%chk=000072684.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072684

0 1
 S   0.2161000      -2.820300      -1.525200    
 S  -0.2295000      -3.022500       1.391600    
 N   1.8000000E-03 -0.6194000      4.7699999E-02
 C  -0.7706000      0.1761000       1.005700    
 C   0.7429000      0.1881000     -0.9257000    
 C   -2.153800      0.4393000      0.4783000    
 C    2.144600      0.4400000     -0.4436000    
 C   -2.391200       1.574000     -0.2868000    
 C    2.412400       1.562600      0.3292000    
 C   -3.177600     -0.4548000      0.7630000    
 C    3.154900     -0.4528000     -0.7769000    
 C  -7.7999998E-03  -2.027800      4.6999998E-02
 C   -3.674600       1.818500     -0.7759000    
 C    3.712900       1.796600      0.7762000    
 C   -4.460900     -0.2105000      0.2740000    
 C    4.455400     -0.2190000     -0.3299000    
 C   -4.709300      0.9262000     -0.4954000    
 C    4.734300      0.9057000      0.4467000    
 H  -0.2570000       1.116900       1.228300    
 H  -0.8442000     -0.3433000       1.966600    
 H   0.2335000       1.139400      -1.107200    
 H   0.7810000     -0.2947000      -1.905800    
 H   -1.602500       2.288900     -0.4999000    
 H    1.631600       2.272900      0.5837000    
 H   -3.005000      -1.339000       1.367900    
 H    2.957900      -1.328600      -1.386800    
 H   -3.869200       2.705700      -1.371300    
 H    3.930800       2.673900       1.378300    
 H   -5.267300     -0.9039000      0.4943000    
 H    5.251300     -0.9115000     -0.5879000    
 H   -5.708900       1.117300     -0.8748000    
 H    5.747100       1.088400      0.7937000    
 H   0.1371000      -4.082300      -1.078600    


%chk=000072684-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072684

0 1
S 0.867920 -3.442713 -1.418564
S -0.857275 -3.624079 1.147930
N -0.026317 -1.278198 -0.021047
C -0.649204 -0.487996 1.083492
C 0.604068 -0.449410 -1.087567
C -1.890387 0.272001 0.632973
C 1.864737 0.273917 -0.619432
C -1.950475 1.683593 0.738246
C 1.955988 1.683763 -0.720611
C -3.011881 -0.431371 0.120375
C 2.964031 -0.453983 -0.095730
C -0.064402 -2.646264 -0.010824
C -3.114135 2.385374 0.345484
C 3.129899 2.359513 -0.313756
C -4.171416 0.268704 -0.276993
C 4.134079 0.219841 0.316204
C -4.226899 1.679081 -0.164721
C 4.221542 1.628534 0.206736
H 0.117722 0.211626 1.463412
H -0.897518 -1.208862 1.881986
H -0.151309 0.286306 -1.420690
H 0.824314 -1.095756 -1.954207
H -1.087859 2.233536 1.136217
H 1.108486 2.253629 -1.122609
H -2.970563 -1.524524 0.046102
H 2.901233 -1.545662 -0.014876
H -3.151318 3.476833 0.436099
H 3.190499 3.450159 -0.399965
H -5.034006 -0.282962 -0.667351
H 4.978568 -0.350989 0.718106
H -5.129349 2.220306 -0.470350
H 5.131623 2.149460 0.524390
H 0.505805 -4.713308 -1.017960


