%chk=000059435.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059435

0 1
 Cl   6.413200      -1.879900      0.2703000    
 N    1.668600     -0.2357000      -1.168400    
 N   -1.465300      0.4903000     -0.4919000    
 N    1.610000       1.500100      0.2184000    
 C  -0.3839000       1.149500      -1.238900    
 C   0.9562000      0.8366000     -0.7087000    
 C    2.861800     -0.2662000     -0.4932000    
 C    2.800900      0.8271000      0.3664000    
 C   -2.757300      0.8434000      -1.052100    
 C   -3.889000      0.1776000     -0.3152000    
 C    3.955600      -1.130000     -0.5586000    
 C    3.886900       1.089400       1.218600    
 C    5.027600     -0.8539000      0.2967000    
 C    4.995900      0.2355000       1.170200    
 C   -4.335100      -1.069300     -0.7307000    
 C   -4.469900      0.8198000      0.7695000    
 C   -5.383300      -1.686300     -4.8099998E-02
 C   -5.518000      0.2026000       1.452200    
 C   -5.974700      -1.050500       1.043400    
 H  -0.5228000       2.237000      -1.193000    
 H  -0.4342000      0.8664000      -2.298300    
 H   -2.810500      0.5641000      -2.112900    
 H   -2.905200       1.930900      -1.017400    
 H    1.371500     -0.8918000      -1.878600    
 H   -1.336400     -0.5205000     -0.5489000    
 H    3.965800      -1.972300      -1.242100    
 H    3.871700       1.933400       1.900800    
 H    5.837400      0.4375000       1.829500    
 H   -3.880100      -1.574200      -1.578200    
 H   -4.120800       1.794900       1.097400    
 H   -5.738600      -2.662200     -0.3659000    
 H   -5.978400      0.6973000       2.302400    
 H   -6.790700      -1.531000       1.575200    


%chk=000059435-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059435

0 1
Cl 6.342068 -1.901116 1.024479
N 1.612228 -0.387552 -0.963017
N -1.463348 0.449778 -0.747350
N 1.706177 1.743544 -0.151478
C -0.368328 1.137241 -1.470997
C 0.974014 0.865738 -0.854602
C 2.831731 -0.304797 -0.279689
C 2.875675 1.042511 0.222379
C -2.813234 0.727482 -1.285672
C -3.898964 0.066593 -0.444483
C 3.867364 -1.235697 -0.058794
C 3.992369 1.476989 0.970991
C 4.956115 -0.756776 0.690948
C 5.040954 0.563916 1.204883
C -5.023537 -0.533753 -1.063148
C -3.812082 0.067625 0.971573
C -6.050708 -1.114303 -0.283687
C -4.834490 -0.516623 1.751328
C -5.958769 -1.107548 1.127074
H -0.535894 2.226115 -1.404080
H -0.338670 0.875692 -2.561077
H -2.934177 0.415849 -2.353820
H -2.945682 1.829569 -1.269857
H 1.261935 -1.196867 -1.473041
H -1.298730 -0.557782 -0.620691
H 3.844483 -2.262036 -0.434077
H 4.036283 2.498590 1.358641
H 5.921440 0.862707 1.780015
H -5.097411 -0.546620 -2.158085
H -2.934924 0.523865 1.442842
H -6.915822 -1.573872 -0.775136
H -4.756945 -0.509327 2.844603
H -6.752224 -1.559534 1.732926


