%chk=000094337.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094337

0 1
 Cl  -7.111400     -0.2747000     -1.4200000E-02
 N    5.329800      0.1737000     -1.8999999E-02
 C    3.930400     -2.0000001E-03 -4.9999999E-03
 C    1.162400     -0.3490000      2.5699999E-02
 C    3.094500       1.018300     -0.4590000    
 C    3.382200      -1.195700      0.4645000    
 C    1.710600      0.8448000     -0.4435000    
 C    1.998300      -1.369300      0.4797000    
 C  -0.2807000     -0.5294000      4.1200001E-02
 C    5.905100       1.494700      0.1384000    
 C    6.211000     -0.9662000     -0.1769000    
 C   -2.655100      0.2864000     -1.9000000E-03
 C   -1.193000      0.4704000      1.9000000E-03
 C   -3.183600     -0.9377000     -0.3784000    
 C   -3.472500       1.340800      0.3710000    
 C   -4.567600      -1.112000     -0.3823000    
 C   -4.856400       1.166600      0.3673000    
 C   -5.404000     -5.9799999E-02 -9.4999997E-03
 H    3.490300       1.953000     -0.8462000    
 H    4.003900      -2.004900      0.8368000    
 H    1.102200       1.657100     -0.8301000    
 H    1.589300      -2.305200      0.8530000    
 H  -0.6015000      -1.565400      0.1084000    
 H    5.389800       2.066400      0.9185000    
 H    6.958000       1.434500      0.4361000    
 H    5.861200       2.051800     -0.8033000    
 H    5.838400      -1.659300     -0.9396000    
 H    7.209700     -0.6514000     -0.4998000    
 H    6.325500      -1.502600      0.7709000    
 H  -0.8768000       1.510000     -1.2300000E-02
 H   -2.572900      -1.776100     -0.6978000    
 H   -3.061500       2.301900      0.6683000    
 H   -4.981000      -2.071500     -0.6829000    
 H   -5.496100       1.995200      0.6606000    


%chk=000094337-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094337

0 1
Cl -7.350759 -0.289045 0.007785
N 5.440785 0.167579 -0.008146
C 4.051317 0.019904 -0.005782
C 1.167737 -0.277052 -0.002233
C 3.180411 1.160683 -0.011774
C 3.437654 -1.274056 0.002112
C 1.787407 1.008621 -0.010090
C 2.040352 -1.404358 0.003547
C -0.281184 -0.488975 -0.000214
C 6.040493 1.507765 -0.017210
C 6.304124 -1.019833 0.001052
C -2.714641 0.242294 0.002657
C -1.263768 0.471250 0.000412
C -3.312927 -1.055041 0.011234
C -3.591559 1.368089 -0.003588
C -4.710994 -1.220733 0.012754
C -4.993829 1.221212 -0.002169
C -5.537114 -0.077397 0.005885
H 3.599163 2.171044 -0.018177
H 4.052863 -2.178022 0.007246
H 1.166327 1.911682 -0.015616
H 1.604018 -2.411720 0.009603
H -0.585960 -1.546276 0.001269
H 5.750539 2.096253 0.877146
H 7.138130 1.418252 -0.020703
H 5.744363 2.086350 -0.916077
H 6.136598 -1.657183 -0.891037
H 7.359813 -0.706577 -0.000554
H 6.135356 -1.644164 0.902210
H -0.965090 1.529279 -0.000731
H -2.682638 -1.950515 0.017485
H -3.164195 2.378177 -0.009980
H -5.154737 -2.220888 0.019456
H -5.649553 2.096800 -0.007172


