%chk=000079992.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079992

0 1
 S   -8.376400      0.4103000     -3.4299999E-02
 N   -4.416700     -0.4735000      7.9999998E-04
 C    1.876900      0.4779000     -9.4999997E-03
 C   0.6184000     -0.3924000      2.9200001E-02
 C    3.175500     -0.3353000     -4.4900000E-02
 C  -0.6788000      0.4225000      7.7200003E-02
 C    4.472100      0.4802000     -6.1999999E-02
 C   -1.940500     -0.4467000      3.5300002E-02
 C    5.735300     -0.3827000     -4.0399998E-02
 C   -3.231400      0.3752000      2.2900000E-02
 C    6.994700      0.4818000      3.2099999E-02
 C    8.255200     -0.3685000      2.1199999E-02
 C   -5.630800      0.3301000     -2.1400001E-02
 C   -6.853400     -0.5790000     -6.3000000E-03
 H    1.840100       1.130800     -0.8900000    
 H    1.889600       1.132700      0.8704000    
 H   0.6048000      -1.039500     -0.8565000    
 H   0.6596000      -1.053000      0.9039000    
 H    3.159400     -0.9866000     -0.9280000    
 H    3.192700      -1.000100      0.8283000    
 H  -0.6888000       1.033900      0.9879000    
 H  -0.6956000       1.117100     -0.7717000    
 H    4.477000       1.149700      0.8072000    
 H    4.481600       1.119600     -0.9533000    
 H   -1.939400      -1.117300      0.9041000    
 H   -1.908800      -1.084100     -0.8576000    
 H    5.764100      -1.009600     -0.9397000    
 H    5.704900      -1.057600      0.8235000    
 H   -3.224200       1.025900     -0.8602000    
 H   -3.248900       1.020800      0.9098000    
 H    6.977800       1.089500      0.9442000    
 H    7.021200       1.173100     -0.8183000    
 H   -4.417700      -1.082100      0.8188000    
 H   -5.654000      0.9960000      0.8506000    
 H   -5.643600      0.9521000     -0.9253000    
 H    8.318900     -0.9639000     -0.8952000    
 H    9.143100      0.2693000      7.4299999E-02
 H    8.275200      -1.051100      0.8768000    
 H   -6.857700      -1.242400     -0.8777000    
 H   -6.866900      -1.203000      0.8938000    
 H   -9.229700     -0.6240000     -1.5300000E-02


%chk=000079992-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000079992

0 1
S -8.540501 0.272939 -0.017040
N -4.454230 -0.387119 0.123333
C 1.905145 0.477796 0.015271
C 0.612968 -0.369267 0.042138
C 3.194029 -0.374823 0.008948
C -0.677244 0.481339 0.047039
C 4.488474 0.469261 -0.012737
C -1.964087 -0.373138 0.079496
C 5.776314 -0.385059 -0.018534
C -3.250579 0.474916 0.075176
C 7.071749 0.458465 -0.038971
C 8.352526 -0.404142 -0.043972
C -5.744479 0.333496 0.102798
C -6.889513 -0.673649 -0.090257
H 1.895270 1.133617 -0.880503
H 1.918086 1.154817 0.895164
H 0.600816 -1.047354 -0.836588
H 0.623453 -1.023794 0.938955
H 3.182355 -1.049574 -0.872669
H 3.201724 -1.033391 0.902848
H -0.662354 1.163113 0.923063
H -0.689749 1.131163 -0.852894
H 4.500595 1.143969 0.868996
H 4.481797 1.127659 -0.906749
H -1.950608 -1.015420 0.986464
H -1.989555 -1.057319 -0.790779
H 5.766075 -1.059248 -0.900671
H 5.784021 -1.044153 0.874991
H -3.295547 1.070465 -0.858466
H -3.210852 1.208446 0.920973
H 7.080959 1.132181 0.842242
H 7.063342 1.116181 -0.932201
H -4.404287 -1.046218 0.914100
H -5.930490 0.942286 1.022913
H -5.731866 1.037690 -0.750328
H 8.380259 -1.065923 -0.930355
H 9.264172 0.221288 -0.060409
H 8.399775 -1.047515 0.855043
H -6.793589 -1.170521 -1.067906
H -6.887403 -1.432197 0.711977
H -9.342174 -0.795165 -0.385197


