File: aug-cc-pCVTZ-CTOCD-uc

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$Basis = aug-cc-pCVTZ-CTOCD-uc

$Elements supported
$H C N O F
$
$  REFERENCE   A. Ligabue, S. P. A. Sauer and P. Lazzeretti, J. Chem. Phys. 118, 6830-6845 (2003)
$              T. H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989)
$              R. A. Kendall, T. H. Dunning, Jr. and R. J. Harrison, J. Chem. Phys. 96, 6769 (1992).
$              D. E. Woon and T. H. Dunning, Jr. J. Chem. Phys. 103, 4572 (1995).
************************************************************************
a 1
$ HYDROGEN     (6s,4p,1d) -> [4s,4p,1d]
$ HYDROGEN     Diffuse (1s,1p)
$ S-TYPE FUNCTIONS
    6    4    0
     33.8700000  0.006068    0.00000000  0.00000000  0.00000000
      5.0950000  0.045308    0.00000000  0.00000000  0.00000000
      1.1590000  0.202822    0.00000000  0.00000000  0.00000000
      0.3258000  0.503903    1.00000000  0.00000000  0.00000000
      0.1027000  0.383421    0.00000000  1.00000000  0.00000000
      0.0252600  0.0         0.00000000  0.00000000  1.00000000
$ P-TYPE FUNCTIONS
    5    5    0
     18.5020000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
      5.1020000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
      1.4070000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
      0.3880000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
      0.1020000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    2    2    0
      1.05700    1.00000000  0.00000000
      0.24700    0.00000000  1.00000000
a 6
$ CARBON       (11s,10p,5d,1f) -> [5s,10p,5d,1f]
$ CARBON       Diffuse (1s,1p,1d)
$ S-TYPE FUNCTIONS
   11    5    0
   8236.0000000  0.000531   -0.000113    0.0         0.0         0.0
   1235.0000000  0.004108   -0.000878    0.0         0.0         0.0
    280.8000000  0.021087   -0.004540    0.0         0.0         0.0
     79.2700000  0.081853   -0.018133    0.0         0.0         0.0
     25.5900000  0.234817   -0.055760    0.0         0.0         0.0
      8.9970000  0.434401   -0.126895    0.0         0.0         0.0
      3.3190000  0.346129   -0.170352    0.0         0.0         0.0
      0.9059000  0.039378    0.140382    1.0         0.0         0.0
      0.3643000 -0.008983    0.598684    0.0         0.0         0.0
      0.1285000  0.002385    0.395389    0.0         1.0         0.0
      0.0440200  0.000000    0.0         0.0         0.0         1.0
$ P-TYPE FUNCTIONS
   11   11    0
   1736.0000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
    383.4000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     84.7000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     33.1900000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     18.7100000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
      8.7780000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
      4.1330000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
      1.2000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
      0.3827000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
      0.1209000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
      0.0356900  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    6    6    0
    45.03000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
    14.83900000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     3.78400000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
      1.0970000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
      0.3180000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
      0.1000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    2    2    0
      0.7610000  1.00000000  0.00000000
      0.2680000  0.00000000  1.00000000
a 7
$ NITROGEN     (11s,10p,5d,1f) -> [5s,10p,5d,1f]
$ NITROGEN     Diffuse (1s,1p,1d)
$ S-TYPE FUNCTIONS
   11    5    0
  11420.000000   0.000523   -0.000115    0.0         0.0         0.0
   1712.000000   0.004045   -0.000895    0.0         0.0         0.0
    389.300000   0.020775   -0.004624    0.0         0.0         0.0
    110.000000   0.080727   -0.018528    0.0         0.0         0.0
     35.570000   0.233074   -0.057339    0.0         0.0         0.0
     12.540000   0.433501   -0.132076    0.0         0.0         0.0
      4.644000   0.347472   -0.172510    0.0         0.0         0.0
      1.293000   0.041262    0.151814    1.0         0.0         0.0
      0.511800  -0.008508    0.599944    0.0         0.0         0.0
      0.1787000  0.002384    0.387462    0.0         1.0         0.0
      0.0576000  0.000000    0.000000    0.0         0.0         1.0
$ P-TYPE FUNCTIONS
   11   11    0
   2390.0000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
    533.8000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
    119.2000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     44.8490000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     26.6300000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     11.8710000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
      5.9480000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
      1.7420000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
      0.5550000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
      0.1725000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
      0.0491000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    6    6    0
    72.55000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
    14.20000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     5.83300000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
      1.6540000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
      0.4690000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
      0.1510000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    2    2    0
      1.0930000  1.00000000  0.00000000
      0.364      0.00000000  1.00000000
a 8
$ OXYGEN       (11s,10p,5d,1f) -> [5s,10p,5d,1f]
$ OXYGEN       Diffuse (1s,1p,1d)
$ S-TYPE FUNCTIONS
   11    5    0
  15330.00000    0.000508   -0.000115    0.0         0.0         0.0
   2299.00000    0.003929   -0.000895    0.0         0.0         0.0
    522.40000    0.020243   -0.004636    0.0         0.0         0.0
    147.30000    0.079181   -0.018724    0.0         0.0         0.0
     47.55000    0.230687   -0.058463    0.0         0.0         0.0
     16.76000    0.433118   -0.136463    0.0         0.0         0.0
      6.20700    0.350260   -0.175740    0.0         0.0         0.0
      1.75200    0.042728    0.160934    1.0         0.0         0.0
      0.68820   -0.008154    0.603418    0.0         0.0         0.0
      0.23840    0.002381    0.378765    0.0         1.0         0.0
      0.07376    0.000000    0.000000    0.0         0.0         1.0
$ P-TYPE FUNCTIONS
   11   11    0
   3031.00000    1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
    681.5000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
    153.2000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     57.4370000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     34.4600000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     15.1590000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
      7.7490000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
      2.2800000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
      0.7156000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
      0.2140000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
      0.0597400  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    6    6    0
    106.8000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
    15.85800000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     8.30200000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
      2.3140000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
      0.6450000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
      0.2140000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    2    2    0
      1.4280000  1.00000000  0.00000000
      0.5000000  0.00000000  1.00000000
a 9
$ FLUORINE     (11s,10p,5d,1f) -> [5s,10p,5d,1f]
$ FLUORINE     Diffuse (1s,1p,1d)
$ S-TYPE FUNCTIONS
   11    5    0
  19500.00000    0.000507   -0.000117    0.0         0.0         0.0
   2923.00000    0.003923   -0.000912    0.0         0.0         0.0
    664.50000    0.020200   -0.004717    0.0         0.0         0.0
    187.50000    0.079010   -0.019086    0.0         0.0         0.0
     60.62000    0.230439   -0.059655    0.0         0.0         0.0
     21.42000    0.432872   -0.140010    0.0         0.0         0.0
      7.95000    0.349964   -0.176782    0.0         0.0         0.0
      2.25700    0.043233    0.171625    1.0         0.0         0.0
      0.88150   -0.007892    0.605043    0.0         0.0         0.0
      0.30410    0.002384    0.369512    0.0         1.0         0.0
      0.09158    0.000000    0.000000    0.0         0.0         1.0
$ P-TYPE FUNCTIONS
   11   11    0
   3791.00000    1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
    857.5000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
    194.0000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     71.3480000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     43.8800000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     18.7560000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
      9.9260000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
      2.9300000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
      0.9132000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
      0.2672000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
      0.0736100  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ D-TYPE FUNCTIONS
    6    6    0
    149.0000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000
    19.10800000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000  0.00000000
     11.2900000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000  0.00000000
      3.1070000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000  0.00000000
      0.8550000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000  0.00000000
      0.2920000  0.00000000  0.00000000  0.00000000  0.00000000  0.00000000  1.00000000
$ F-TYPE FUNCTIONS
    2    2    0
      1.9170000  1.00000000  0.00000000
      0.7240000  0.00000000  1.00000000