%chk=000117068.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117068

0 1
 Cl  -5.696800      0.7977000     -0.1026000    
 N    1.713300       1.516700     -0.1277000    
 N    2.044000      -1.230000      0.1233000    
 N  -0.6407000       1.234500     -0.1147000    
 N  -0.3093000      -1.513000      0.1334000    
 C   0.5810000      0.6746000     -5.7700001E-02
 C   0.7444000     -0.6796000      6.4499997E-02
 C   -1.707200      0.4185000     -4.7600001E-02
 C   -1.539400     -0.9728000      7.8199998E-02
 C   -2.996400      0.9431000     -0.1021000    
 C   -2.667000      -1.787900      0.1449000    
 C    1.615500       2.936500     -0.2555000    
 C    2.286100      -2.632600      0.2504000    
 C   -4.118100      0.1187000     -3.4499999E-02
 C   -3.952700      -1.252700      8.9699998E-02
 C    2.993900       3.512800     -0.3054000    
 C    3.762200      -2.866500      0.2871000    
 C    3.465200       4.399300      0.5789000    
 C    4.421700      -3.617300     -0.6025000    
 H    2.548400       1.146500      0.3164000    
 H    2.763800     -0.6733000     -0.3281000    
 H   -3.125200       2.020300     -0.1992000    
 H   -2.551500      -2.865600      0.2423000    
 H    1.093600       3.202500      -1.182100    
 H    1.045600       3.358100      0.5812000    
 H    1.850500      -3.013400       1.181500    
 H    1.824500      -3.177900     -0.5815000    
 H   -4.809500      -1.918600      0.1449000    
 H    3.641200       3.200500      -1.121400    
 H    4.324700      -2.409000       1.097500    
 H    4.473600       4.787100      0.4834000    
 H    2.860800       4.751500       1.407400    
 H    5.493900      -3.755300     -0.5168000    
 H    3.910000      -4.103400      -1.425700    


%chk=000117068-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117068

0 1
Cl -5.829774 0.816002 -0.100057
N 1.713365 1.542627 0.106143
N 2.054419 -1.252575 -0.060341
N -0.632579 1.288532 -0.004052
N -0.286949 -1.564214 0.037654
C 0.585408 0.731018 0.040153
C 0.763023 -0.733217 -0.001936
C -1.734263 0.434866 -0.024540
C -1.561261 -0.998147 0.053517
C -3.046820 0.987312 -0.076577
C -2.709343 -1.839413 0.097497
C 1.608577 3.016703 0.133921
C 2.295188 -2.711048 -0.085905
C -4.140437 0.120683 -0.037836
C -3.998985 -1.290456 0.052578
C 2.863178 3.650952 -0.425090
C 3.692006 -3.027633 0.400860
C 3.628110 4.550159 0.243208
C 4.608474 -3.728899 -0.312312
H 2.561451 1.140988 0.512204
H 2.776052 -0.671029 -0.492982
H -3.164016 2.072255 -0.134810
H -2.558763 -2.921598 0.155662
H 0.721235 3.278194 -0.470670
H 1.409554 3.384478 1.161792
H 1.529376 -3.167523 0.567227
H 2.130009 -3.126874 -1.101476
H -4.885452 -1.929835 0.082293
H 3.132125 3.351254 -1.448608
H 3.938862 -2.663052 1.408727
H 4.513798 5.004194 -0.214470
H 3.381541 4.866706 1.264642
H 5.600031 -3.957912 0.093251
H 4.386959 -4.103499 -1.319769


