%chk=000038835.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038835

1 1
 S   -2.729800      -1.241300     -0.9285000    
 P   -3.883100     -8.6199999E-02  0.3895000    
 O   -3.308000       1.425700      0.5148000    
 O    3.777100       2.529900      0.4878000    
 O   -3.980200     -0.7565000       1.734500    
 N    1.151100      -2.355700     -0.2607000    
 C  -0.1513000      -2.232400     -0.9598000    
 C    1.876900      -1.004400     -5.3100001E-02
 C   0.9358000      -2.974100       1.133500    
 C    2.095200      -3.257700      -1.077900    
 C   -1.122600      -1.411300     -0.1278000    
 C    1.625100     -4.6999998E-02 -0.9665000    
 C    2.688100     -0.9218000       1.018700    
 C    2.279800       1.170500     -0.7806000    
 C    3.342800      0.2958000       1.204600    
 C    3.138600       1.342000      0.3050000    
 C   -5.510700      0.1365000     -0.3289000    
 C   -3.149600       2.243200     -0.6308000    
 C   -2.598700       3.587400     -0.2048000    
 C    3.523400       3.557500     -0.4692000    
 H  -0.5469000      -3.251400      -1.077000    
 H  -8.8000000E-03  -1.854700      -1.978000    
 H   0.2024000      -3.782000       1.028700    
 H    1.865100      -3.436800       1.481600    
 H   0.5602000      -2.226100       1.839400    
 H    3.050300      -3.345600     -0.5510000    
 H    1.623900      -4.240900      -1.170000    
 H    2.236700      -2.807600      -2.065400    
 H  -0.7654000     -0.4004000      7.9499997E-02
 H   -1.334200      -1.885300      0.8340000    
 H   0.9938000     -0.1398000      -1.838000    
 H    2.915200      -1.707700       1.724500    
 H    2.081200       1.939300      -1.519800    
 H    4.017500      0.4216000       2.047200    
 H   -6.105500      0.8201000      0.2831000    
 H   -6.032600     -0.8238000     -0.3763000    
 H   -5.451900      0.5369000      -1.344300    
 H   -4.115500       2.384800      -1.122600    
 H   -2.460400       1.764700      -1.332200    
 H   -2.464700       4.246100      -1.067400    
 H   -3.272900       4.072200      0.5090000    
 H   -1.634500       3.465900      0.2999000    
 H    2.471400       3.862300     -0.4629000    
 H    3.866200       3.269600      -1.468800    
 H    4.111200       4.431100     -0.1690000    


%chk=000038835-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038835

1 1
S -2.226076 0.581527 -2.087588
P -3.710753 -0.534842 -0.642013
O -4.206777 0.651003 0.514439
O 5.538574 1.661915 0.245281
O -2.968489 -1.737195 0.113539
N 0.754036 -1.488789 0.103562
C -0.227733 -1.065214 -1.032985
C 2.003993 -0.619488 0.127292
C -0.017022 -1.471418 1.430868
C 1.160581 -2.946068 -0.167662
C -0.754113 0.370147 -0.899930
C 2.707880 -0.407422 -1.078413
C 2.499255 -0.083841 1.339822
C 3.894307 0.352951 -1.087315
C 3.681999 0.673190 1.336893
C 4.389449 0.901091 0.126826
C -5.163340 -0.991937 -1.707971
C -4.861352 1.931016 0.084267
C -5.059623 2.751111 1.353898
C 6.335602 1.934048 -0.964996
H -1.065694 -1.778115 -0.962886
H 0.294756 -1.202558 -1.992225
H -1.010160 -1.915999 1.254445
H 0.548744 -2.043946 2.180412
H -0.147831 -0.435910 1.772132
H 1.881326 -3.256812 0.602969
H 0.259256 -3.577726 -0.132212
H 1.631776 -3.010408 -1.158902
H -0.019077 1.133451 -1.198490
H -1.119578 0.598980 0.112642
H 2.356981 -0.822004 -2.029260
H 1.990998 -0.241984 2.293625
H 4.419457 0.507720 -2.033318
H 4.079852 1.097427 2.262717
H -5.949212 -1.412600 -1.059666
H -4.839220 -1.750571 -2.436646
H -5.545601 -0.107796 -2.241038
H -5.829858 1.695581 -0.398550
H -4.199633 2.441788 -0.642030
H -5.555037 3.706894 1.103374
H -5.693484 2.209810 2.075283
H -4.092494 2.975443 1.833550
H 5.744550 2.502030 -1.707187
H 6.712120 0.993914 -1.408875
H 7.178367 2.544203 -0.613679


