%chk=000131923.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131923

0 1
 S   -4.308700      -1.728800     -0.2986000    
 F    1.257700      -1.741100     -0.3418000    
 F    2.479000       2.792700      8.9299999E-02
 O   -2.544700       2.833700      0.2760000    
 O   -5.247300       1.898400      8.0100000E-02
 N   -1.536800      -1.102700     -0.1500000    
 N    3.192600      0.1445000     -0.2062000    
 N    6.653900      1.6300000E-02  0.9117000    
 N   -5.344400     -0.4072000     -0.1772000    
 C   -1.214600      -2.549900     -0.2288000    
 C  -0.3173000      -3.184100      0.7773000    
 C   -1.782300      -3.508500      0.7601000    
 C  -0.4935000     -0.1254000     -9.6100003E-02
 C    5.377100     -0.4659000      0.4149000    
 C   -2.878300     -0.6986000     -0.1439000    
 C    4.188000      0.4069000      0.8333000    
 C    3.779200     -0.5487000      -1.352300    
 C    5.284900     -0.4480000      -1.106900    
 C    1.866500      0.5100000     -0.1191000    
 C  -0.8117000       1.241000      4.5200001E-02
 C   0.8681000     -0.4671000     -0.1820000    
 C   -3.241800      0.5947000     -1.5600000E-02
 C   -2.229300       1.661600      0.1193000    
 C    1.527300       1.850400      2.8600000E-02
 C   0.1883000       2.220600      0.1100000    
 C   -4.711900      0.8051000     -2.7400000E-02
 H   -1.126200      -2.889800      -1.255800    
 H   3.4000002E-02  -2.618700       1.632300    
 H   0.3639000      -3.957600      0.4426000    
 H   -2.075900      -4.488800      0.4048000    
 H   -2.360200      -3.148300       1.602400    
 H    5.216900      -1.490200      0.7749000    
 H    3.825500      0.1285000       1.829000    
 H    4.451300       1.471200      0.8375000    
 H    3.503300     -7.9200000E-02  -2.302200    
 H    3.466200      -1.598200      -1.367100    
 H    5.838900      -1.264200      -1.580500    
 H    5.661400      0.4999000      -1.512900    
 H  -5.7599999E-02   3.273200      0.2198000    
 H    6.812000      0.9727000      0.5963000    
 H    7.408400     -0.5391000      0.5101000    
 H   -6.352700     -0.5086000     -0.2129000    


%chk=000131923-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000131923

0 1
S -4.203131 -1.743323 -0.834561
F 1.208915 -1.773950 -0.709177
F 2.504195 2.672561 0.796185
O -2.539452 2.797671 0.887447
O -5.375991 1.937739 -0.031511
N -1.548655 -1.140383 -0.216531
N 3.281513 0.074961 -0.130618
N 6.891855 0.593375 0.399201
N -5.278583 -0.301637 -0.666572
C -1.315384 -2.587006 -0.287284
C -0.616362 -3.293095 0.872670
C -2.112942 -3.518370 0.652239
C -0.504264 -0.187039 -0.006463
C 5.638746 -0.144677 0.246321
C -2.842139 -0.652877 -0.286340
C 4.417537 0.760234 0.548301
C 3.770541 -0.995934 -1.059578
C 5.280650 -0.712089 -1.163370
C 1.950309 0.399937 0.070255
C -0.847680 1.139044 0.410247
C 0.866070 -0.494159 -0.196247
C -3.240257 0.646265 0.002030
C -2.256527 1.626406 0.480828
C 1.519882 1.688920 0.543777
C 0.193580 2.053930 0.697137
C -4.687183 0.896487 -0.201520
H -1.093212 -2.953914 -1.294192
H -0.326894 -2.681805 1.732311
H 0.093418 -4.082411 0.614657
H -2.456999 -4.469797 0.237805
H -2.797659 -3.060137 1.370502
H 5.652702 -0.983577 0.968721
H 4.235004 0.866081 1.630172
H 4.596114 1.771444 0.135635
H 3.250168 -0.932488 -2.030782
H 3.585012 -2.002220 -0.641332
H 5.858360 -1.616139 -1.421257
H 5.484416 0.063099 -1.926881
H -0.082124 3.067350 1.005127
H 7.002332 1.398737 -0.223309
H 7.736625 0.023679 0.474421
H -6.283308 -0.388193 -0.830262


