%chk=000052712.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052712

0 1
 Cl   7.665800      0.9766000      -1.979700    
 F   -6.139600     -1.1100000E-02  -1.311800    
 F   -4.679800      -1.586400      -1.613700    
 F   -5.675900      -1.385000      0.3088000    
 O    5.192800     -0.9997000      0.3201000    
 O    5.491600       1.253800     -6.0199998E-02
 N    1.714000     -0.3963000       1.348100    
 C   0.4527000     -0.3545000      0.6025000    
 C  -0.6984000      2.6000000E-03   1.560500    
 C   -1.910300      0.5730000      0.8635000    
 C   0.2507000      -1.708800     -7.7500001E-02
 C    2.827500     -0.6710000      0.4554000    
 C   -2.906600     -0.2835000      0.4231000    
 C   -2.004200       1.943100      0.6785000    
 C    4.136700     -0.7123000       1.227200    
 C   -4.026500      0.2441000     -0.2196000    
 C   -3.124100       2.470700      3.5799999E-02
 C   -4.135200       1.621200     -0.4132000    
 C   -5.107000     -0.6642000     -0.7011000    
 C    5.794600      8.6300001E-02 -0.2630000    
 C    6.881300     -0.3985000      -1.183700    
 H   0.5197000      0.4232000     -0.1702000    
 H  -0.9875000     -0.8718000       2.159700    
 H  -0.3607000      0.7485000       2.294400    
 H    1.864500      0.4958000       1.818500    
 H   0.9179000      -1.854900     -0.9328000    
 H   0.3841000      -2.542000      0.6222000    
 H  -0.7583000      -1.795100     -0.4908000    
 H    2.744900      -1.643700     -3.9400000E-02
 H    2.889800      8.5500002E-02 -0.3366000    
 H   -2.830300      -1.355800      0.5824000    
 H   -1.221200       2.612800       1.022200    
 H    4.320400      0.2178000       1.779300    
 H    4.116700      -1.520300       1.967600    
 H   -3.208300       3.542900     -0.1155000    
 H   -4.999400       2.051000     -0.9120000    
 H    6.452800      -1.038500      -1.958800    
 H    7.639700     -0.9375000     -0.6110000    


%chk=000052712-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000052712

0 1
Cl 6.872751 0.085231 -2.402546
F -6.683444 -0.022413 0.058222
F -5.464553 -1.410975 -1.249591
F -5.468047 -1.698014 0.996148
O 5.379878 -1.218823 0.317855
O 5.907135 0.980871 0.915341
N 1.751090 -0.478975 1.000425
C 0.491092 -0.181541 0.265595
C -0.613035 0.077825 1.334718
C -1.920075 0.582439 0.747812
C 0.106463 -1.345882 -0.669876
C 2.988687 -0.562351 0.197585
C -3.055958 -0.256916 0.667087
C -2.026154 1.909702 0.253666
C 4.104195 -1.133338 1.089556
C -4.264004 0.220819 0.108157
C -3.232549 2.385861 -0.303802
C -4.361485 1.543010 -0.382736
C -5.442192 -0.701610 -0.010423
C 6.161157 -0.068961 0.283309
C 7.363991 -0.280265 -0.616802
H 0.590011 0.746455 -0.353563
H -0.768934 -0.861348 1.896615
H -0.224750 0.827305 2.055902
H 1.872677 0.176245 1.787044
H 0.845458 -1.485588 -1.478245
H 0.042018 -2.286269 -0.093057
H -0.869282 -1.151552 -1.148075
H 2.827315 -1.250384 -0.649127
H 3.315308 0.416956 -0.224771
H -3.002981 -1.281358 1.050723
H -1.158996 2.578431 0.318370
H 4.270507 -0.500278 1.980693
H 3.884825 -2.168797 1.386781
H -3.297739 3.414708 -0.672449
H -5.303458 1.907582 -0.803598
H 7.708228 -1.322364 -0.605150
H 8.159750 0.432565 -0.368590


