%chk=000071644.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071644

0 1
 S  -0.7764000     -0.6330000       1.847700    
 N    2.988500       1.492700      0.3512000    
 C   0.7790000      0.8938000     -0.5088000    
 C    2.038200       1.697600     -0.7245000    
 C   0.9519000     -0.5783000     -0.3790000    
 C  -0.4109000       1.526400     -0.4644000    
 C   0.3315000      -1.342900      0.6317000    
 C   -1.745000      0.9341000     -0.2658000    
 C   -2.033300     -7.4999998E-03  0.7385000    
 C    1.800900      -1.243500      -1.284200    
 C   0.5744000      -2.723800      0.7219000    
 C   -2.789700       1.399100      -1.081000    
 C    2.416100       1.897200       1.639800    
 C    4.230400       2.232100      0.1008000    
 C   -3.345600     -0.4760000      0.9000000    
 C    2.029900      -2.617700      -1.190900    
 C    1.419000      -3.356900     -0.1865000    
 C   -4.090700      0.9221000     -0.9180000    
 C   -4.367900     -1.5300000E-02  7.1500003E-02
 H    1.800700       2.767300     -0.8170000    
 H    2.483700       1.424300      -1.688800    
 H  -0.4332000       2.606800     -0.6037000    
 H    2.290400     -0.7089000      -2.094700    
 H   0.1048000      -3.323400       1.499000    
 H   -2.599700       2.139400      -1.855700    
 H    1.584600       1.262200       1.950300    
 H    2.077700       2.940100       1.632300    
 H    3.166800       1.796300       2.432900    
 H    4.685400       1.909100     -0.8422000    
 H    4.964600       2.028600      0.8882000    
 H    4.064600       3.314500      5.2499998E-02
 H   -3.587400      -1.204500       1.670700    
 H    2.685800      -3.107500      -1.904800    
 H    1.597200      -4.425400     -0.1105000    
 H   -4.887000       1.286800      -1.560200    
 H   -5.380800     -0.3850000      0.2020000    


%chk=000071644-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071644

0 1
S -0.991714 -0.762118 1.843502
N 3.053800 1.551890 0.260316
C 0.713414 0.883424 -0.373401
C 1.927562 1.772906 -0.669436
C 0.968257 -0.576777 -0.234244
C -0.520855 1.491739 -0.382862
C 0.247920 -1.433562 0.648068
C -1.879356 0.932073 -0.254535
C -2.236824 -0.106076 0.652755
C 1.995647 -1.178923 -1.020177
C 0.517364 -2.819437 0.715986
C -2.922352 1.499881 -1.045090
C 2.710899 1.829724 1.668120
C 4.284695 2.234351 -0.175671
C -3.564169 -0.580450 0.738525
C 2.273466 -2.557387 -0.954138
C 1.532785 -3.388195 -0.082047
C -4.250357 1.037653 -0.959116
C -4.576372 -0.009361 -0.064979
H 1.583552 2.840037 -0.670780
H 2.304524 1.571585 -1.694307
H -0.513454 2.570756 -0.601967
H 2.585756 -0.549440 -1.691669
H -0.066973 -3.441345 1.401461
H -2.671614 2.310075 -1.740376
H 1.835291 1.228565 1.967635
H 2.469226 2.907020 1.857340
H 3.560378 1.548130 2.315387
H 4.549629 1.914034 -1.200321
H 5.118193 1.958425 0.494650
H 4.201813 3.351940 -0.175341
H -3.799245 -1.385626 1.442047
H 3.068304 -2.982231 -1.576802
H 1.744485 -4.461081 -0.018703
H -5.028489 1.491650 -1.582301
H -5.606686 -0.372946 0.012773


