%chk=000001857.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001857

0 1
 Cl  -3.440100       1.044700       2.630800    
 S   -1.351000      -2.425400     -0.7041000    
 O    3.691400       1.558400     -0.6154000    
 N    1.665300      -1.439800      -1.033000    
 N   -2.033700      4.2100001E-02  -1.462600    
 N   -2.422200     -0.5330000      0.8452000    
 N   -2.601400       2.214800      -2.254000    
 C   5.9900001E-02  -2.446300      0.4704000    
 C    1.045100      -1.363400      0.1707000    
 C    2.189700      0.6120000      0.7840000    
 C    1.255300     -0.3728000       1.124800    
 C    2.820400      0.5251000     -0.4523000    
 C   0.6587000      -3.862300      0.4807000    
 C    2.569700     -0.4869000      -1.362600    
 C    2.718400       1.775000       1.402900    
 C    3.622600       2.310600      0.5145000    
 C   -2.008400     -0.7920000     -0.4080000    
 C   -2.535100       1.267500      -1.203200    
 C   -2.993000       1.661500      3.7500001E-02
 C   -2.911600      0.7101000       1.033700    
 H  -0.3689000      -2.290000       1.468200    
 H   0.7332000     -0.3546000       2.074400    
 H    1.065800      -4.142400     -0.4979000    
 H    1.481900      -3.920000       1.202200    
 H  -8.7600000E-02  -4.610100      0.7716000    
 H    3.053400     -0.5645000      -2.326300    
 H    2.470800       2.173800       2.376500    
 H    4.264900       3.178700      0.5361000    
 H   -3.391900       2.652500      0.2201000    
 H   -2.257800       1.921000      -3.160000    
 H   -2.554700       3.198800      -2.019800    


%chk=000001857-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001857

0 1
Cl -2.421397 1.738721 2.519721
S -0.916709 -1.741232 -1.406293
O 4.845372 0.991459 0.180964
N 2.416461 -1.714066 -0.657266
N -2.802055 0.130804 -1.746504
N -1.797888 0.083289 0.466259
N -4.475856 1.657062 -2.300748
C 0.137883 -2.139460 0.170040
C 1.397471 -1.292697 0.174461
C 2.692636 0.594327 0.964564
C 1.487465 -0.149475 1.003244
C 3.724762 0.137329 0.094612
C 0.403740 -3.652146 0.160068
C 3.576112 -1.007682 -0.704586
C 3.208913 1.788457 1.614634
C 4.482669 1.986243 1.122330
C -1.938099 -0.364942 -0.822965
C -3.605815 1.170884 -1.354906
C -3.534561 1.717946 -0.029950
C -2.597915 1.106553 0.809686
H -0.520134 -1.839929 1.000612
H 0.636682 0.140825 1.625233
H 1.029305 -3.933505 -0.702606
H 0.955038 -3.931201 1.077210
H -0.543022 -4.218019 0.132581
H 4.364045 -1.364181 -1.375623
H 2.699366 2.412349 2.345748
H 5.245859 2.737519 1.308736
H -4.158765 2.549637 0.299118
H -4.471253 1.223935 -3.222510
H -5.111212 2.424296 -2.100765


