%chk=000121690.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121690

0 1
 S   -2.988900      2.8200001E-02  0.1485000    
 O   -3.620800      -1.165600      0.6921000    
 O   -3.206000       1.317300      0.7908000    
 O    1.412200       2.819500      8.4700003E-02
 O    3.121000       1.443900     -7.5199999E-02
 N    2.856500      -1.020700     -0.1989000    
 N    1.890200       1.665000     -2.7000001E-03
 C   -1.271600     -0.2712000      4.7100000E-02
 C    1.471700     -0.7510000     -0.1153000    
 C  -0.3748000      0.7970000      6.1700001E-02
 C   0.9969000      0.5572000     -1.9500000E-02
 C  -0.7968000      -1.579200     -4.8700001E-02
 C   0.5749000      -1.819100     -0.1298000    
 C   -3.507900      0.1988000      -1.544100    
 C    3.443400      -2.219900      0.3092000    
 H  -0.7643000       1.809600      0.1292000    
 H   -1.477600      -2.425600     -7.1199998E-02
 H   0.9090000      -2.849100     -0.2146000    
 H   -3.287300     -0.7274000      -2.078200    
 H   -4.584000      0.3852000      -1.551300    
 H   -2.980900       1.042100      -1.994200    
 H    3.481200     -0.2621000     -0.4392000    
 H    3.136600      -2.412200       1.342700    
 H    4.534400      -2.127000      0.3027000    
 H    3.190800      -3.086100     -0.3105000    


%chk=000121690-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121690

0 1
S -3.077746 0.040667 0.121220
O -3.741188 -1.345979 0.688143
O -3.313060 1.494154 0.831601
O 1.371203 2.936649 -0.121239
O 3.207096 1.590897 -0.039217
N 2.919373 -1.012715 0.069549
N 1.902929 1.764199 -0.053012
C -1.217203 -0.262397 0.037825
C 1.574094 -0.759439 0.057948
C -0.356530 0.829131 0.006697
C 1.039620 0.589664 0.003399
C -0.755501 -1.597882 0.102801
C 0.619632 -1.836555 0.110896
C -3.637475 0.219122 -1.703388
C 3.507622 -2.351316 0.132422
H -0.723594 1.860633 0.012280
H -1.479671 -2.416678 0.178193
H 0.984699 -2.864896 0.167041
H -3.377210 -0.718006 -2.214001
H -4.724107 0.373706 -1.647391
H -3.114908 1.093396 -2.114802
H 3.515120 -0.169320 0.040742
H 3.212677 -2.887446 1.055054
H 4.603942 -2.251956 0.131374
H 3.218085 -2.970035 -0.738836


