%chk=000031855.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031855

0 1
 Cl  -6.245200      -1.478900       1.462500    
 O   -1.849800       2.574400      -1.412300    
 O    4.978200       2.624200       1.273900    
 O    2.939300       2.019400       2.072700    
 N  -0.2505000       1.165100     -0.6511000    
 N    2.532800      -3.647200     -0.1684000    
 C    1.642600     -4.6300001E-02 -0.4049000    
 C    1.981000       1.326900     -0.4260000    
 C   0.2504000     -0.1368000     -0.5417000    
 C   0.8170000       2.039300     -0.5691000    
 C    2.407000      -1.225100     -0.2783000    
 C    3.341900       1.893100     -0.3098000    
 C  -0.3887000      -1.391500     -0.5643000    
 C    1.769200      -2.467000     -0.2952000    
 C   0.6812000       3.513900     -0.6355000    
 C   -1.602300       1.550700     -0.7835000    
 C   0.3899000      -2.546500     -0.4375000    
 C   -2.747600      0.8024000     -0.2301000    
 C    3.710400       2.162500       1.132300    
 C    1.886400      -4.943800     -0.1858000    
 C    3.973800      -3.576900     -3.3399999E-02
 C   -2.588700      5.3500000E-02  0.9330000    
 C   -3.982200      0.8502000     -0.8726000    
 C   -3.671300     -0.6525000       1.457100    
 C   -5.065100      0.1442000     -0.3484000    
 C   -4.909700     -0.6072000      0.8165000    
 H    3.481300      -1.123500     -0.1687000    
 H    3.431400       2.828500     -0.8719000    
 H    4.078900       1.194000     -0.7211000    
 H   -1.449500      -1.503300     -0.7519000    
 H    1.583400       4.028400     -0.2913000    
 H   0.4889000       3.837100      -1.663600    
 H  -0.1337000       3.866500      5.4000001E-03
 H  -0.1400000      -3.494200     -0.4749000    
 H    1.172400      -5.042400      0.6394000    
 H    2.610100      -5.758200     -6.8000004E-02
 H    1.374400      -5.118400      -1.138600    
 H    4.421200      -4.573700      5.0400000E-02
 H    4.261000      -3.031000      0.8722000    
 H    4.431700      -3.104000     -0.9094000    
 H   -1.654700      4.1800000E-02   1.487400    
 H   -4.122300       1.424900      -1.784200    
 H   -3.538900      -1.224400       2.372000    
 H   -6.023700      0.1874000     -0.8592000    
 H    5.196300       2.813200       2.211400    


%chk=000031855-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000031855

0 1
Cl -6.338650 -1.356912 1.745331
O -1.944080 2.569294 -1.653058
O 4.553409 1.057057 1.535847
O 3.460506 3.073777 1.903125
N -0.322151 1.193223 -0.670053
N 2.651935 -3.595751 -0.152114
C 1.632777 -0.003622 -0.388361
C 1.950583 1.418110 -0.450196
C 0.217967 -0.131945 -0.537747
C 0.767858 2.126575 -0.635023
C 2.456146 -1.141977 -0.254347
C 3.339868 2.006004 -0.333087
C -0.373963 -1.406622 -0.628910
C 1.867689 -2.441754 -0.297642
C 0.560014 3.611835 -0.705850
C -1.670352 1.560041 -0.938351
C 0.447363 -2.543691 -0.504499
C -2.760518 0.760044 -0.290556
C 3.763683 2.145207 1.124386
C 2.039433 -4.923963 -0.256272
C 4.102211 -3.471329 0.023438
C -2.611539 0.183038 0.998195
C -4.021244 0.701388 -0.939147
C -3.700527 -0.456397 1.625949
C -5.113374 0.049308 -0.332226
C -4.932806 -0.520777 0.944766
H 3.532101 -1.011267 -0.116605
H 3.373584 3.012034 -0.782619
H 4.068314 1.364415 -0.857175
H -1.445870 -1.540233 -0.792850
H 1.486046 4.131935 -0.411995
H 0.257220 3.936062 -1.715990
H -0.240472 3.943075 -0.020171
H -0.024980 -3.526899 -0.573500
H 1.252711 -5.075279 0.511027
H 2.810554 -5.695315 -0.101547
H 1.580144 -5.097640 -1.252232
H 4.543606 -4.471680 0.157732
H 4.354361 -2.865687 0.917692
H 4.591425 -2.996301 -0.853413
H -1.649628 0.239955 1.516404
H -4.134727 1.183332 -1.915336
H -3.594889 -0.892298 2.623156
H -6.083466 -0.008396 -0.833664
H 4.769929 1.158827 2.502987


