%chk=000040159.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040159

0 1
 Cl  -3.600500       3.229300       1.584800    
 Cl  -3.789900       2.313800      -1.215100    
 O  -0.1609000      -2.074000      0.2463000    
 O   -1.661400      -3.767400     -0.2335000    
 O    3.584300       1.158500     -0.7202000    
 C   -3.599800      -1.371700     -0.3266000    
 C   -2.534800     -0.3513000     -5.0500002E-02
 C   -2.466400      -1.700000      0.5916000    
 C   -3.637800      -1.971900      -1.691800    
 C   -4.951400      -1.219100      0.2880000    
 C   -2.817600      0.8015000      0.7914000    
 C   -1.400800      -2.637400      0.1538000    
 C   -3.344200       1.978000      0.4190000    
 C   0.9248000      -2.901700     -0.1529000    
 C    2.203700      -2.151200      4.1000000E-03
 C    2.296700     -0.8310000     -0.4366000    
 C    3.307400      -2.769700      0.5917000    
 C    3.493100     -0.1294000     -0.2897000    
 C    4.503900      -2.068000      0.7385000    
 C    4.596800     -0.7478000      0.2978000    
 C    2.543400       2.016800     -0.4080000    
 C    2.030100       2.014300      0.8764000    
 C    2.043200       2.853800      -1.389000    
 C   0.9810000       2.878200       1.190500    
 C   0.9941000       3.717800      -1.074900    
 C   0.4630000       3.729900      0.2149000    
 H   -1.818800     -0.1440000     -0.8412000    
 H   -2.698400      -1.781900       1.649600    
 H   -4.311500      -1.400000      -2.339800    
 H   -2.658700      -1.982200      -2.183400    
 H   -4.006500      -3.002500      -1.652300    
 H   -5.553100     -0.4976000     -0.2753000    
 H   -5.483600      -2.177000      0.2792000    
 H   -4.917200     -0.8853000       1.330800    
 H   -2.553100      0.6850000       1.842100    
 H   0.9268000      -3.805900      0.4678000    
 H   0.8057000      -3.192700      -1.203600    
 H    1.440100     -0.3694000     -0.9224000    
 H    3.250400      -3.798100      0.9384000    
 H    5.363400      -2.549600       1.195600    
 H    5.531400     -0.2063000      0.4151000    
 H    2.430800       1.377500       1.659700    
 H    2.455000       2.844700      -2.393600    
 H   0.5693000       2.890600       2.195500    
 H   0.5901000       4.380400      -1.834600    
 H  -0.3540000       4.402300      0.4595000    


%chk=000040159-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000040159

0 1
Cl -4.312671 1.504076 4.217519
Cl -1.478057 1.556848 3.151861
O -0.391312 -2.286734 0.361539
O -1.693510 -4.220475 0.406201
O 3.329163 1.062836 -0.867156
C -3.125678 -0.903471 -0.445988
C -2.626807 -0.560910 0.975841
C -2.785791 -2.054002 0.551395
C -2.190384 -0.591713 -1.611271
C -4.606073 -0.741005 -0.791104
C -3.512991 -0.003886 2.021321
C -1.616595 -2.967857 0.429294
C -3.150834 0.881247 2.978347
C 0.819161 -3.153135 0.233100
C 2.045017 -2.269396 0.311099
C 2.054567 -0.992874 -0.298642
C 3.210284 -2.746371 0.959864
C 3.220967 -0.200015 -0.236325
C 4.380905 -1.953358 0.985005
C 4.393864 -0.673782 0.392858
C 2.204820 1.918722 -1.011696
C 1.205032 2.052654 -0.019326
C 2.193447 2.723144 -2.172104
C 0.174789 3.000823 -0.210541
C 1.160898 3.670440 -2.346009
C 0.145375 3.810354 -1.370475
H -1.584945 -0.229274 1.019300
H -3.659624 -2.588738 0.937648
H -2.325940 0.457443 -1.932986
H -1.132722 -0.729830 -1.337445
H -2.413177 -1.245588 -2.475538
H -4.829837 0.312545 -1.043054
H -4.859944 -1.362261 -1.669351
H -5.276729 -1.043610 0.031846
H -4.561082 -0.329205 2.038529
H 0.803541 -3.909419 1.037068
H 0.746585 -3.687069 -0.733976
H 1.158944 -0.621781 -0.803675
H 3.204009 -3.729577 1.444101
H 5.282081 -2.326860 1.482707
H 5.283180 -0.037291 0.411363
H 1.235857 1.443698 0.889685
H 2.990752 2.599426 -2.911081
H -0.597468 3.109335 0.559113
H 1.150859 4.297768 -3.244132
H -0.653827 4.546426 -1.507629


