%chk=000075846.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075846

0 1
 S   0.5594000      -1.832600      0.9656000    
 S  -0.6267000      -1.925800     -0.7144000    
 N    3.740700       1.201300     -0.3061000    
 N   -3.694400       1.362200      0.1347000    
 C    1.797600     -0.6517000      0.4707000    
 C   -1.822400     -0.6442000     -0.3834000    
 C    2.604900     -0.9076000     -0.6322000    
 C   -1.578900      0.6585000     -0.8000000    
 C    1.960600      0.5296000       1.185500    
 C   -2.998200     -0.9477000      0.2910000    
 C    3.552900      4.2399999E-02 -0.9764000    
 C   -2.538700       1.617300     -0.5188000    
 C    2.937600       1.415200      0.7601000    
 C   -3.894400      8.3099999E-02  0.5237000    
 H    2.521000      -1.819200      -1.214800    
 H  -0.6735000      0.9351000      -1.330300    
 H    1.350400      0.7675000       2.050600    
 H   -3.224700      -1.952600      0.6321000    
 H    4.209000     -0.1103000      -1.826900    
 H   -2.398000       2.649500     -0.8221000    
 H    3.104500       2.351100       1.283100    
 H   -4.827600     -9.9699996E-02   1.046200    


%chk=000075846-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000075846

0 1
S 0.663233 -0.596648 2.116671
S -0.777296 -1.869651 0.935847
N 4.027600 0.743505 -0.861161
N -3.953512 1.048343 -0.902601
C 1.949935 -0.116629 0.881534
C -1.989607 -0.654321 0.253467
C 1.876991 -0.383974 -0.500957
C -1.853667 0.746872 0.332468
C 3.072026 0.580667 1.392534
C -3.117734 -1.203676 -0.403613
C 2.936393 0.064940 -1.323889
C -2.858159 1.548708 -0.258213
C 4.074398 0.986994 0.481521
C -4.061860 -0.311369 -0.962653
H 1.033418 -0.933084 -0.930665
H -1.004089 1.208661 0.844998
H 3.178534 0.804283 2.459102
H -3.272838 -2.284716 -0.482257
H 2.913073 -0.125562 -2.402592
H -2.785141 2.641087 -0.215855
H 4.956203 1.528319 0.841995
H -4.946802 -0.701349 -1.477780


