%chk=000089060.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089060

0 1
 Cl   5.898500     -0.3497000     -3.1000001E-03
 O  -0.3222000       2.673600       1.125500    
 N   -2.142500      0.1692000      1.4200000E-02
 N  -0.7794000      -1.603900     -2.2500001E-02
 N  -0.3419000       2.722800      -1.167000    
 C  -0.8633000      0.6629000      2.4900001E-02
 C  -4.7600001E-02 -0.4438000      1.6000000E-03
 C   -2.039400      -1.219000     -1.4900000E-02
 C    1.384200     -0.4220000      3.9999999E-04
 C   -3.355900      0.8516000      2.8100001E-02
 C   -3.258200      -1.958800     -3.0400001E-02
 C  -0.5070000       2.049000      5.2000001E-02
 C   -4.499500      0.1477000      1.3000000E-02
 C    2.087000     -0.4359000       1.207500    
 C    2.084300     -0.3857000      -1.207900    
 C   -4.435700      -1.304700     -1.7100001E-02
 C    3.481600     -0.4132000       1.206500    
 C    3.479000     -0.3632000      -1.209000    
 C    4.177800     -0.3770000     -1.8000000E-03
 H   -3.339300       1.934300      5.0999999E-02
 H   -3.223100      -3.042300     -5.2900001E-02
 H    1.559800     -0.4639000       2.158400    
 H    1.555000     -0.3741000      -2.158000    
 H   -5.469000      0.6307000      2.2900000E-02
 H   -5.373200      -1.850200     -2.8600000E-02
 H    4.012900     -0.4243000       2.154800    
 H    4.008200     -0.3349000      -2.158100    
 H  -0.4723000       2.257200      -2.059500    
 H  -8.3499998E-02   3.703600      -1.189900    


%chk=000089060-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089060

0 1
Cl 6.011580 -0.550523 -0.278752
O -1.820429 2.990748 0.699459
N -2.292384 0.205865 0.050760
N -0.785666 -1.459339 -0.441464
N 0.340304 2.828837 -0.109910
C -1.005746 0.795676 0.096286
C -0.104296 -0.275222 -0.191480
C -2.110900 -1.169277 -0.294780
C 1.375150 -0.292616 -0.208220
C -3.556996 0.745674 0.262495
C -3.250421 -2.004435 -0.429300
C -0.864417 2.259117 0.264812
C -4.666989 -0.079580 0.124437
C 2.155325 0.428421 0.737247
C 2.040929 -1.122510 -1.150852
C -4.521538 -1.462616 -0.222544
C 3.565343 0.353113 0.721782
C 3.447987 -1.203997 -1.181136
C 4.191234 -0.455590 -0.246552
H -3.580196 1.800186 0.541111
H -3.091116 -3.052770 -0.691454
H 1.663865 1.022429 1.514494
H 1.439073 -1.710485 -1.850199
H -5.657326 0.349769 0.295861
H -5.410125 -2.093573 -0.320250
H 4.161297 0.898770 1.458810
H 3.955910 -1.838591 -1.912780
H 1.112472 2.291043 -0.501523
H 0.433376 3.837475 0.003740


