%chk=000157552.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157552

0 1
 Cl  -3.022800     -0.7488000       3.083100    
 F    5.003900      -1.873900      -1.336300    
 F    4.858700      0.2246000      -1.864700    
 F    5.592100     -0.3507000      9.9900000E-02
 F   -6.690200      0.5354000     -0.3865000    
 F   -5.654800       1.880900      -1.736200    
 F   -5.871600     -0.2200000      -2.254100    
 O    3.516900       1.689700      0.2850000    
 O  -0.2462000       1.795900       1.756400    
 O    1.652700       2.810600       1.328000    
 O   0.9146000      -3.966000     -0.3809000    
 O  -0.7641000      -2.919600      0.5710000    
 N  -0.6605000     -0.5485000       1.227900    
 N   0.9229000       1.793700       1.308600    
 N   0.4041000      -2.936200      0.1181000    
 N   -1.911600      7.1199998E-02 -0.6800000    
 C   0.6609000     -0.5676000      0.7165000    
 C    1.443200      0.5866000      0.7557000    
 C    2.743400      0.5653000      0.2514000    
 C    3.261400     -0.6102000     -0.2922000    
 C    1.178900      -1.743100      0.1729000    
 C    2.479200      -1.764400     -0.3316000    
 C    4.650400     -0.6524000     -0.8397000    
 C   -1.900900     -0.2606000      0.6368000    
 C    3.443900       2.557000     -0.8433000    
 C   -3.054400     -0.3259000       1.413200    
 C   -4.313600      0.3053000     -0.5364000    
 C   -4.273800     -3.7400000E-02  0.8107000    
 C   -3.115400      0.3452000      -1.231100    
 C    4.354200       3.744200     -0.6121000    
 C   -5.601700      0.6196000      -1.210200    
 H    2.900200      -2.670600     -0.7598000    
 H  -0.6644000     -0.3840000       2.232700    
 H    3.745800       2.045400      -1.759300    
 H    2.418400       2.909000      -1.002600    
 H   -5.191900     -8.0100000E-02   1.391700    
 H   -3.083600      0.6062000      -2.284400    
 H    4.320600       4.433700      -1.460400    
 H    4.062900       4.285600      0.2938000    
 H    5.388000       3.413500     -0.4674000    


%chk=000157552-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157552

0 1
Cl -3.003490 0.612962 3.205186
F 4.352724 -1.891637 -2.064201
F 4.654094 0.307644 -2.488525
F 5.419868 -0.593556 -0.550165
F -6.905907 -1.116638 -0.089789
F -6.468288 0.506843 -1.608330
F -5.917574 -1.639999 -2.073185
O 3.756504 1.666720 0.514558
O 0.534216 2.173614 2.439801
O 1.644956 3.328045 0.822459
O -0.075729 -3.035591 -1.462645
O -0.912817 -2.569417 0.605987
N -0.778510 0.257152 1.131787
N 1.236901 2.229476 1.342113
N -0.156981 -2.303756 -0.404609
N -2.181260 -0.385045 -0.673513
C 0.441011 0.010104 0.506937
C 1.507107 0.958943 0.645809
C 2.807065 0.786455 0.074044
C 3.009276 -0.330225 -0.795325
C 0.730081 -1.123106 -0.317534
C 1.959396 -1.249148 -0.979601
C 4.327096 -0.623781 -1.455295
C -2.052443 -0.028931 0.635263
C 4.719892 2.413042 -0.379272
C -3.198691 0.126088 1.468084
C -4.592714 -0.477614 -0.413797
C -4.476168 -0.097443 0.945623
C -3.414450 -0.611236 -1.184731
C 5.049134 3.706102 0.353910
C -5.941845 -0.685853 -1.032075
H 2.107598 -2.133739 -1.604660
H -0.717133 0.816257 1.999050
H 5.608118 1.777589 -0.524032
H 4.220702 2.591777 -1.347215
H -5.361238 0.004895 1.579219
H -3.455407 -0.915465 -2.234781
H 5.770548 4.290780 -0.246403
H 4.141834 4.311557 0.509704
H 5.508324 3.494735 1.334351


