%chk=000052671.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052671

0 1
 Cl   4.704400      -1.954400      0.3925000    
 O    4.061200       2.289000     -5.8200002E-02
 O    5.342800      0.5299000      0.2597000    
 N   -2.802100      0.6446000     -0.7969000    
 N   -1.695900     -9.1300003E-02 -0.5908000    
 N    4.221100       1.053400      6.9600001E-02
 C   -5.284500     -0.6041000      0.5418000    
 C   -4.244500     -0.4069000       1.640700    
 C   -4.668000      -1.054400     -0.7837000    
 C   -3.497000      0.9263000       1.615500    
 C   -3.897800      2.9500000E-02  -1.537500    
 C   -3.241600       1.561500      0.2478000    
 C  -0.6121000      0.6113000     -0.5126000    
 C   0.6878000     -7.9999998E-04 -0.2926000    
 C    1.831200      0.7954000     -0.2148000    
 C   0.7933000      -1.385500     -0.1590000    
 C    3.078300      0.2074000     -3.5999999E-03
 C    2.040400      -1.973600      5.2200001E-02
 C    3.183000      -1.177200      0.1298000    
 H   -5.970600      -1.395600      0.8692000    
 H   -5.892100      0.2980000      0.4069000    
 H   -4.739900     -0.4936000       2.616300    
 H   -3.517600      -1.228400       1.606700    
 H   -4.017300      -1.921500     -0.6139000    
 H   -5.477500      -1.405400      -1.436400    
 H   -4.060800       1.651600       2.216500    
 H   -2.540900      0.7898000       2.137300    
 H   -3.494900     -0.4114000      -2.458700    
 H   -4.598100      0.8032000      -1.878000    
 H   -4.149000       2.089500     -7.4800000E-02
 H   -2.505400       2.364400      0.3789000    
 H  -0.6167000       1.711200     -0.6332000    
 H    1.720700       1.872300     -0.3221000    
 H  -7.8599997E-02  -2.031900     -0.2146000    
 H    2.104400      -3.054100      0.1543000    


%chk=000052671-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052671

0 1
Cl 4.890372 -2.041396 -0.339438
O 3.681740 1.643971 1.914851
O 5.298901 0.718887 0.602808
N -2.943825 0.422457 -0.954634
N -1.698015 -0.115148 -0.907459
N 4.074851 0.837128 0.981256
C -5.183883 -0.499000 0.878648
C -4.036295 0.113256 1.732066
C -4.683873 -1.314463 -0.342744
C -3.531669 1.510971 1.285661
C -4.007877 -0.472559 -1.453229
C -3.347297 1.662297 -0.255364
C -0.688696 0.508717 -0.308736
C 0.648660 -0.086073 -0.336883
C 1.723972 0.575329 0.306046
C 0.922933 -1.328971 -0.985480
C 3.029064 0.033323 0.297288
C 2.214370 -1.878028 -0.975073
C 3.285907 -1.205527 -0.341630
H -5.775630 -1.180440 1.519964
H -5.885104 0.296675 0.549801
H -4.364629 0.196952 2.786126
H -3.185993 -0.597590 1.730619
H -3.964131 -2.078064 0.013070
H -5.531930 -1.860755 -0.803075
H -4.250821 2.289635 1.607459
H -2.582479 1.725560 1.811904
H -3.551992 -1.134791 -2.208336
H -4.766043 0.156572 -1.958367
H -4.302796 1.969899 -0.714525
H -2.613483 2.461901 -0.479821
H -0.793786 1.472361 0.216527
H 1.573269 1.524876 0.829085
H 0.101690 -1.849797 -1.486106
H 2.410216 -2.839965 -1.457981


