%chk=000036957.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036957

0 1
 Cl  -2.278600      -2.868700     -7.3799998E-02
 Cl  -3.736400       1.756500     -0.4401000    
 F   -3.922600     -0.9048000     -0.1091000    
 F   -2.715500      -1.047000       1.662200    
 F   -1.261500       2.198900     -0.6430000    
 F   -1.898200       1.589600       1.335400    
 O   -1.718600     -0.3273000      -1.715300    
 O   0.8074000      0.2542000      -1.986200    
 C  -0.1547000     -0.4130000      0.1627000    
 C   -1.654300     -0.1439000     -0.2946000    
 C   0.9452000      0.4366000     -0.5681000    
 C   4.4399999E-02 -0.3438000       1.691600    
 C   -2.657200      -1.175800      0.3098000    
 C   -2.067700       1.328400      1.2600000E-02
 C    2.395700      0.1779000     -0.2128000    
 C    2.975300      0.8969000      0.8166000    
 C    3.104800     -0.7708000     -0.9266000    
 C    4.310400      0.6589000       1.143300    
 C    4.439800      -1.008700     -0.5998000    
 C    5.042600     -0.2940000      0.4351000    
 H   6.7299999E-02  -1.449800     -0.1267000    
 H   0.7672000       1.500800     -0.3884000    
 H   2.1100000E-02  0.6841000       2.062600    
 H    1.015600     -0.7672000       1.969400    
 H  -0.6851000     -0.9348000       2.244400    
 H   -1.308000      0.4469000      -2.136400    
 H   0.5111000     -0.6566000      -2.153700    
 H    2.415500       1.643100       1.372500    
 H    2.656500      -1.353400      -1.725300    
 H    4.779900       1.215800       1.948900    
 H    5.009100      -1.753500      -1.148500    
 H    6.081700     -0.4800000      0.6902000    


%chk=000036957-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000036957

0 1
Cl -2.210341 -2.644980 -1.198061
Cl -3.694796 2.053085 -0.279171
F -3.961682 -0.956426 -0.136335
F -2.449346 -1.802222 1.309431
F -1.210851 2.239637 0.567356
F -2.567827 0.945337 1.846772
O -1.793476 0.316046 -1.653699
O 0.671281 -0.116059 -2.080296
C -0.182903 -0.377836 0.177042
C -1.669816 -0.013650 -0.262445
C 0.873373 0.391158 -0.678239
C 0.115338 -0.234660 1.690868
C -2.598904 -1.267145 0.002236
C -2.233834 1.244795 0.501397
C 2.311725 0.139842 -0.257669
C 3.071500 1.172117 0.343818
C 2.908569 -1.130354 -0.470116
C 4.407963 0.938714 0.739456
C 4.244914 -1.362036 -0.079895
C 4.997352 -0.328953 0.528676
H -0.057582 -1.444874 -0.096392
H 0.655063 1.475610 -0.660968
H 0.161104 0.820214 2.008024
H 1.089590 -0.700758 1.910502
H -0.648000 -0.742797 2.297481
H -0.917283 0.087736 -2.122903
H 1.352943 0.273427 -2.681414
H 2.617297 2.157245 0.506712
H 2.327782 -1.925638 -0.951085
H 4.987966 1.742538 1.205591
H 4.700551 -2.343851 -0.249339
H 6.034528 -0.509761 0.831567


