%chk=000079611.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079611

0 1
 S   -3.896000     -3.7999999E-02 -8.2300000E-02
 O    2.538200      -2.288800     -0.3886000    
 O    2.498500       2.296500      0.3984000    
 O   -4.348100      0.8968000      -1.103300    
 O   -4.349000      -1.421700     -0.1172000    
 N    2.071600      1.1000000E-03 -1.4000000E-03
 N   -4.247200      0.6149000       1.457200    
 C    4.287000     -0.7368000      9.9799998E-02
 C    4.279500      0.7671000     -4.2800002E-02
 C    2.858900      -1.136300     -0.1313000    
 C    2.840500       1.148200      0.1495000    
 C   0.6390000     -8.0000004E-03 -2.0700000E-02
 C  -5.7300001E-02  -1.124500      0.4419000    
 C  -5.9200000E-02   1.099300     -0.5023000    
 C   -2.150500     -2.6300000E-02 -5.8499999E-02
 C   -1.452000      -1.133700      0.4229000    
 C   -1.453900       1.090200     -0.5213000    
 H    4.578200      -1.042700       1.109900    
 H    4.949300      -1.209600     -0.6302000    
 H    4.594000       1.076900      -1.044700    
 H    4.915700       1.248000      0.7047000    
 H   0.4509000      -1.990400      0.8549000    
 H   0.4486000       1.973000     -0.8988000    
 H   -1.974400      -2.008200      0.8004000    
 H   -1.977400       1.963200     -0.9010000    
 H   -4.634400       1.565700       1.494800    
 H   -4.632900     -1.9300001E-02   2.167400    


%chk=000079611-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000079611

0 1
S -3.979233 -0.042872 -0.039313
O 2.505390 -2.345115 -0.263943
O 2.465728 2.341700 0.268612
O -4.461885 0.993551 -1.199728
O -4.466544 -1.594384 0.044904
N 2.119326 -0.004144 -0.002625
N -4.429550 0.716398 1.576496
C 4.401935 -0.748417 -0.105229
C 4.389054 0.777390 0.107592
C 2.935614 -1.178511 -0.136271
C 2.915766 1.182875 0.137006
C 0.678347 -0.013780 -0.007321
C -0.020811 -1.116391 0.549059
C -0.028446 1.075726 -0.579217
C -2.097089 -0.026587 -0.013496
C -1.430229 -1.126442 0.544733
C -1.437715 1.073281 -0.580713
H 4.917046 -1.300251 0.699161
H 4.874832 -1.052548 -1.054852
H 4.895344 1.337563 -0.696685
H 4.856348 1.089594 1.057352
H 0.526851 -1.964235 0.962873
H 0.513097 1.921479 -1.005215
H -1.992259 -1.975382 0.945579
H -2.006593 1.890511 -1.034488
H -4.915275 1.609522 1.389593
H -5.011447 0.036068 2.093538


