%chk=000157072.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157072

0 1
 Cl   2.672200       1.293800       3.104500    
 F    5.106700      -1.262000      -2.184300    
 F    6.296000     -0.8829000     -0.4106000    
 F    4.741000      -2.402500     -0.3694000    
 O    1.237900       2.686500      0.8599000    
 O   -2.338700      -1.028100     -0.7872000    
 O   -2.774700      -4.354700      0.4607000    
 O   -3.118000     -0.6697000       1.349200    
 O   -1.386900      -2.641000       1.136200    
 O   -4.679400       2.917700      -1.174900    
 O   -4.578100      0.7983000     -0.6121000    
 N   -4.053900       1.931800     -0.7194000    
 C   -1.951800       1.064000      0.2007000    
 C  -5.4099999E-02   2.496000      0.4768000    
 C   -2.702100       2.105000     -0.3106000    
 C  -0.6384000       1.235000      0.5968000    
 C   -2.858100      -2.348800     -0.7736000    
 C    2.171500       1.741600      0.4682000    
 C  -0.7937000       3.561500     -3.6400001E-02
 C   -2.117600       3.365900     -0.4301000    
 C   -2.538600     -0.2926000      0.3426000    
 C    4.024200     -0.1354000     -0.3726000    
 C    2.895200       1.036000       1.413400    
 C    2.352600       1.530900     -0.8884000    
 C    3.828700      9.0000004E-02  0.9901000    
 C    3.286500      0.5852000      -1.312000    
 C   -2.527900      -2.999700      -2.105300    
 C   -2.232200      -3.104100      0.3814000    
 C    5.021700      -1.147200     -0.8258000    
 C   -2.290200      -5.170600       1.532100    
 H  -8.6599998E-02  0.3952000       1.010400    
 H   -3.944500      -2.302900     -0.6323000    
 H  -0.3432000       4.545600     -0.1324000    
 H   -2.659400       4.221500     -0.8252000    
 H    1.793500       2.092500      -1.631200    
 H    4.407000     -0.4753000       1.717600    
 H    3.426400      0.4254000      -2.377600    
 H   -2.942000      -4.010200      -2.175800    
 H   -2.922900      -2.401700      -2.933500    
 H   -1.443400      -3.065900      -2.249500    
 H   -2.514700      -4.703000       2.495500    
 H   -1.214200      -5.337300       1.424100    
 H   -2.801500      -6.135500       1.482600    


%chk=000157072-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000157072

0 1
Cl 3.240344 2.536696 2.626115
F 5.328592 -1.939496 -1.462511
F 6.273079 -1.314247 0.509735
F 4.598514 -2.838629 0.481231
O 1.198553 2.579541 0.456170
O -2.760004 -0.891021 -0.943675
O -2.082824 -4.283821 0.236189
O -3.463189 -0.535991 1.259972
O -0.834320 -2.322407 0.386230
O -4.983781 3.588841 -0.610693
O -4.981941 1.306299 -0.628755
N -4.388847 2.449104 -0.497968
C -2.273649 1.221201 0.037978
C -0.181852 2.460496 0.205914
C -2.940338 2.442461 -0.215652
C -0.879292 1.232167 0.252515
C -3.034577 -2.339729 -0.784917
C 2.082931 1.495772 0.305228
C -0.855951 3.683696 -0.025482
C -2.242263 3.671996 -0.237360
C -2.953793 -0.115598 0.202427
C 4.034786 -0.514188 0.013333
C 3.141223 1.385742 1.239347
C 2.021010 0.604044 -0.791222
C 4.116216 0.383981 1.101091
C 2.989569 -0.404988 -0.933206
C -3.182222 -2.928605 -2.191541
C -1.853990 -2.938093 0.004764
C 5.041446 -1.620738 -0.112887
C -1.034397 -5.000069 1.011171
H -0.372042 0.285272 0.462702
H -3.954027 -2.476310 -0.187148
H -0.282693 4.614095 -0.037080
H -2.798979 4.592109 -0.430725
H 1.221272 0.705774 -1.529974
H 4.928850 0.309831 1.828497
H 2.941192 -1.091123 -1.783102
H -3.364942 -4.013525 -2.122981
H -4.034482 -2.451638 -2.702582
H -2.271414 -2.754031 -2.788797
H -0.917035 -4.532885 2.002578
H -0.073832 -4.963968 0.471369
H -1.406600 -6.029718 1.096299


