%chk=000150172.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150172

0 1
 S    1.369600     -0.7355000      8.2300000E-02
 N    5.744600      0.2841000     -0.8762000    
 N   -1.636400      0.1404000      0.5388000    
 N    4.672900      -1.643700     -0.6171000    
 N   -3.122000       1.850500     -0.2787000    
 N   -3.848500     -0.4193000     -1.9300001E-02
 N   -1.244700       3.490200     -5.4299999E-02
 C    4.102200     -0.6650000      0.1378000    
 C    2.914700     -0.9873000      0.9845000    
 C   0.2150000      -1.215800       1.403800    
 C   -1.236800      -1.188500      0.9426000    
 C    4.732100      0.5346000      6.6000000E-03
 C    4.508400       1.863700      0.5963000    
 C    5.669000      -1.036200      -1.222900    
 C   -2.904200      0.4657000      8.1900001E-02
 C   -5.160600     -2.3100000E-02 -0.5051000    
 C   -2.112000       2.726100     -0.1566000    
 C   -5.989000      -1.227500     -0.5162000    
 C   -6.674200      -2.213400     -0.5281000    
 H    2.974800      -2.032300       1.307500    
 H    2.915900     -0.3599000       1.882200    
 H   0.3517000     -0.5317000       2.248500    
 H   0.4653000      -2.228000       1.738100    
 H   -1.874200      -1.521700       1.769900    
 H   -1.383000      -1.892000      0.1141000    
 H    6.427100      0.9502000      -1.213400    
 H  -0.9190000      0.8564000      0.5965000    
 H    4.665200       1.832900       1.679300    
 H    5.187500       2.614700      0.1794000    
 H    3.483600       2.200200      0.4095000    
 H    6.364300      -1.488900      -1.915300    
 H   -4.035000       2.134300     -0.6164000    
 H   -5.614700      0.7249000      0.1545000    
 H   -5.098300      0.3834000      -1.520800    
 H   -7.281800      -3.087900     -0.5385000    


%chk=000150172-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000150172

0 1
S 1.682194 -1.539628 -0.817175
N 5.439120 1.042187 0.273946
N -1.302017 -0.692946 -0.387457
N 5.105393 -1.168830 0.567533
N -2.513118 1.297351 0.044609
N -3.645164 -0.819437 -0.426919
N -0.333043 2.595000 0.268797
C 3.868432 -0.488134 0.629350
C 2.600458 -1.237806 0.855282
C 0.226925 -2.609843 -0.197302
C -1.112565 -2.099713 -0.754839
C 4.053596 0.893778 0.446061
C 3.100173 2.051292 0.402521
C 6.029162 -0.217731 0.355507
C -2.547615 -0.118487 -0.274700
C -4.997916 -0.228270 -0.392505
C -1.375510 2.005420 0.174841
C -5.311727 0.742283 0.690941
C -5.555532 1.546212 1.596911
H 2.830063 -2.229475 1.273685
H 1.894820 -0.698129 1.507749
H 0.231574 -2.553645 0.904976
H 0.407134 -3.649915 -0.512768
H -1.953685 -2.681175 -0.337468
H -1.146868 -2.228374 -1.856702
H 5.920159 1.927718 0.118466
H -0.448795 -0.119827 -0.403028
H 3.346180 2.820952 1.158928
H 3.093002 2.545159 -0.587676
H 2.067153 1.724525 0.593488
H 7.099903 -0.382600 0.261750
H -3.401422 1.704083 0.369009
H -5.222744 0.261703 -1.365369
H -5.711554 -1.067747 -0.300811
H -5.786668 2.228648 2.395568


