%chk=000154627.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154627

0 1
 S    2.968000     -0.9641000       1.078900    
 O  -0.7605000      -3.263600      0.1041000    
 O    2.718800       1.949200      -1.445100    
 O    4.301700       1.338100     -5.2299999E-02
 N   -1.772400      -1.226600     -0.4841000    
 N    3.156300       1.164600     -0.5566000    
 C   -1.950900      8.9100003E-02 -5.5500001E-02
 C   0.6480000      -1.415200      0.1401000    
 C  -0.6564000      -2.050500     -7.5000003E-02
 C   -2.829100      -1.873100      -1.325200    
 C    1.100600     -0.2690000     -0.5426000    
 C   -1.481400      0.4843000       1.197100    
 C   -2.599200       1.009200     -0.8795000    
 C    1.539600      -1.907900       1.045600    
 C    2.363000      9.1600001E-02 -0.1259000    
 C   -1.660200       1.799600       1.625600    
 C   -2.777700       2.324600     -0.4511000    
 C   -2.308200       2.719800      0.8015000    
 H   -2.756300      -1.480400      -2.343300    
 H   -3.813100      -1.662300     -0.8961000    
 H   -2.679200      -2.955300      -1.363800    
 H   0.5604000      0.2628000      -1.316100    
 H   -1.015800     -0.2134000       1.887300    
 H   -2.965000      0.7390000      -1.865700    
 H    1.443400      -2.765900       1.696800    
 H   -1.304200       2.105100       2.605200    
 H   -3.279900       3.042000      -1.093500    
 H   -2.448600       3.743500       1.135900    


%chk=000154627-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154627

0 1
S 3.189075 -1.201886 0.847302
O -0.689198 -3.358067 -0.267187
O 2.567905 2.295587 -0.999674
O 4.389645 1.412207 0.084891
N -1.794110 -1.311763 -0.480541
N 3.164456 1.356717 -0.337864
C -1.931522 0.078567 -0.111136
C 0.652869 -1.392467 0.043827
C -0.655220 -2.085953 -0.227273
C -3.021375 -2.009898 -0.935369
C 1.092634 -0.091813 -0.392280
C -1.677130 0.490363 1.221419
C -2.363989 1.026214 -1.072045
C 1.660637 -2.099884 0.704202
C 2.411549 0.160715 -0.046488
C -1.825216 1.848263 1.579128
C -2.522765 2.380112 -0.704068
C -2.247948 2.797092 0.619706
H -3.401904 -1.552728 -1.865101
H -3.807787 -1.952604 -0.161420
H -2.766379 -3.065018 -1.114649
H 0.490648 0.629187 -0.945058
H -1.371384 -0.251301 1.967007
H -2.556831 0.708386 -2.102469
H 1.584677 -3.116811 1.087182
H -1.619193 2.162430 2.607959
H -2.847630 3.110174 -1.453082
H -2.362815 3.849380 0.899784


