%chk=000040595.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040595

0 1
 Cl   3.950500      -1.866800       1.617600    
 Cl   5.260900     -0.4618000     -0.9874000    
 O  -0.6832000       2.159900      0.3164000    
 N   -2.210000     -0.8419000      0.7400000    
 N   -1.433100     -0.1681000      -1.291600    
 C   -3.052700      -1.619400     -0.1330000    
 C   -2.527300      -1.166600      -1.520700    
 C   -1.352600     -7.4900001E-02  1.0900000E-02
 C   -2.822300      -3.107400      0.1120000    
 C   -4.514200      -1.238400      8.0300003E-02
 C  -0.3666000      0.8258000      0.6793000    
 C    1.047000      0.4934000      0.2747000    
 C    1.773900     -0.4184000       1.025500    
 C    1.597200       1.103200     -0.8429000    
 C   -2.013000       2.502700      0.6863000    
 C    3.081300     -0.7274000      0.6500000    
 C    2.904400      0.7942000      -1.218300    
 C   -2.286800       3.933000      0.2728000    
 C    3.646500     -0.1212000     -0.4719000    
 H   -2.120200      -2.003500      -2.099000    
 H   -3.311100     -0.6931000      -2.122300    
 H   -2.266100     -0.8761000       1.750900    
 H   -3.112400      -3.389100       1.130700    
 H   -3.405300      -3.716200     -0.5874000    
 H   -1.765700      -3.373600     -8.1000002E-03
 H   -4.840100      -1.479200       1.098700    
 H   -4.672700     -0.1632000     -6.3400000E-02
 H   -5.166200      -1.772000     -0.6196000    
 H  -0.4562000      0.7387000       1.770100    
 H    1.325900     -0.8889000       1.897400    
 H    1.036100       1.810900      -1.446200    
 H   -2.754600       1.874400      0.1842000    
 H   -2.134700       2.404000       1.771000    
 H    3.328500       1.274300      -2.096800    
 H   -3.301400       4.233500      0.5490000    
 H   -1.574900       4.614900      0.7497000    
 H   -2.165200       4.051700     -0.8090000    


%chk=000040595-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000040595

0 1
Cl 3.674500 -1.390808 2.559113
Cl 4.864633 -1.322999 -0.514841
O -0.663475 2.435175 0.208325
N -2.095959 -1.020070 0.720924
N -2.410142 0.463620 -1.017731
C -2.952078 -1.826918 -0.210554
C -3.352517 -0.688849 -1.230974
C -1.754771 0.186248 0.090693
C -2.101917 -2.925116 -0.898670
C -4.166570 -2.432818 0.519394
C -0.677908 1.074207 0.725121
C 0.703819 0.488771 0.445253
C 1.467036 -0.094559 1.479319
C 1.220553 0.521899 -0.873744
C -1.896760 3.207613 0.485194
C 2.732654 -0.651934 1.196931
C 2.487049 -0.027150 -1.151573
C -1.633374 4.635415 0.010796
C 3.243428 -0.620298 -0.115991
H -3.291620 -1.033659 -2.278530
H -4.388276 -0.340857 -1.048093
H -1.473158 -1.484068 1.386130
H -1.713192 -3.653837 -0.162126
H -2.711316 -3.481636 -1.634460
H -1.243699 -2.475465 -1.430405
H -3.854707 -3.196552 1.256512
H -4.729216 -1.647079 1.052388
H -4.845048 -2.922292 -0.203611
H -0.864051 1.080166 1.825242
H 1.100083 -0.103875 2.511356
H 0.628074 0.987000 -1.666806
H -2.740623 2.746280 -0.061236
H -2.108538 3.179075 1.577806
H 2.899281 -0.003038 -2.164616
H -2.524940 5.265927 0.183275
H -0.777745 5.078604 0.549072
H -1.405911 4.641274 -1.068985


