%chk=000156368.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156368

0 1
 S    1.847300      0.3919000      0.6126000    
 S    5.139600      0.3582000       1.614300    
 P    3.846900      0.2933000     -4.9199998E-02
 O    4.086300      -1.085600     -0.8795000    
 O  -0.9067000      -1.862500     -0.3996000    
 O    4.125100       1.488500     -0.9274000    
 N  -0.5837000      0.4349000     -0.5452000    
 N   -1.092700       1.701600     -0.4602000    
 N   -2.292200       1.917900     -0.1843000    
 C   -2.738600     -0.4794000     -1.0200000E-02
 C   0.8299000      0.3706000     -0.8750000    
 C   -1.331500     -0.7129000     -0.3345000    
 C   -3.156300      0.8432000      4.9600001E-02
 C   -3.622600      -1.536200      0.2289000    
 C   -4.496500       1.106300      0.3575000    
 C   -4.953400      -1.259800      0.5344000    
 C   -5.391200      6.1299998E-02  0.5989000    
 C    6.805200      0.3099000      0.9238000    
 C    3.884700      -2.341000     -0.2549000    
 H    1.033100     -0.5552000      -1.422200    
 H    1.092400       1.214700      -1.521100    
 H   -3.293900      -2.570400      0.1818000    
 H   -4.853700       2.132100      0.4119000    
 H   -5.648700      -2.072700      0.7221000    
 H   -6.428200      0.2793000      0.8369000    
 H    6.964100       1.172200      0.2716000    
 H    6.942000     -0.6067000      0.3446000    
 H    7.541100      0.3339000       1.731300    
 H    2.848000      -2.441200      7.4299999E-02
 H    4.560600      -2.457700      0.5951000    
 H    4.098300      -3.128200     -0.9825000    


%chk=000156368-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156368

0 1
S 2.023723 1.096638 0.514962
S 5.028983 -0.377781 1.651006
P 3.963043 0.154597 -0.332325
O 3.442622 -1.304294 -1.118983
O -0.268297 -1.532336 -0.379677
O 4.843985 1.031992 -1.326763
N -0.464419 0.786551 -0.685806
N -1.187429 2.038897 -0.667569
N -2.442030 2.027384 -0.320532
C -2.413598 -0.446002 0.029799
C 0.929026 0.945026 -1.067585
C -0.989315 -0.493962 -0.343427
C -3.090197 0.812751 0.034494
C -3.116124 -1.623677 0.385623
C -4.460746 0.887719 0.397173
C -4.474560 -1.542913 0.741887
C -5.145953 -0.287306 0.748649
C 6.758090 0.192709 1.120600
C 2.883871 -2.421961 -0.314016
H 1.277038 0.059553 -1.619787
H 1.029866 1.875218 -1.639422
H -2.579322 -2.577249 0.374599
H -4.947821 1.867177 0.391441
H -5.020952 -2.451078 1.016654
H -6.203047 -0.238688 1.029357
H 6.662854 0.840703 0.232274
H 7.374717 -0.686513 0.889081
H 7.174838 0.764267 1.962588
H 1.885888 -2.155974 0.070733
H 3.579578 -2.690543 0.501793
H 2.800387 -3.250604 -1.033019


