File: cc-pwCVQZ

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file content (1033 lines) | stat: -rw-r--r-- 55,690 bytes parent folder | download | duplicates (3)
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$ Basis = cc-pwCVQZ                                                              
$
$Elements supported
$ H He B C N O F Ne Al Si P S Cl Ar
$Elements                             References
$--------                             ----------
$ He    : D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 100, 2975 (1994).
$Li - Ne: T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
$Na - Mg: D.E. Woon and T.H. Dunning, Jr.  (to be published)
$Al - Ar: D.E. Woon and T.H. Dunning, Jr.  J. Chem. Phys. 98, 1358 (1993).
$Ca     : J. Koput and K.A. Peterson, J. Phys. Chem. A, 106, 9595 (2002).
$
$  Polarization and/or diffuse functions
$Elements                             References
$--------                             ----------
$B  - Ne: K.A. Peterson and T.H. Dunning, Jr. J. Chem. Phys. 117, 10548 (2002)
$Al - Ar:
$
************************************************************************
a 1
$ HYDROGEN     (6s,3p,2d,1f) -> [4s,3p,2d,1f]
$ S-TYPE FUNCTIONS
    6    4    0
     82.6400000  0.00200600  0.00000000  0.00000000  0.00000000
     12.4100000  0.01534300  0.00000000  0.00000000  0.00000000
      2.8240000  0.07557900  0.00000000  0.00000000  0.00000000
      0.7977000  0.25687500  1.00000000  0.00000000  0.00000000
      0.2581000  0.49736800  0.00000000  1.00000000  0.00000000
      0.0898900  0.29613300  0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
    3    3    0
      2.2920000  1.00000000  0.00000000  0.00000000
      0.8380000  0.00000000  1.00000000  0.00000000
      0.2920000  0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    2    2    0
      2.0620000  1.00000000  0.00000000
      0.6620000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    1    1    0
      1.3970000  1.00000000
a 2
$ HELIUM       (7s,3p,2d,1f) -> [4s,3p,2d,1f]
$ S-TYPE FUNCTIONS
    7    4    0
    528.5000000  0.00094000  0.00000000  0.00000000  0.00000000
     79.3100000  0.00721400  0.00000000  0.00000000  0.00000000
     18.0500000  0.03597500  0.00000000  0.00000000  0.00000000
      5.0850000  0.12778200  0.00000000  0.00000000  0.00000000
      1.6090000  0.30847000  1.00000000  0.00000000  0.00000000
      0.5363000  0.45305200  0.00000000  1.00000000  0.00000000
      0.1833000  0.23888400  0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
    3    3    0
      5.9940000  1.00000000  0.00000000  0.00000000
      1.7450000  0.00000000  1.00000000  0.00000000
      0.5600000  0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    2    2    0
      4.2990000  1.00000000  0.00000000
      1.2230000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    1    1    0
      2.6800000  1.00000000
a 5
$ BORON        (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]                            
$ BORON        Tight (3s,3p,2d,1f)                                              
$ S-TYPE FUNCTIONS
   15    8    0
    23870.00000  0.00008800 -0.00001800  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
  3575.00000000  0.00068700 -0.00013900  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   812.80000000  0.00360000 -0.00072500  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   229.70000000  0.01494900 -0.00306300  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    74.69000000  0.05143500 -0.01058100  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    26.81000000  0.14330200 -0.03136500  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    10.32000000  0.30093500 -0.07101200  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     4.17800000  0.40352600 -0.13210300  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     1.72700000  0.22534000 -0.12307200  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.47040000  0.01540700  0.26181900  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.18960000 -0.00395500  0.58666200  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.07394000  0.00112400  0.29049400  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
     3.76800000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
    10.41400000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
    28.78800000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
    9    7    0
    22.26000000  0.00509500  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     5.05800000  0.03320600  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     1.48700000  0.13231400  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.50710000  0.33181800  1.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.18120000  0.47206300  0.00000000  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.06463000  0.25797900  0.00000000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000
     3.84700000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000
    11.92500000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000
    36.97100000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    5    5    0
     1.11000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.40200000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     0.14500000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
     3.71800000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    16.57400000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    3    3    0
     0.88200000  1.00000000  0.00000000  0.00000000
     0.31100000  0.00000000  1.00000000  0.00000000
     3.69200000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    1    1    0
     0.67300000  1.00000000
a 6
$ CARBON       (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]                            
$ CARBON       Tight (3s,3p,2d,1f)                                              
$ S-TYPE FUNCTIONS
   15    8    0
    33980.00000  0.00009100 -0.00001900  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
  5089.00000000  0.00070400 -0.00015100  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
  1157.00000000  0.00369300 -0.00078500  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   326.60000000  0.01536000 -0.00332400  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   106.10000000  0.05292900 -0.01151200  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    38.11000000  0.14704300 -0.03416000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    14.75000000  0.30563100 -0.07717300  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     6.03500000  0.39934500 -0.14149300  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     2.53000000  0.21705100 -0.11801900  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.73550000  0.01589400  0.27380600  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.29050000 -0.00308400  0.58651000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.11110000  0.00097800  0.28543000  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
     5.58400000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
    15.10900000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
    40.88100000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
    9    7    0
    34.51000000  0.00537800  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     7.91500000  0.03613200  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     2.36800000  0.14249300  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.81320000  0.34215000  1.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.28900000  0.46386400  0.00000000  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.10070000  0.25002800  0.00000000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000
     5.99600000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000
    18.05700000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000
    54.38200000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    5    5    0
     1.84800000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.64900000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     0.22800000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
     5.88800000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    22.80400000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    3    3    0
     1.41900000  1.00000000  0.00000000  0.00000000
     0.48500000  0.00000000  1.00000000  0.00000000
     6.11600000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    1    1    0
     1.01100000  1.00000000
a 7
$ NITROGEN     (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]                            
$ NITROGEN     Tight (3s,3p,2d,1f)                                              
$ S-TYPE FUNCTIONS
   15    8    0
    45840.00000  0.00009200 -0.00002000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
  6868.00000000  0.00071700 -0.00015900  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
  1563.00000000  0.00374900 -0.00082400  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   442.40000000  0.01553200 -0.00347800  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   144.30000000  0.05314600 -0.01196600  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    52.18000000  0.14678700 -0.03538800  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    20.34000000  0.30466300 -0.08007700  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     8.38100000  0.39768400 -0.14672200  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     3.52900000  0.21764100 -0.11636000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     1.05400000  0.01696300  0.27991900  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.41180000 -0.00274500  0.58548100  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.15520000  0.00095300  0.28402800  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
     7.82900000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
    20.73500000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
    54.91700000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
    9    7    0
    49.33000000  0.00553300  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
    11.37000000  0.03796200  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     3.43500000  0.14902800  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     1.18200000  0.34892200  1.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.41730000  0.45897200  0.00000000  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.14280000  0.24492300  0.00000000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000
     8.55400000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000
    25.19000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000
    74.18500000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    5    5    0
     2.83700000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.96800000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     0.33500000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
     8.69300000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    31.16700000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    3    3    0
     2.02700000  1.00000000  0.00000000  0.00000000
     0.68500000  0.00000000  1.00000000  0.00000000
     8.97200000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    1    1    0
     1.42700000  1.00000000
a 8
$ OXYGEN       (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]                            
$ OXYGEN       Tight (3s,3p,2d,1f)                                              
$ S-TYPE FUNCTIONS
   15    8    0
    61420.00000  0.00009000 -0.00002000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
  9199.00000000  0.00069800 -0.00015900  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
  2091.00000000  0.00366400 -0.00082900  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   590.90000000  0.01521800 -0.00350800  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   192.30000000  0.05242300 -0.01215600  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    69.32000000  0.14592100 -0.03626100  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    26.97000000  0.30525800 -0.08299200  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    11.10000000  0.39850800 -0.15209000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     4.68200000  0.21698000 -0.11533100  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     1.42800000  0.01759400  0.28897900  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.55470000 -0.00250200  0.58612800  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.20670000  0.00095400  0.27762400  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
    10.47800000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
    27.31400000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
    71.20600000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
    9    7    0
    63.42000000  0.00604400  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
    14.66000000  0.04179900  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     4.45900000  0.16114300  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     1.53100000  0.35673100  1.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.53020000  0.44830900  0.00000000  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.17500000  0.24494000  0.00000000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000
    11.16100000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000
    32.45900000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000
    94.39800000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    5    5    0
     3.77500000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.30000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     0.44400000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
    11.46900000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    39.23900000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    3    3    0
     2.66600000  1.00000000  0.00000000  0.00000000
     0.85900000  0.00000000  1.00000000  0.00000000
    12.16300000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    1    1    0
     1.84600000  1.00000000
a 9
$ FLUORINE     (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]                            
$ FLUORINE     Tight (3s,3p,2d,1f)                                              
$ S-TYPE FUNCTIONS
   15    8    0
    74530.00000  0.00009500 -0.00002200  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    11170.00000  0.00073800 -0.00017200  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
  2543.00000000  0.00385800 -0.00089100  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   721.00000000  0.01592600 -0.00374800  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   235.90000000  0.05428900 -0.01286200  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    85.60000000  0.14951300 -0.03806100  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    33.55000000  0.30825200 -0.08623900  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    13.93000000  0.39485300 -0.15586500  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     5.91500000  0.21103100 -0.11091400  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     1.84300000  0.01715100  0.29876100  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.71240000 -0.00201500  0.58501300  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.26370000  0.00086900  0.27115900  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
    13.45400000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
    34.58100000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
    88.88000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
    9    7    0
    80.39000000  0.00634700  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
    18.63000000  0.04420400  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     5.69400000  0.16851400  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     1.95300000  0.36156300  1.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.67020000  0.44217800  0.00000000  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.21660000  0.24343500  0.00000000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000
    14.23000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000
    40.86200000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000
   117.33900000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    5    5    0
     5.01400000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.72500000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     0.58600000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
    15.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    49.61000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    3    3    0
     3.56200000  1.00000000  0.00000000  0.00000000
     1.14800000  0.00000000  1.00000000  0.00000000
    16.16800000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    1    1    0
     2.37600000  1.00000000
a 10
$ NEON         (12s,6p,3d,2f,1g) -> [5s,4p,3d,2f,1g]                            
$ NEON         Tight (3s,3p,2d,1f)                                              
$ S-TYPE FUNCTIONS
   15    8    0
    99920.00000  0.00008600 -0.00002000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    14960.00000  0.00066900 -0.00015800  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
  3399.00000000  0.00351800 -0.00082400  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   958.90000000  0.01466700 -0.00350000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   311.20000000  0.05096200 -0.01223300  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   111.70000000  0.14374400 -0.03701700  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    43.32000000  0.30456200 -0.08611300  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    17.80000000  0.40010500 -0.15838100  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     7.50300000  0.21864400 -0.11428800  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     2.33700000  0.01866400  0.29819100  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.90010000 -0.00216700  0.58578400  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.33010000  0.00095100  0.27246700  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
    16.92300000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
    42.92300000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
   108.87000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
    9    7    0
    99.68000000  0.00656600  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
    23.15000000  0.04597900  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     7.10800000  0.17341900  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     2.44100000  0.36457100  1.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.83390000  0.43818500  0.00000000  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000
     0.26620000  0.24168000  0.00000000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000
    17.72400000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000
    50.29100000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000
   142.70100000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    5    5    0
     6.47100000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     2.21300000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     0.74700000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
    19.10400000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    61.55500000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    3    3    0
     4.65700000  1.00000000  0.00000000  0.00000000
     1.52400000  0.00000000  1.00000000  0.00000000
    20.87700000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    1    1    0
     2.98300000  1.00000000
a 13
$ ALUMINUM     (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]                           
$ ALUMINUM     Tight (3s,3p,3d,2f,1g)                                           
$ S-TYPE FUNCTIONS
   19    9    0
   419600.00000  0.00002782 -0.00000724  0.00000167  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    62830.00000  0.00021633 -0.00005617  0.00001296  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    14290.00000  0.00113754 -0.00029653  0.00006851  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  4038.00000000  0.00479635 -0.00124913  0.00028827  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  1312.00000000  0.01723890 -0.00455101  0.00105276  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   470.50000000  0.05380660 -0.01443930  0.00333878  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   181.80000000  0.14132600 -0.04034640  0.00939217  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    74.46000000  0.28926800 -0.09226180  0.02160470  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    31.90000000  0.38482500 -0.16451000  0.03958730  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    13.96000000  0.23285200 -0.14129600  0.03491800  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     5.18000000  0.02933300  0.19536500 -0.05284150  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     2.26500000 -0.00300574  0.57247500 -0.19187800  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.96640000  0.00166673  0.37404100 -0.25411500  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.24470000 -0.00060602  0.02341190  0.27507000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.11840000  0.00043136 -0.00905197  0.60474300  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.05021000 -0.00012292  0.00211174  0.28762900  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000  0.00000000
     1.79400000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000  0.00000000
     3.91600000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000  0.00000000
     8.54900000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
   14    8    0
   891.30000000  0.00049175 -0.00008887  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   211.30000000  0.00415843 -0.00074582  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    68.28000000  0.02125380 -0.00387025  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    25.70000000  0.07640580 -0.01393500  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    10.63000000  0.19427700 -0.03668600  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     4.60200000  0.33442800 -0.06277970  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     2.01500000  0.37502600 -0.07896020  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.87060000  0.20404100 -0.02885890  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.29720000  0.02137380  0.23825600  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.11000000 -0.00202144  0.55136300  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.03989000  0.00081725  0.35438500  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
     2.04900000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
     4.46800000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
     9.74000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    6    6    0
     0.08040000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.19900000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.49400000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     1.37900000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
     3.88700000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    10.96000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    4    4    0
     0.15400000  1.00000000  0.00000000  0.00000000  0.00000000
     0.40100000  0.00000000  1.00000000  0.00000000  0.00000000
     1.46300000  0.00000000  0.00000000  1.00000000  0.00000000
     6.81400000  0.00000000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    2    2    0
     0.35700000  1.00000000  0.00000000
     1.64500000  0.00000000  1.00000000
a 14
$ SILICON      (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]                           
$ SILICON      Tight (3s,3p,3d,2f,1g)                                           
$ S-TYPE FUNCTIONS
   19    9    0
   513000.00000  0.00002609 -0.00000695  0.00000178  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    76820.00000  0.00020290 -0.00005396  0.00001381  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    17470.00000  0.00106715 -0.00028472  0.00007300  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  4935.00000000  0.00450597 -0.00120203  0.00030767  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  1602.00000000  0.01623590 -0.00438397  0.00112563  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   574.10000000  0.05089130 -0.01397760  0.00358435  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   221.50000000  0.13515500 -0.03935160  0.01017280  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    90.54000000  0.28129200 -0.09142830  0.02375200  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    38.74000000  0.38533600 -0.16560900  0.04434830  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    16.95000000  0.24565100 -0.15250500  0.04190410  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     6.45200000  0.03431450  0.16852400 -0.05025040  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     2.87400000 -0.00334884  0.56928400 -0.21657800  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     1.25000000  0.00187625  0.39805600 -0.28644800  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.35990000 -0.00069333  0.02915090  0.26325600  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.16990000  0.00043831 -0.00848976  0.63490000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.07066000 -0.00012262  0.00199603  0.29083200  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000  0.00000000
     2.42000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000  0.00000000
     5.12200000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000  0.00000000
    10.84200000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
   14    8    0
  1122.00000000  0.00044814 -0.00009649  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   266.00000000  0.00381639 -0.00081197  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    85.92000000  0.01981050 -0.00430087  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    32.33000000  0.07270170 -0.01575020  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    13.37000000  0.18983900 -0.04295410  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     5.80000000  0.33567200 -0.07525740  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     2.55900000  0.37936500 -0.09714460  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     1.12400000  0.20119300 -0.02275070  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.39880000  0.02085150  0.29198800  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.15330000 -0.00170258  0.55067000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.05728000  0.00075005  0.29761800  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
     2.56200000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
     5.46800000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
    11.67000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    6    6    0
     0.12000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.30200000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.76000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     1.97000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
     5.47200000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    15.19500000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    4    4    0
     0.21200000  1.00000000  0.00000000  0.00000000  0.00000000
     0.54100000  0.00000000  1.00000000  0.00000000  0.00000000
     1.85700000  0.00000000  0.00000000  1.00000000  0.00000000
     8.53700000  0.00000000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    2    2    0
     0.46100000  1.00000000  0.00000000
     1.93400000  0.00000000  1.00000000
a 15
$ PHOSPHORUS   (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]                           
$ PHOSPHORUS   Tight (3s,3p,3d,2f,1g)                                           
$ S-TYPE FUNCTIONS
   19    9    0
   615200.00000  0.00002475 -0.00000672  0.00000185  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    92120.00000  0.00019247 -0.00005223  0.00001434  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    20950.00000  0.00101202 -0.00027536  0.00007572  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  5920.00000000  0.00427261 -0.00116307  0.00031920  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  1922.00000000  0.01541610 -0.00424281  0.00116851  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   688.00000000  0.04859760 -0.01361140  0.00374267  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   265.00000000  0.13006000 -0.03851140  0.01068170  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   108.20000000  0.27451400 -0.09066430  0.02526570  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    46.22000000  0.38540200 -0.16658400  0.04792830  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    20.23000000  0.25593400 -0.16144700  0.04770960  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     7.85900000  0.03912370  0.14678100 -0.04665250  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     3.54700000 -0.00368010  0.56668200 -0.23496800  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     1.56400000  0.00208211  0.41643300 -0.31133700  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.48880000 -0.00078848  0.03438440  0.25710900  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.22660000  0.00045405 -0.00780638  0.65365500  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.09331000 -0.00012664  0.00192259  0.29421200  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000  0.00000000
     3.11300000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000  0.00000000
     6.43400000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000  0.00000000
    13.29800000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
   14    8    0
  1367.00000000  0.00042102 -0.00010083  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   324.00000000  0.00360985 -0.00085450  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   104.60000000  0.01892170 -0.00457116  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    39.37000000  0.07055600 -0.01703270  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    16.26000000  0.18815700 -0.04752040  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     7.05600000  0.33870900 -0.08527860  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     3.13000000  0.38194300 -0.10967600  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     1.39400000  0.19526100 -0.01611810  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.51790000  0.01994160  0.32289300  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.20320000 -0.00135121  0.54573800  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.07698000  0.00051714  0.26853800  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
     3.11200000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
     6.61500000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
    14.06000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    6    6    0
     0.16500000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.41300000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.03600000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     2.59000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
     7.11900000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    19.56600000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    4    4    0
     0.28000000  1.00000000  0.00000000  0.00000000  0.00000000
     0.70300000  0.00000000  1.00000000  0.00000000  0.00000000
     2.31000000  0.00000000  0.00000000  1.00000000  0.00000000
    10.51800000  0.00000000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    2    2    0
     0.59700000  1.00000000  0.00000000
     2.32800000  0.00000000  1.00000000
a 16
$ SULFUR       (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]                           
$ SULFUR       Tight (3s,3p,3d,2f,1g)                                           
$ S-TYPE FUNCTIONS
   19    9    0
   727800.00000  0.00002360 -0.00000652  0.00000189  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   109000.00000  0.00018348 -0.00005066  0.00001469  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    24800.00000  0.00096428 -0.00026683  0.00007755  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  7014.00000000  0.00406537 -0.00112601  0.00032651  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  2278.00000000  0.01469730 -0.00411186  0.00119686  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   814.70000000  0.04650810 -0.01324540  0.00384799  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   313.40000000  0.12550800 -0.03770040  0.01105390  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   127.70000000  0.26843300 -0.08985540  0.02646450  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    54.48000000  0.38480900 -0.16709800  0.05087710  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    23.85000000  0.26537200 -0.16935400  0.05300300  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     9.42800000  0.04373260  0.12782400 -0.04255180  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     4.29000000 -0.00378807  0.56486200 -0.25085300  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     1.90900000  0.00218083  0.43176700 -0.33315200  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.62700000 -0.00083694  0.03893980  0.26379600  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.28730000  0.00044809 -0.00730260  0.66684900  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.11720000 -0.00012529  0.00192327  0.28845100  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000  0.00000000
     3.80700000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000  0.00000000
     7.78000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000  0.00000000
    15.90100000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
   14    8    0
  1546.00000000  0.00044118 -0.00011311  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   366.40000000  0.00377571 -0.00095858  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   118.40000000  0.01983600 -0.00513471  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    44.53000000  0.07420630 -0.01926410  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    18.38000000  0.19732700 -0.05359800  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     7.96500000  0.35185100 -0.09603330  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     3.54100000  0.37868700 -0.11818300  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     1.59100000  0.17093100  0.00923194  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.62050000  0.01515870  0.35884100  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.24200000  0.00006720  0.52581800  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.09014000  0.00040549  0.24887200  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
     3.52200000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
     7.53900000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
    16.13900000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    6    6    0
     0.20300000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.50400000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.25000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     3.11600000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
     8.52400000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    23.32300000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    4    4    0
     0.33500000  1.00000000  0.00000000  0.00000000  0.00000000
     0.86900000  0.00000000  1.00000000  0.00000000  0.00000000
     2.80100000  0.00000000  0.00000000  1.00000000  0.00000000
    12.70300000  0.00000000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    2    2    0
     0.68300000  1.00000000  0.00000000
     2.73900000  0.00000000  1.00000000
a 17
$ CHLORINE     (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]                           
$ CHLORINE     Tight (3s,3p,3d,2f,1g)                                           
$ S-TYPE FUNCTIONS
   19    9    0
   834900.00000  0.00002317 -0.00000650  0.00000197  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   125000.00000  0.00018015 -0.00005049  0.00001526  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    28430.00000  0.00094778 -0.00026611  0.00008061  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  8033.00000000  0.00400139 -0.00112499  0.00033996  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  2608.00000000  0.01446290 -0.00410497  0.00124551  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   933.90000000  0.04565860 -0.01319870  0.00399612  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   360.00000000  0.12324800 -0.03753420  0.01147510  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   147.00000000  0.26436900 -0.08972330  0.02755040  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    62.88000000  0.38298900 -0.16767100  0.05329170  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    27.60000000  0.27093400 -0.17476300  0.05712460  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    11.08000000  0.04714040  0.11490900 -0.03952010  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     5.07500000 -0.00371766  0.56361800 -0.26434300  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     2.27800000  0.00219158  0.44160600 -0.34929100  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.77750000 -0.00084985  0.04266970  0.26967100  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.35270000  0.00042466 -0.00667229  0.67607300  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.14310000 -0.00012002  0.00190729  0.28467900  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000  0.00000000
     4.57000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000  0.00000000
     9.27700000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000  0.00000000
    18.83100000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
   14    8    0
  1703.00000000  0.00047404 -0.00012827  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   403.60000000  0.00406412 -0.00109356  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   130.30000000  0.02133550 -0.00583429  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    49.05000000  0.07946110 -0.02192580  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    20.26000000  0.20892700 -0.06013850  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     8.78700000  0.36494500 -0.10692900  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     3.91900000  0.37172500 -0.12245400  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     1.76500000  0.14629200  0.03836190  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.72070000  0.01079060  0.38525600  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.28390000  0.00117004  0.50726500  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.10600000  0.00033941  0.22721800  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
     3.93200000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
     8.49200000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
    18.33800000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    6    6    0
     0.25400000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.62800000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.55100000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     3.79900000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
    10.31200000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    27.99100000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    4    4    0
     0.42300000  1.00000000  0.00000000  0.00000000  0.00000000
     1.08900000  0.00000000  1.00000000  0.00000000  0.00000000
     3.38900000  0.00000000  0.00000000  1.00000000  0.00000000
    15.18800000  0.00000000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    2    2    0
     0.82700000  1.00000000  0.00000000
     3.23900000  0.00000000  1.00000000
a 18
$ ARGON        (16s,11p,3d,2f,1g) -> [6s,5p,3d,2f,1g]                           
$ ARGON        Tight (3s,3p,3d,2f,1g)                                           
$ S-TYPE FUNCTIONS
   19    9    0
   950600.00000  0.00002275 -0.00000646  0.00000202  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   142300.00000  0.00017694 -0.00005023  0.00001569  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    32360.00000  0.00093128 -0.00026480  0.00008286  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  9145.00000000  0.00392860 -0.00111895  0.00034926  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  2970.00000000  0.01420640 -0.00408276  0.00127976  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
  1064.00000000  0.04481140 -0.01312160  0.00410365  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   410.80000000  0.12100100 -0.03728550  0.01177890  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
   168.00000000  0.26057900 -0.08947090  0.02838680  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    71.99000000  0.38136400 -0.16805400  0.05524060  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    31.67000000  0.27605800 -0.17959400  0.06074920  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
    12.89000000  0.05051790  0.10295300 -0.03620120  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     5.92900000 -0.00359866  0.56263000 -0.27539800  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     2.67800000  0.00218798  0.45035500 -0.36284500  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.94160000 -0.00086236  0.04606070  0.27311800  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.42390000  0.00040523 -0.00603691  0.68289900  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000  0.00000000
     0.17140000 -0.00011616  0.00188744  0.28341700  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000  0.00000000
     5.38600000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000  0.00000000
    10.86700000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000  0.00000000
    21.92600000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
   14    8    0
  1890.00000000  0.00049575 -0.00013886  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   447.80000000  0.00425172 -0.00118870  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
   144.60000000  0.02232770 -0.00632553  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    54.46000000  0.08308780 -0.02388130  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
    22.51000000  0.21711000 -0.06492380  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     9.77400000  0.37450700 -0.11544400  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     4.36800000  0.36644500 -0.12365100  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     1.95900000  0.12924500  0.06490550  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.82600000  0.00692249  0.40363300  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.32970000  0.00083615  0.49059200  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000
     0.12420000 -0.00015267  0.20852800  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000
     4.41100000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000
     9.55600000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000
    20.70200000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    6    6    0
     0.31100000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.76300000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.87300000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     4.53000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
    12.21500000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
    32.93300000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    4    4    0
     0.54300000  1.00000000  0.00000000  0.00000000  0.00000000
     1.32500000  0.00000000  1.00000000  0.00000000  0.00000000
     4.03000000  0.00000000  0.00000000  1.00000000  0.00000000
    17.87400000  0.00000000  0.00000000  0.00000000  1.00000000
$ G-TYPE FUNCTIONS
    2    2    0
     1.00700000  1.00000000  0.00000000
     3.81600000  0.00000000  1.00000000