%chk=000037016.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037016

0 1
 S   -1.622600       1.072500     -8.2999999E-03
 O    1.998500      -1.926400     -3.5500001E-02
 O    5.335500      0.4431000      2.6100000E-02
 O   -5.131600     -0.5733000      2.1900000E-02
 O   -4.505900       1.530900      3.1000001E-03
 N   0.8866000      0.2024000     -1.5000000E-02
 N    3.149300      0.1035000     -2.7999999E-03
 N  -0.9448000      -1.422000      6.0999999E-03
 N    4.483200     -0.4506000      1.8200001E-02
 N   -4.216500      0.2997000      1.0200000E-02
 C    1.366200       1.577600     -0.1118000    
 C    2.870400       1.504000      9.0099998E-02
 C    1.995700     -0.7023000     -1.5300000E-02
 C  -0.4644000     -0.1959000     -4.6999999E-03
 C   -2.874900     -9.9200003E-02  5.5999998E-03
 C   -2.324800      -1.363900      1.2000000E-02
 H   0.9080000       2.215500      0.6505000    
 H    1.127500       1.960700      -1.110500    
 H    3.411900       2.071000     -0.6733000    
 H    3.155300       1.857800       1.086800    
 H   -2.883400      -2.290900      2.1400001E-02


%chk=000037016-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000037016

0 1
S -1.671972 1.253919 -0.059233
O 1.951225 -1.986626 -0.013645
O 5.380388 0.362606 0.026041
O -5.135021 -0.762005 -0.016089
O -4.646516 1.485784 -0.087076
N 0.919237 0.196225 0.002301
N 3.177396 0.073774 0.007143
N -0.934875 -1.357677 0.039836
N 4.453960 -0.515265 0.002524
N -4.306909 0.232980 -0.043267
C 1.375637 1.612033 -0.022394
C 2.925548 1.528564 0.040947
C 2.002595 -0.753063 -0.002582
C -0.423650 -0.129158 0.001148
C -2.903036 -0.071438 -0.023484
C -2.317447 -1.333065 0.025409
H 0.960277 2.158720 0.842299
H 1.030114 2.102593 -0.949967
H 3.420464 2.018531 -0.813924
H 3.343481 1.962244 0.965293
H -2.881696 -2.265476 0.053521


