%chk=000006967.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006967

0 1
 S    1.897600      0.8206000      0.8242000    
 S    2.422600      0.2671000      -2.039700    
 O   -1.607200       3.213200     -0.2212000    
 O   0.5160000       2.970100      0.2805000    
 O   -3.801800      -2.557400     -8.0300003E-02
 O   -4.547400     -0.5294000     -0.4683000    
 N    3.859200     -0.8904000      9.3999999E-03
 N  -0.6251000       2.495100      7.7100001E-02
 N   -3.618200      -1.319700     -0.1745000    
 C   0.2380000      0.2287000      0.5182000    
 C  -0.8127000       1.087700      0.1893000    
 C   -2.318500     -0.7973000      5.9099998E-02
 C   -2.089700      0.5752000     -3.9999999E-02
 C   6.2000002E-03  -1.144800      0.6169000    
 C   -1.270700      -1.657200      0.3875000    
 C    2.829400     -3.3000000E-02 -0.4260000    
 C    4.706700      -1.630600     -0.9280000    
 C    4.215600      -1.098000       1.415700    
 H   -2.911900       1.239100     -0.2967000    
 H   0.8043000      -1.836400      0.8770000    
 H   -1.412200      -2.731500      0.4748000    
 H    4.566400      -2.701200     -0.7482000    
 H    5.750800      -1.366800     -0.7315000    
 H    4.495800      -1.429500      -1.977700    
 H    4.588300      -2.118000       1.553100    
 H    3.367700     -0.9631000       2.088400    
 H    5.004500     -0.3862000       1.675900    


%chk=000006967-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006967

0 1
S 1.980991 1.055175 -0.133107
S 2.765323 -0.844697 -2.486869
O -1.814517 3.309372 0.514363
O 0.459439 3.119919 0.498818
O -3.766276 -2.631519 0.027055
O -4.649476 -0.555581 0.390324
N 3.881233 -0.976024 -0.000639
N -0.733345 2.614709 0.417438
N -3.656957 -1.352748 0.179380
C 0.311937 0.341870 -0.026916
C -0.840616 1.156810 0.210978
C -2.298995 -0.769034 0.108109
C -2.140423 0.612739 0.273208
C 0.093709 -1.056603 -0.184613
C -1.187616 -1.615526 -0.118004
C 2.958123 -0.431956 -0.851374
C 4.847847 -1.959276 -0.550900
C 4.015017 -0.691691 1.447450
H -2.997652 1.267697 0.449199
H 0.947314 -1.710130 -0.378762
H -1.347289 -2.690050 -0.238544
H 4.332449 -2.895625 -0.830946
H 5.616004 -2.167195 0.210184
H 5.316179 -1.552566 -1.463536
H 3.979699 -1.640438 2.012433
H 3.201048 -0.038301 1.790120
H 4.980550 -0.193031 1.650151


