%chk=000086224.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086224

0 1
 Cl   5.237900      0.9943000      0.2405000    
 O   -1.181100      0.7571000      -1.588900    
 N  -0.5823000      -1.719700      0.2056000    
 N  -0.5615000      -2.200500      -1.034400    
 N   0.6661000      -3.474300      0.4158000    
 C  -0.7842000      0.7912000     -0.2146000    
 C   -1.347700     -0.4834000      0.5107000    
 C   -1.373000       2.086100      0.4115000    
 C   -2.851600     -0.7670000      0.3231000    
 C   -2.748100       2.551000     -7.1199998E-02
 C   -3.786600      0.3531000      0.7752000    
 C   -3.845100       1.504400     -0.2189000    
 C   0.7528000      0.8439000     -9.8499998E-02
 C    1.344600      0.9307000       1.156000    
 C    1.530500      0.8035000      -1.249400    
 C   0.1377000      -2.463700       1.066200    
 C    2.734700      0.9779000       1.261100    
 C    2.920700      0.8504000      -1.144300    
 C   0.2132000      -3.272700     -0.8565000    
 C    3.522800      0.9378000      0.1110000    
 H   -1.191800     -0.3491000       1.591500    
 H  -0.6922000       2.925400      0.2061000    
 H   -1.388900       1.997500       1.506000    
 H   -3.104400      -1.662200      0.9085000    
 H   -3.067100      -1.031900     -0.7200000    
 H   -2.636100       3.066100      -1.034100    
 H   -3.096400       3.322100      0.6288000    
 H   -3.531000      0.7033000       1.781500    
 H   -4.795200     -7.4900001E-02  0.8445000    
 H   -3.844300       1.112300      -1.243400    
 H   -4.809200       2.017300     -0.1066000    
 H   -1.063000     -0.1486000      -1.921600    
 H   0.7502000      0.9637000       2.064300    
 H    1.099100      0.7358000      -2.242900    
 H   0.2516000      -2.247900       2.119200    
 H    3.190100       1.045500       2.245700    
 H    3.522600      0.8178000      -2.048900    
 H   0.4563000      -3.927000      -1.680300    


%chk=000086224-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086224

0 1
Cl 5.372332 1.234123 0.358737
O -1.162479 0.561517 -1.612658
N -0.620006 -1.716439 0.230501
N -0.539608 -2.059919 -1.126056
N 0.468048 -3.679181 0.177847
C -0.780190 0.736125 -0.211488
C -1.334331 -0.474837 0.633956
C -1.375101 2.091732 0.278932
C -2.857681 -0.740428 0.530121
C -2.743250 2.518494 -0.302112
C -3.788817 0.433649 0.913854
C -3.914609 1.501721 -0.199067
C 0.760669 0.811128 -0.057741
C 1.373006 0.873641 1.221501
C 1.585903 0.894029 -1.204402
C -0.016557 -2.696607 0.980699
C 2.772353 1.002065 1.358765
C 2.988394 1.020969 -1.088564
C 0.127707 -3.246022 -1.094904
C 3.561749 1.070419 0.195048
H -1.069040 -0.305099 1.694449
H -0.648032 2.883947 0.019932
H -1.413046 2.069182 1.386784
H -3.072079 -1.609939 1.183414
H -3.088170 -1.053042 -0.505392
H -2.598300 2.777524 -1.365485
H -3.020457 3.456979 0.219587
H -3.470016 0.892791 1.872251
H -4.792292 0.004212 1.101925
H -4.008935 0.967224 -1.163070
H -4.858534 2.063420 -0.056754
H -0.960008 -0.400901 -1.845645
H 0.766485 0.839629 2.134983
H 1.116487 0.871413 -2.192089
H 0.060967 -2.667432 2.064010
H 3.237234 1.049744 2.347858
H 3.619822 1.081969 -1.979791
H 0.370480 -3.792504 -2.001636


