%chk=000052731.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052731

0 1
 F   -8.445400      -1.201400      0.1471000    
 F   -7.746900      0.1990000       1.648600    
 F   -7.815200      0.7949000     -0.4416000    
 F    6.608200      -3.277100     -8.5299999E-02
 F    4.608400      -3.072500      0.7287000    
 F    4.950500      -2.766700      -1.396900    
 O    2.586900       1.517200     -8.6000003E-02
 O    3.887500       3.361100      0.3702000    
 N  -0.9878000       2.247700     -0.5452000    
 C   -2.143000       1.397200     -0.8473000    
 C   -2.558300      0.6251000      0.4183000    
 C   -3.720500     -0.3137000      0.1998000    
 C   -3.265200       2.284000      -1.387100    
 C   0.2275000       1.453900     -0.4740000    
 C   -5.026900      0.1379000      0.3864000    
 C    1.426700       2.335100     -0.1630000    
 C   -3.487500      -1.632500     -0.1902000    
 C   -6.100400     -0.7293000      0.1829000    
 C   -4.560900      -2.499800     -0.3935000    
 C   -5.867300      -2.048000     -0.2070000    
 C   -7.497200     -0.2463000      0.3818000    
 C    3.755300       2.160700      0.1881000    
 C    4.886000       1.199800      0.2398000    
 C    4.658200     -0.1589000      2.0900000E-02
 C    5.721200      -1.060700      6.9200002E-02
 C    6.176500       1.656500      0.5070000    
 C    7.011800     -0.6039000      0.3364000    
 C    7.239500      0.7547000      0.5554000    
 C    5.478200      -2.513700     -0.1638000    
 H   -1.889200      0.6898000      -1.648400    
 H   -1.730600      2.8999999E-02  0.8193000    
 H   -2.817200       1.329900       1.221100    
 H  -0.8764000       2.953200      -1.273300    
 H   -2.916800       2.887800      -2.233500    
 H   -4.103900       1.688400      -1.760100    
 H   -3.642000       2.970100     -0.6203000    
 H   0.1766000      0.6818000      0.3005000    
 H   0.4112000      0.9303000      -1.421000    
 H   -5.213400       1.163900      0.6946000    
 H    1.562900       3.084400     -0.9525000    
 H    1.281100       2.848200      0.7956000    
 H   -2.474300      -1.995300     -0.3414000    
 H   -4.379300      -3.526400     -0.6979000    
 H   -6.690200      -2.738400     -0.3706000    
 H    3.665600     -0.5485000     -0.1895000    
 H    6.375000       2.710800      0.6803000    
 H    7.852500      -1.290900      0.3784000    
 H    8.244400       1.110300      0.7636000    


%chk=000052731-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000052731

0 1
F -8.602957 -1.313332 0.265379
F -7.830219 -0.179907 2.070743
F -8.018937 0.873496 0.078477
F 6.927398 -3.104766 -0.892318
F 5.581950 -3.360791 0.909577
F 4.679966 -2.838966 -1.101499
O 2.598124 1.409441 -0.055220
O 3.835628 3.266543 0.619617
N -0.967152 2.182871 -0.826825
C -2.222871 1.420105 -1.035938
C -2.739181 0.874840 0.336652
C -3.857214 -0.143134 0.195204
C -3.266171 2.332532 -1.707706
C 0.272777 1.391112 -0.718643
C -5.199519 0.194416 0.485116
C 1.374350 2.260597 -0.105110
C -3.578540 -1.461037 -0.259714
C -6.232895 -0.759863 0.322913
C -4.609112 -2.410761 -0.421765
C -5.947117 -2.066646 -0.130155
C -7.638342 -0.363548 0.669851
C 3.776005 2.046317 0.332361
C 4.936576 1.104127 0.358603
C 4.796651 -0.262985 0.021180
C 5.928318 -1.103961 0.057788
C 6.203888 1.616928 0.734495
C 7.196913 -0.597161 0.431092
C 7.328706 0.767119 0.767986
C 5.781416 -2.565872 -0.257063
H -2.048227 0.539468 -1.703060
H -1.884366 0.413335 0.867269
H -3.062058 1.741016 0.942230
H -0.875558 2.958836 -1.494924
H -2.934632 2.639964 -2.717415
H -4.233882 1.814530 -1.814585
H -3.424689 3.243551 -1.100529
H 0.089966 0.529116 -0.051737
H 0.628533 0.974956 -1.691021
H -5.440608 1.203626 0.837833
H 1.592214 3.159733 -0.711430
H 1.112622 2.583140 0.917112
H -2.541651 -1.745375 -0.477935
H -4.373714 -3.421612 -0.770441
H -6.752909 -2.796007 -0.252448
H 3.817776 -0.649768 -0.271964
H 6.282976 2.678287 0.991308
H 8.068192 -1.259435 0.446950
H 8.307477 1.163623 1.054310


