449856E-02  5.88889309E-01 -1.81816901E-02  7.03203796E-02
  7.29349891E-02  6.70288823E-02  2.30843479E-33 -2.18795584E-03  7.31747518E-03
  2.66020375E-03  6.58888181E-03  1.99126808E-34 -1.81622593E-02  6.93029553E-02
  7.51693804E-02  6.02811497E-02  2.13506778E-33  2.61115362E-02 -9.73974918E-02
 -1.30460369E-01 -1.28259056E-02 -1.15972996E-33 -1.13958037E-01  2.87389554E-01
  4.19990402E-01  3.53500565E-01  1.23921602E-32  1.86251699E-02 -4.79000251E-02
  5.86984993E-01  6.16922472E-05 -3.28446524E-05 -5.27949802E-04 -7.88009998E-04
 -2.51079314E-35  3.31156035E-03 -1.23408594E-02  2.52966617E-03 -1.63743551E-02
 -4.38526125E-34 -5.96857002E-03  2.15567757E-02  3.72064349E-03  2.38265403E-02
  6.83721000E-34  2.16406214E-02 -5.94308374E-02  2.19986502E-02 -1.03359006E-01
 -2.73091860E-33 -5.00989969E-03  1.66969068E-02 -1.38689126E-02  1.78046734E-02
  4.08310200E-34  6.04108940E-03  1.47319521E-02  1.13353836E-02  2.06713954E+00
  6.06386204E-04 -2.86384518E-03  2.59945157E-03 -2.99191110E-04  0.00000000E+00
 -1.32230702E-02  4.64911117E-02 -9.92426741E-03  6.97829878E-02  0.00000000E+00
  2.31120505E-02 -7.64761351E-02 -1.21325009E-02 -1.01416258E-01 -1.44369453E-33
 -5.96544011E-02  1.00198189E-01 -5.59798464E-02  2.85745285E-01  0.00000000E+00
  1.70327460E-02 -5.11526359E-02  4.72314447E-02 -7.27638877E-02  0.00000000E+00
 -2.66430560E-02 -5.71004146E-02 -4.51352774E-02 -2.05747870E-01  8.31682490E-01
 -1.54616182E-03  6.64156252E-03 -3.82274537E-03  4.04712740E-03 -6.09474898E-35
  3.29542584E-04 -3.25084604E-03  3.59121671E-03  4.56411169E-03  1.78410722E-34
 -9.32141030E-03  4.28808381E-02 -1.51098799E-02  1.02268757E-02  1.58844502E-34
 -2.95579372E-02  9.73425470E-02 -1.46515163E-02  1.30633039E-01 -8.87673217E-34
  1.51822989E-02 -6.23978375E-02  4.51504821E-02 -2.77719260E-02  2.17419760E-34
 -8.50745790E-03  6.22123970E-03 -2.62595278E-02  4.40795528E-03 -3.23394813E-02
  6.24117362E-01  1.98070655E-03 -7.94812528E-03  2.31912051E-03 -7.83535393E-03
 -1.11737065E-34  1.36461316E-02 -5.45311211E-02  1.15668041E-02 -6.81547031E-02
  3.27086323E-34 -2.22962334E-02  8.52833418E-02  4.96284519E-02  8.42897745E-02
  1.51252745E-33  1.02621743E-01 -2.83226982E-01  9.21880538E-02 -4.42596123E-01
 -1.62740090E-33 -1.79521148E-02  6.43107507E-02 -6.52083054E-02  5.87445898E-02
  3.98602893E-34  3.34270082E-02  5.12240710E-02  5.03918022E-02 -1.81951805E-04
 -2.39363301E-02  2.24950233E-03  5.90915544E-01  4.54027516E-35 -1.79496678E-34
  4.07575890E-35 -1.92358587E-34  1.31857275E-02  3.80484468E-34 -1.53236780E-33
  3.42919284E-34 -1.86203253E-33 -3.85983929E-02 -6.75797789E-34  1.31473492E-33
  7.68806607E-34  1.35931574E-33 -4.12738545E-02  2.66388410E-33 -7.25492494E-33
  2.46639042E-33 -1.14696032E-32  1.92044286E-01 -4.04304882E-34  1.39899884E-33
 -1.53018611E-33  1.45802898E-33 -4.70378306E-02  8.74613038E-34  1.45895855E-33
  1.23569873E-33  2.21199812E-35 -8.63143049E-34  3.90880654E-33  1.64019556E-32
  7.86602265E-01 -3.25645448E-04  1.32238071E-03  5.29982017E-04  1.22384271E-03
  3.72075750E-35 -1.35379501E-03  5.40476590E-03 -5.08052652E-04  6.21043861E-03
  1.69105407E-34  3.35752891E-03 -1.28447244E-02 -6.54728181E-03 -1.12060800E-02
 -3.51133341E-34 -4.78974947E-03  1.56659483E-02  5.25308565E-03  2.21103185E-02
  6.45568754E-34 -2.99099585E-03  1.02471907E-02 -8.18711731E-04  9.20401539E-03
  2.50212859E-34 -3.26975658E-03 -2.67422772E-03  4.17555437E-03  2.88793670E-02
 -7.41660129E-02 -8.45614140E-02 -8.97321170E-02 -3.00972585E-33  2.06711373E+00
  1.17029279E-03 -4.55584682E-03 -2.23565754E-03 -4.63412193E-03  0.00000000E+00
  5.10916041E-03 -1.91906854E-02  7.91556042E-04 -2.48624662E-02  0.00000000E+00
 -1.20472695E-02  4.27175193E-02  2.36217628E-02  4.49073520E-02  6.95506757E-34
  1.30539986E-02 -3.69198092E-02 -2.82988007E-02 -7.05629028E-02  0.00000000E+00
  1.00309649E-02 -3.45451782E-02  5.01147599E-03 -3.48791497E-02  0.00000000E+00
  1.32167089E-02  7.99458214E-03 -1.41826697E-02 -7.42006603E-02  9.24868779E-02
  2.11510361E-01  2.04860557E-01  0.00000000E+00 -2.03688077E-01  8.19141563E-01
  1.73361964E-03 -7.33323244E-03 -6.86646822E-03 -6.01355949E-03 -7.67949878E-34
 -3.03633860E-03  1.17998785E-02 -1.31090875E-03  1.64747377E-02 -4.67259895E-35
  8.43138497E-03 -3.33550809E-02 -1.54173590E-02 -3.11221940E-02 -1.66098216E-34
 -9.04084282E-04 -5.93915253E-03  9.77951725E-03  2.52790853E-02  3.29569511E-34
  4.22054531E-03 -1.56096459E-02 -4.00267827E-02 -2.41473859E-02  9.04046661E-34
 -9.41622321E-03 -9.01201929E-04 -2.41309111E-02  7.70337316E-02 -1.80993033E-01
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 -5.16349307E-03  1.76234648E-02  2.42054001E-02  1.67740681E-03  1.95697475E-34
 -4.31324969E-03  1.48462157E-02  1.17541795E-02 -3.76328159E-03 -3.19278368E-35
 -4.63727099E-03  1.44030139E-02  1.57546571E-02 -1.46948818E-02 -3.10443334E-34
  2.54938803E-02 -6.67355188E-02 -1.85532449E-02  1.14066079E-01  3.04909601E-33
 -1.81622593E-02 -2.46995937E-03  2.81952761E-02  2.96868503E-03 -1.12895516E-02
 -5.87118531E-03  1.32861204E-02  3.32285202E-34  7.49119264E-04 -2.94136808E-03
 -2.64122679E-03  1.07461788E-03  1.35249811E-35  6.27376116E-04  6.82817254E-03
 -4.74854839E-04 -5.96857002E-03  2.31120505E-02  9.32141030E-03  2.22962334E-02
  6.75797789E-34  1.39135673E-02  3.35752891E-03 -1.20472695E-02 -8.43138497E-03
 -1.16735216E-02 -3.75708762E-34 -3.00635007E-05  5.72317310E-03  2.06693263E+00
 -6.51833615E-02  9.09777548E-02  2.20203362E-01  1.90540728E-01  3.32072427E-33
  1.75476822E-02 -5.05178867E-02 -9.25951026E-02 -1.33077526E-02 -4.69865243E-34
  1.48462157E-02 -5.02145867E-02 -4.38264382E-02  1.32824965E-02  4.91336957E-35
  1.40854533E-02 -3.45972147E-02 -5.16967804E-02  5.92080276E-02  0.00000000E+00
 -6.66221858E-02  8.88120277E-02  3.81074862E-02 -2.90673754E-01  0.00000000E+00
  6.93029553E-02  8.39761460E-03 -1.04059607E-01 -1.08247562E-02  3.86098656E-02
  2.52377248E-02 -5.17163411E-02 -6.39365016E-34 -2.48285113E-03  9.53553869E-03
  1.03150690E-02 -2.86818930E-03 -7.98654746E-36 -2.01862713E-03 -2.77679927E-02
  2.77321875E-03  2.15567757E-02 -7.64761351E-02 -4.28808381E-02 -8.52833418E-02
 -1.31473492E-33 -5.31120729E-02 -1.28447244E-02  4.27175193E-02  3.33550809E-02
  4.78552857E-02  7.66377958E-34 -2.52779080E-03 -2.31640172E-02 -2.05642436E-01
  8.32475714E-01  8.36804924E-02 -2.19397908E-01 -2.56686844E-01 -2.40143561E-01
 -4.84734296E-33 -2.26334932E-02  8.89670458E-02  8.94458795E-02 -1.05131391E-02
  2.06729617E-34 -1.17541795E-02  4.38264382E-02  2.95432780E-02 -2.89926525E-02
  1.75330369E-34 -1.41757585E-02  5.97724696E-02  4.94237004E-02 -1.72031629E-02
  2.60742553E-34  2.42970095E-02 -7.04016868E-02  4.14374779E-03  8.82692627E-02
 -2.45314404E-33 -7.51693804E-02 -6.05217327E-03 -3.49200611E-02  3.73240772E-03
 -1.59352699E-02 -2.16835027E-03  1.51931357E-02  2.77932906E-34  6.77415542E-04
 -2.71521856E-03  5.05087273E-04  4.17489597E-03  3.82087843E-35 -1.20738855E-03
  9.74103110E-03  9.15321409E-05 -3.72064349E-03  1.21325009E-02 -1.51098799E-02
  4.96284519E-02  7.05214166E-34  1.75636486E-02  6.54728181E-03 -2.36217628E-02
 -1.54173590E-02 -2.89179273E-02 -1.35532321E-34 -1.17588099E-02  2.45707958E-02
 -4.46938542E-03  2.41093610E-02  6.16342923E-01  7.47632096E-02 -1.87042099E-01
 -2.47953852E-01 -1.91165467E-01 -5.59400380E-33 -7.49211181E-03  2.23878531E-02
  4.32091583E-02  1.26448217E-02  5.39147551E-34  3.76328159E-03 -1.32824965E-02
 -2.89926525E-02 -4.15181623E-02  7.93915979E-34  1.97395379E-02 -6.83460848E-02
 -5.87798398E-02  5.54121618E-02  4.78028014E-34 -1.13367809E-01  2.86367968E-01
  8.76380675E-02 -4.46038490E-01 -4.49743074E-33 -6.02811497E-02  5.76923955E-03
 -1.19580395E-01 -1.47767510E-02  6.05898258E-02  2.56348795E-02 -6.82152252E-02
 -6.45118003E-34 -2.75008100E-03  1.17919044E-02  1.47592352E-02 -1.69321497E-03
 -4.17178345E-35 -7.19280659E-03 -3.09175624E-02  3.98061190E-03 -2.38265403E-02
  1.01416258E-01  1.02268757E-02  8.42897745E-02  1.39111196E-33  4.16548252E-02
  1.12060800E-02 -4.49073520E-02 -3.11221940E-02 -3.58446378E-02  3.45967192E-34
 -4.57008074E-03  2.26802237E-02  2.70448661E-03 -1.62561491E-02 -7.84872225E-03
  6.02490867E-01  2.58915819E-33 -3.26972785E-33 -5.68201378E-33 -5.20675254E-33
  4.71439714E-01 -3.47271339E-34  5.84596420E-34  1.02856608E-33  3.35160082E-34
 -4.99016852E-02  3.19278368E-35 -4.91336957E-35  6.61655771E-34  5.50753278E-34
 -3.15643232E-01  4.60079471E-34 -1.52709242E-33 -1.32556722E-33  1.43074448E-33
 -5.64105308E-02 -2.99433193E-33  7.50807100E-33  2.45603863E-33 -1.18261586E-32
  5.30727170E-01 -2.13506778E-33  1.22701180E-34 -3.53158137E-33 -3.86806678E-34
  7.91076330E-34  4.96661451E-34 -7.14262142E-34 -4.79872482E-02 -7.20941766E-35
  1.55147836E-34  1.63738947E-34 -6.37135242E-35  1.37853194E-02 -2.06922025E-34
 -7.97415113E-34  1.10959977E-34 -6.83721000E-34  1.44369453E-33  2.22436944E-34
  1.48073122E-33 -4.12738545E-02  1.26347391E-33  3.51133341E-34 -6.95506757E-34
  1.46873963E-34  1.96273523E-34 -2.03130558E-01 -1.99213098E-34  7.80428737E-34
  4.74598709E-35 -3.02252732E-34  3.58083485E-33  1.66607434E-32  7.98965830E-01
  2.67758757E-02 -1.00858564E-01 -1.26968214E-01 -3.78531763E-02 -1.83229898E-33
 -1.80032241E-02  6.85476938E-02  9.08517302E-02 -2.74859916E-02 -2.02362741E-34
 -2.46995937E-03  8.39761460E-03  6.05217327E-03 -5.76923955E-03 -1.22701180E-34
 -1.83891150E-02  7.07534395E-02  9.23707425E-02 -3.45757110E-02 -3.89623066E-34
  2.83695418E-02 -1.04621244E-01 -7.73218549E-02  9.80273762E-02  2.24209885E-33
 -4.79000251E-02  1.74886374E-02 -7.49449856E-02  6.55349446E-03 -2.68504718E-02
 -1.22191602E-02  3.33619372E-02  8.49933266E-34  1.59996962E-04 -1.87556823E-03
  5.85542212E-03  9.02077912E-04  6.11045046E-35  7.75971131E-03  2.46995382E-02
 -6.61860945E-03  1.47319521E-02 -5.71004146E-02 -6.22123970E-03 -5.12240710E-02
 -1.45895855E-33  1.66284816E-02 -2.67422772E-03  7.99458214E-03  9.01201929E-04
  1.14113732E-02  3.22030164E-34  3.27119054E-03 -8.89725253E-03 -1.13774802E-01
  2.87587809E-01  5.20609660E-01 -1.76108180E-01 -1.67557230E-33  5.88889309E-01
QEq coupling tensors                       R   N=         120
 -5.59485266E-02  1.02490535E-02 -7.96735819E-02 -5.43952638E-33 -3.97222770E-33
  1.35622109E-01 -8.03721735E-02  7.04231133E-03 -7.73755507E-02  4.23402010E-33
  5.74394717E-34  1.57747724E-01 -7.99347278E-02 -5.32956447E-03 -7.83966776E-02
 -2.89770168E-33  7.33985556E-33  1.58331405E-01 -5.59485266E-02  1.02490535E-02
 -7.96735819E-02 -1.55522268E-33 -2.32883507E-33  1.35622109E-01 -8.03721735E-02
  7.04231133E-03 -7.73755507E-02  1.60755151E-32  1.52491838E-33  1.57747724E-01
 -1.12704941E-01 -2.14810338E-01 -4.02207294E-02 -6.23047931E-33 -5.45543287E-33
  1.52925671E-01 -2.45958051E-01  1.32585447E-01  9.41766290E-02  4.07204977E-34
 -1.19971570E-34  1.51781422E-01 -1.12704941E-01 -2.14810338E-01 -4.02207294E-02
 -8.55193564E-33 -7.92181745E-33  1.52925671E-01 -5.32033240E-02  1.05813651E-02
 -1.00579070E-01 -7.07887071E-33  1.08420235E-32  1.53782394E-01 -9.23312508E-02
 -1.06893175E-02 -9.56323767E-02  3.03834919E-33  1.16924216E-32  1.87963628E-01
 -2.87651833E-01  6.09283585E-02  1.34629206E-01 -9.08304794E-34  6.67823336E-34
  1.53022627E-01 -2.71694873E-01  8.29322556E-02  1.21100964E-01 -1.23553436E-33
  5.74340563E-34  1.50593909E-01  9.99590646E-02  1.30964297E-01 -2.52074405E-01
  2.77766770E-33 -7.71453388E-33  1.52115340E-01 -5.32033240E-02  1.05813651E-02
 -1.00579070E-01  5.29200698E-33 -1.11170479E-32  1.53782394E-01 -2.71694873E-01
  8.29322556E-02  1.21100964E-01 -1.05616312E-32  1.46944931E-33  1.50593909E-01
 -9.23312508E-02 -1.06893175E-02 -9.56323767E-02  1.44791582E-32  6.16299805E-33
  1.87963628E-01 -2.87651833E-01  6.09283585E-02  1.34629206E-01 -1.07004336E-32
  1.54508315E-33  1.53022627E-01  9.99590646E-02  1.30964297E-01 -2.52074405E-01
  6.26481258E-34 -5.77781639E-34  1.52115340E-01 -7.99347278E-02 -5.32956447E-03
 -7.83966776E-02  1.96453156E-32  1.17252215E-32  1.58331405E-01 -2.45958051E-01
  1.32585447E-01  9.41766290E-02 -8.37670117E-33  3.49831665E-33  1.51781422E-01
Mulliken Charges                           R   N=          20
 -4.51341988E-03 -7.71554439E-02 -7.66091291E-02 -4.51341988E-03 -7.71554439E-02
  7.92189278E-02  7.76906947E-02  7.92189278E-02 -7.63779013E-02 -1.54815723E-01
  7.63303388E-02  7.68860528E-02  7.93456033E-02 -7.63779013E-02  7.68860528E-02
 -1.54815723E-01  7.63303388E-02  7.93456033E-02 -7.66091291E-02  7.76906947E-02
ONIOM Charges                              I   N=          16
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0
ONIOM Multiplicities                       I   N=          16
           1           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0
Atom Layers                                I   N=          20
           1           1           1           1           1           1
           1           1           1           1           1           1
           1           1           1           1           1           1
           1           1
Atom Modifiers                             I   N=          20
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0
Force Field                                I                0
Int Atom Modified Types                    I   N=          20
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0
Link Atoms                                 I   N=          20
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0           0           0           0           0
           0           0
Atom Modified MM Charges                   R   N=          20
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
Link Distances                             R   N=          80
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
Cartesian Gradient                         R   N=          60
 -3.76179908E-05  3.24297741E-05 -9.63718793E-31  2.05706938E-05  2.96577697E-05
 -1.23706157E-31 -7.84014908E-06 -1.68363787E-05  2.07253678E-31  3.76179907E-05
 -3.24297741E-05 -9.30370865E-31 -2.05706937E-05 -2.96577697E-05  3.11878164E-31
 -4.90892736E-06  1.88712150E-07 -3.51066090E-32  5.97012761E-06  6.41877463E-06
  3.05308327E-32  4.90892737E-06 -1.88712153E-07  1.40005750E-31 -2.86752770E-05
  4.73736964E-05 -1.06016425E-32 -6.14357135E-06 -1.02775102E-05  1.30895316E-31
  9.99523860E-06 -1.24077492E-05  4.17787619E-32  9.05196759E-06  2.50295682E-07
  3.87397329E-32  8.32181663E-06  2.41174444E-06  8.17341441E-32  2.86752770E-05
 -4.73736964E-05  5.10202164E-31 -9.05196759E-06 -2.50295686E-07  1.03194204E-31
  6.14357136E-06  1.02775102E-05  1.63468100E-31 -9.99523860E-06  1.24077492E-05
 -1.00699617E-31 -8.32181663E-06 -2.41174443E-06  2.56234729E-32  7.84014906E-06
  1.68363787E-05  2.46026536E-31 -5.97012760E-06 -6.41877463E-06  1.32871581E-31
Cartesian Force Constants                  R   N=        1830
  7.26301774E-01 -3.50769387E-03  7.06182090E-01  1.23849154E-11  1.32114855E-11
  1.57917183E-01 -3.22018947E-01  9.34272979E-02 -8.50385817E-12  7.81711649E-01
  1.26102790E-02 -1.52176592E-01  5.15131392E-12  6.62944571E-02  7.99473261E-01
  3.87016225E-12 -7.87276865E-12 -6.74474564E-02 -6.97603889E-12  3.91007139E-12
  1.41470288E-01  1.75906812E-02  3.79247914E-02 -1.40494616E-12 -1.55803880E-01
  9.38651261E-02  1.32828241E-12  8.25141097E-01  1.09658431E-01 -1.24801084E-02
 -5.81903508E-12 -8.83104694E-03 -3.76342502E-01 -9.81502793E-14 -5.44472785E-02
  7.56244657E-01 -8.94004337E-12  6.69861771E-12  6.96344448E-03  1.03820127E-11
 -6.19824489E-12 -6.24807414E-02  3.53516686E-12  3.55388469E-12  1.41363550E-01
 -8.31336882E-02 -1.80581095E-02  5.06278091E-12  6.32940959E-02 -7.75359563E-02
 -3.20589021E-12 -2.60301256E-01 -5.42575851E-02  4.83165683E-12  7.26301774E-01
 -1.80581095E-02  9.57446788E-03  6.81528171E-12 -7.39774152E-03 -5.71247544E-02
  3.02349502E-12 -1.39256736E-01 -2.13786330E-01  9.15192174E-12 -3.50769387E-03
  7.06182090E-01 -5.06278091E-12 -6.81528171E-12 -8.95569316E-03  2.48509127E-12
 -4.92049238E-12  7.02332659E-03  1.75088948E-12  7.01399001E-12 -6.66536346E-02
 -1.23849154E-11 -1.32114855E-11  1.57917183E-01  6.32940959E-02 -7.39774152E-03
 -2.48509127E-12 -3.40667568E-02  4.28417634E-02  2.46070933E-12 -5.86108674E-02
 -5.64486515E-02 -7.82731506E-12 -3.22018947E-01  9.34272979E-02  8.50385817E-12
  7.81711649E-01 -7.75359563E-02 -5.71247544E-02  4.92049238E-12  4.28417634E-02
 -4.87895557E-02 -4.75213137E-12  2.58194448E-03  7.38006645E-02  5.25260820E-12
  1.26102790E-02 -1.52176592E-01 -5.15131392E-12  6.62944571E-02  7.99473261E-01
  3.20589021E-12 -3.02349502E-12  7.02332659E-03 -2.46070933E-12  4.75213137E-12
 -6.46643935E-03 -1.88265892E-12 -2.53195907E-12  6.51648630E-03 -3.87016225E-12
  7.87276865E-12 -6.74474564E-02  6.97603889E-12 -3.91007139E-12  1.41470288E-01
 -1.47606093E-02 -2.28513469E-02 -2.48404108E-13 -2.66873511E-01 -1.69153654E-01
 -2.46901037E-13  9.36889865E-03  1.18003067E-02  5.35552397E-13  4.14350047E-05
  1.90322517E-03 -7.83764319E-13  4.11547476E-04  1.03715425E-03  6.95268579E-13
  2.72543306E-01  1.34068266E-02  1.24335925E-02  9.36049441E-15 -1.67887422E-01
 -2.07254037E-01  4.45643463E-13 -2.79540255E-02 -1.40918865E-02 -4.08669397E-13
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 -3.78723238E-13  1.59387869E-04  6.36114744E-13  1.80468159E-13  2.58843328E-05
 -2.06741156E-13 -7.07983352E-15  1.35792896E-05 -4.34755174E-13  6.32404220E-14
 -2.26510653E-04 -1.71659667E-13 -1.60397400E-13  4.22355102E-06  2.73682579E-13
  2.64613765E-13 -3.87381752E-03  7.17383847E-13 -3.51221164E-14 -5.81321605E-05
 -5.69089605E-13 -1.86117046E-13  1.22676292E-04  3.01149329E-13  1.26379653E-13
 -8.67649177E-05 -1.72312154E-13 -1.99244653E-13  3.26809709E-04  9.77705154E-13
 -1.10378791E-12 -3.99435573E-02 -2.98452000E-13  8.90997874E-14  2.84704581E-02
Dipole Moment                              R   N=           3
 -5.77315973E-15 -1.97175609E-13  3.78836684E-33
Dipole Derivatives                         R   N=         180
 -1.51036086E-01  6.43034628E-02  7.63435088E-11 -7.56811334E-03  1.88089079E-01
 -7.02496039E-12  4.30223114E-12  5.56626851E-11  2.74543456E-02 -4.61943919E-02
  1.11739252E-01 -7.49741526E-11  1.00411735E-01 -1.09746295E-01  3.55875283E-11
 -1.90384238E-11  2.53467732E-11 -8.31185874E-02  3.09313475E-02 -6.96067043E-02
 -3.10809752E-12 -7.66079787E-02 -1.89045915E-01 -4.66955745E-11 -8.61974790E-12
 -1.60104134E-12 -9.08927951E-02 -1.51036086E-01  6.43034628E-02 -7.66189847E-11
 -7.56811333E-03  1.88089079E-01  6.76321020E-12 -3.18762531E-12 -6.14922590E-11
  2.74543456E-02 -4.61943919E-02  1.11739252E-01  7.47346141E-11  1.00411735E-01
 -1.09746295E-01 -3.62279954E-11  1.76553355E-11 -2.30585975E-11 -8.31185874E-02
  6.25682958E-02 -9.26022944E-03  1.37235239E-11 -1.04809958E-02  3.47493892E-02
  1.65941708E-11  3.85352695E-11  1.43633400E-11  7.91866166E-02  5.89380868E-02
  1.97967398E-02  3.34462343E-12  1.29498409E-02  3.69533914E-02 -2.61260179E-12
  1.44473825E-12  9.89762855E-13  7.76546671E-02  6.25682958E-02 -9.26022944E-03
 -1.34532700E-11 -1.04809958E-02  3.47493892E-02 -1.64290907E-11 -3.69923967E-11
 -1.36092859E-11  7.91866166E-02  3.89867437E-03 -3.41165362E-01  8.86407720E-13
 -2.32136458E-02  1.90017623E-01 -8.60349569E-12  1.66255624E-13  1.18733610E-11
 -7.88487262E-02 -3.91760970E-02  6.07417673E-02  5.81087597E-12 -3.93329152E-02
 -2.57342466E-01  1.08350525E-11  1.04622754E-11  3.85044754E-12 -2.04623493E-01
  3.34393391E-02  1.55969589E-01 -8.40195163E-12  2.08602673E-02  2.02713213E-02
  5.03602361E-12 -9.80630177E-13  1.35993443E-11  9.85507200E-02  1.93890117E-02
  6.60455371E-02 -5.10454988E-12 -1.82356409E-02 -2.91282461E-02  2.49891345E-12
  7.16413920E-12  2.34696752E-11  8.03458946E-02  2.72418170E-02 -5.85640555E-02
  9.54725660E-12  4.12174494E-02  1.15182123E-01 -9.75039255E-12 -1.70057418E-11
  1.45370898E-11  9.42913575E-02  3.89867439E-03 -3.41165362E-01 -3.12579804E-13
 -2.32136458E-02  1.90017623E-01  8.86388763E-12  7.10044384E-13 -1.17626045E-11
 -7.88487262E-02  1.93890117E-02  6.60455371E-02  5.02512089E-12 -1.82356409E-02
 -2.91282461E-02 -2.37615969E-12 -7.13517626E-12 -2.29921745E-11  8.03458946E-02
 -3.91760970E-02  6.07417673E-02 -6.45043293E-12 -3.93329152E-02 -2.57342466E-01
 -1.11367173E-11 -9.21919537E-12 -1.93405959E-12 -2.04623493E-01  3.34393391E-02
  1.55969589E-01  8.54498881E-12  2.08602673E-02  2.02713213E-02 -5.51568267E-12
  7.91038486E-13 -1.30945392E-11  9.85507200E-02  2.72418170E-02 -5.85640555E-02
 -9.55574181E-12  4.12174494E-02  1.15182123E-01  1.01296706E-11  1.48881085E-11
 -1.68795883E-11  9.42913575E-02  3.09313475E-02 -6.96067043E-02  2.80713277E-12
 -7.66079787E-02 -1.89045915E-01  4.72496761E-11  7.21830299E-12  2.98140991E-12
 -9.08927951E-02  5.89380868E-02  1.97967398E-02 -2.78829217E-12  1.29498409E-02
  3.69533914E-02  2.81453746E-12 -1.15880168E-12 -2.49739188E-13  7.76546671E-02
Polarizability                             R   N=           6
  6.82381530E+01  6.77760228E+00  1.43009891E+02  4.04412983E-12  6.38501315E-11
  1.13434632E+01
Polarizability Derivatives                 R   N=         360
 -3.15332664E-01 -1.72670607E+00  1.30436242E+01 -1.85630345E-10 -2.48316214E-10
 -1.73434273E-01  2.45380016E-01  7.24584355E-01 -6.80358377E+01  1.31187245E-10
  8.13086987E-11  1.69183704E-02 -7.94373284E-11 -1.19355075E-10  1.00748221E-09
 -9.56303533E-02 -5.15837151E+00 -2.48272484E-11  7.49672645E-01  1.73398694E+00
 -2.55834665E+01  1.30288331E-10 -2.01509121E-11 -2.54685710E-01 -3.31481288E+00
 -2.12451799E+00  2.76290581E+01 -1.76113827E-12 -1.25731345E-10 -3.03242840E-01
 -1.10727295E-10  1.81618890E-10 -8.88700304E-10 -1.47332333E+00  9.06459402E-02
 -3.94315033E-11 -7.04279995E-01 -1.18021080E-01 -1.45931248E+01 -1.81115120E-11
 -3.86638345E-12 -3.44726396E-01  2.70244066E+00  9.22864083E-01 -3.61934687E+01
 -4.31803672E-11 -6.03096218E-11  2.28182500E-01  3.30815739E-11 -1.83876073E-12
  2.92550737E-10 -2.18010549E+00 -5.30785772E-01  8.07509910E-11  3.15332664E-01
  1.72670607E+00 -1.30436242E+01 -1.52036845E-10 -2.57232162E-10  1.73434273E-01
 -2.45380015E-01 -7.24584355E-01  6.80358377E+01  1.25410032E-10  1.40270994E-10
 -1.69183704E-02 -9.08690367E-11 -1.70864826E-10  1.08149114E-09  9.56303532E-02
  5.15837151E+00  1.58158254E-11 -7.49672645E-01 -1.73398694E+00  2.55834665E+01
  1.17753645E-10  4.19956574E-12  2.54685710E-01  3.31481288E+00  2.12451799E+00
 -2.76290581E+01  1.12132110E-12 -1.53758548E-10  3.03242840E-01 -8.97280830E-11
  2.10208181E-10 -8.66647395E-10  1.47332333E+00 -9.06459403E-02 -6.44325264E-11
 -4.51710064E+00 -2.39953016E+00 -1.07215787E+00 -9.73615679E-12  1.73059650E-10
 -1.20429020E-01 -1.10513130E+00 -1.94874205E+00 -2.62111495E+00 -2.39079212E-11
  6.07740209E-11 -6.14199357E-02  1.26731417E-10 -1.74084243E-11 -4.05629625E-10
 -1.08962010E+00 -9.61645518E-01 -1.51039313E-11 -7.11397136E+00  1.66664149E+00
 -4.05461105E-01  1.73671381E-11  5.77122705E-11 -1.56980909E-01  8.93061908E-01
 -2.02034050E+00  1.32785024E+00  4.16078836E-12 -2.88906062E-11  2.59382498E-02
  5.50689570E-11 -1.36058105E-11 -4.41041899E-10 -1.40283209E+00  6.07790595E-01
 -1.92228664E-11  4.51710064E+00  2.39953016E+00  1.07215787E+00 -8.92562051E-12
  1.70302489E-10  1.20429020E-01  1.10513130E+00  1.94874205E+00  2.62111495E+00
 -2.30864383E-11  6.17728153E-11  6.14199357E-02  9.13701770E-11 -4.19230386E-11
 -4.44637704E-10  1.08962010E+00  9.61645518E-01 -8.18615648E-12  1.20535459E+00
 -1.76347752E+00 -1.26242353E+01 -7.55964132E-12  6.54805774E-12 -5.65064325E-01
 -2.58064443E-01 -1.33648625E+00 -6.61601370E+01 -4.58766488E-11 -3.87868761E-11
 -1.41306815E-01  2.29232170E-10  4.23992889E-11 -3.75356219E-09 -1.93403346E+00
 -4.60679562E+00  4.25118902E-11 -8.95762425E-01  1.77997245E+00  2.30534551E+01
  1.63025892E-11  1.21009902E-10  4.84412844E-01  6.66168385E-01  1.67444925E+00
  2.60294747E+01 -6.49770220E-11  5.07747466E-11  4.61594816E-01 -2.25892625E-10
 -4.25599027E-10  4.69013139E-09  2.21084107E+00  7.83988155E+00 -3.90226822E-11
  4.96676748E+00  2.25405792E+00  1.04670031E+00  6.79951135E-12  2.97576056E-11
  1.39538221E-01  1.63256215E-01  2.13496063E+00  2.44042830E+00  6.89450547E-11
  2.77467621E-11 -1.11645045E-01  7.00094170E-11  1.92523887E-10 -9.41939123E-10
  1.04141417E+00 -4.73068593E-01  5.65066799E-12 -5.25180602E+00  2.09618035E+00
 -1.29680602E+00  1.05002973E-11 -3.80742644E-11 -1.20917589E-01  1.00165171E+00
 -2.41497446E+00  1.19455688E+00 -1.38102746E-12 -6.02141037E-11  1.09258922E-01
 -3.61035748E-11 -2.03881138E-11  1.46992040E-09 -1.19814393E+00  1.17144123E+00
 -1.18597850E-11 -1.76452288E-01  3.02557326E+00 -1.51710493E+00 -1.33996185E-11
 -4.34952649E-11 -1.73393209E-01  6.45242321E-02 -3.79495860E-01  1.22782707E+01
  7.99707488E-11  1.07957786E-11  1.15853831E-01 -3.69004305E-11  2.32520787E-10
 -9.94927879E-10 -5.23646322E-01  1.35605172E+00  3.67043961E-12 -1.20535459E+00
  1.76347752E+00  1.26242353E+01 -8.25611980E-12  1.86567133E-11  5.65064325E-01
  2.58064443E-01  1.33648625E+00  6.61601370E+01 -5.34647701E-11 -6.26323261E-12
  1.41306815E-01  2.16226229E-10  6.28432375E-11 -3.71230923E-09  1.93403345E+00
  4.60679562E+00  4.94185155E-11  5.25180602E+00 -2.09618035E+00  1.29680602E+00
  8.68816346E-12 -3.37764663E-11  1.20917589E-01 -1.00165171E+00  2.41497446E+00
 -1.19455688E+00 -7.59860509E-13 -5.90151077E-11 -1.09258922E-01 -3.41022033E-11
 -2.82054964E-11  1.46692679E-09  1.19814393E+00 -1.17144123E+00 -7.19053921E-12
  8.95762427E-01 -1.77997245E+00 -2.30534551E+01  1.60900562E-11  9.82786460E-11
 -4.84412844E-01 -6.66168385E-01 -1.67444925E+00 -2.60294747E+01 -6.42889570E-11
  3.56396850E-11 -4.61594816E-01 -2.11522137E-10 -3.82845464E-10  4.82891648E-09
 -2.21084107E+00 -7.83988155E+00 -5.60287755E-11 -4.96676748E+00 -2.25405792E+00
 -1.04670031E+00  5.20278370E-12  3.08225084E-11 -1.39538221E-01 -1.63256215E-01
 -2.13496063E+00 -2.44042830E+00  6.69263521E-11  1.61909580E-11  1.11645045E-01
  6.22331116E-11  1.89514570E-10 -8.97984126E-10 -1.04141417E+00  4.73068593E-01
  6.25524211E-12  1.76452288E-01 -3.02557326E+00  1.51710493E+00 -1.87229537E-11
 -3.89617305E-11  1.73393209E-01 -6.45242321E-02  3.79495860E-01 -1.22782707E+01
  8.18354453E-11  1.01775656E-11 -1.15853831E-01 -4.23999616E-11  1.74719865E-10
 -1.16542532E-09  5.23646321E-01 -1.35605172E+00 -4.66373437E-12  7.04279995E-01
  1.18021080E-01  1.45931248E+01 -1.22639913E-11  9.55664940E-12  3.44726396E-01
 -2.70244066E+00 -9.22864083E-01  3.61934687E+01 -4.06659025E-11 -2.85839095E-11
 -2.28182500E-01  7.25372417E-11 -1.49490515E-11  2.84013667E-10  2.18010549E+00
  5.30785772E-01  9.29844593E-11  7.11397136E+00 -1.66664149E+00  4.05461105E-01
  2.37327714E-11  5.78888611E-11  1.56980909E-01 -8.93061908E-01  2.02034050E+00
 -1.32785024E+00  5.14473941E-12 -2.82212781E-11 -2.59382498E-02  4.84772243E-11
 -3.06567680E-11 -4.34328046E-10  1.40283209E+00 -6.07790595E-01 -1.58095313E-11
HyperPolarizability                        R   N=          10
 -1.02375308E-08 -1.85403615E-09 -7.78264155E-09 -3.34406667E-08 -3.01716085E-10
 -1.67838794E-10 -2.87490175E-09 -9.76961303E-11  4.45017084E-10 -2.35914944E-11