%chk=000117599.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117599

0 1
 Cl  -3.284300       3.223100      0.1927000    
 O   0.1421000      -1.563500       1.378700    
 N    1.571000      8.5500002E-02 -0.1648000    
 N   0.4693000       2.160400     -0.5198000    
 N   -1.896000       1.048800      0.4982000    
 N   -2.078100      -1.634100      0.7322000    
 N   -3.523800      -2.933900     -0.6883000    
 N   -1.420300      -2.378400      -1.374100    
 C    3.865800     -0.4842000     -0.5999000    
 C    4.211200      -1.073300      0.7307000    
 C    5.178700     -0.1587000      3.8400002E-02
 C    2.814700      0.5747000     -0.6696000    
 C   0.4066000      0.8831000     -9.3999997E-02
 C  -0.7530000      0.3710000      0.3947000    
 C  -0.8443000      -1.038400      0.8709000    
 C  -0.6716000       2.871900     -0.4278000    
 C   -1.833400       2.326000      7.2099999E-02
 C   -2.354700      -2.280100     -0.3704000    
 H    3.852800      -1.151200      -1.452800    
 H    4.453700      -2.128400      0.7679000    
 H    3.718900     -0.6979000       1.619500    
 H    5.331500      0.8255000      0.4634000    
 H    6.070400     -0.6004000     -0.3902000    
 H    2.704700      0.8900000      -1.714000    
 H    3.123500       1.458300     -9.7199999E-02
 H    1.421100     -0.9181000     -0.1860000    
 H  -0.6110000       3.897600     -0.7726000    
 H   -4.305300      -2.953000     -4.1999999E-02
 H   -3.640100      -3.410900      -1.575600    
 H  -0.4945000      -1.971300      -1.309300    
 H   -1.631600      -2.878900      -2.230900    


%chk=000117599-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000117599

0 1
Cl -3.485341 2.479078 -0.854790
O 0.610036 -2.263297 0.226388
N 1.868085 0.044757 -0.110824
N 0.548895 1.957959 -0.506398
N -1.792735 0.385096 -0.381446
N -1.718551 -2.377913 0.200588
N -4.037761 -2.598506 0.135184
N -2.901935 -2.184859 -1.875281
C 4.310595 -0.113393 -0.251880
C 4.820811 -0.842642 1.003421
C 5.650327 0.290265 0.377555
C 3.119522 0.823682 -0.146695
C 0.634348 0.590053 -0.274252
C -0.582303 -0.214773 -0.210987
C -0.537554 -1.703265 0.051279
C -0.676271 2.502428 -0.679364
C -1.841499 1.696783 -0.616411
C -2.837171 -2.344073 -0.495758
H 4.362988 -0.674541 -1.192215
H 5.178076 -1.870350 0.896070
H 4.311843 -0.639472 1.951014
H 5.697625 1.244085 0.912713
H 6.569732 0.028129 -0.152950
H 3.083602 1.525147 -1.000536
H 3.201575 1.448954 0.766907
H 1.860853 -0.974799 0.095120
H -0.731836 3.579837 -0.861726
H -4.027930 -2.658708 1.149738
H -4.871482 -2.876342 -0.375500
H -2.032190 -2.035867 -2.381052
H -3.760357 -1.862255 -2.317813


