%chk=000129499.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129499

0 1
 Br  -5.369700      -3.579800     -0.3885000    
 F    8.740700      0.8114000     -0.1374000    
 O   -1.481200       1.363000      0.4855000    
 O   -3.941600       2.265900      0.1752000    
 O   -6.586800       1.468400      0.2445000    
 N    2.634700     -0.7844000     -0.1152000    
 N   -1.009600     -0.4136000     -0.9305000    
 C    1.177700     -0.9108000      2.7799999E-02
 C   0.9625000      -2.423500     -5.2600000E-02
 C    2.281900      -3.042200      0.3964000    
 C    3.189600      -1.863300      0.7059000    
 C   0.3973000     -0.1709000      -1.051300    
 C    3.144700      0.5175000      0.2975000    
 C    4.643700      0.5956000      0.1802000    
 C   -1.850400      0.3852000     -0.1596000    
 C    5.433100      0.2294000       1.261300    
 C    5.214900       1.033400      -1.006400    
 C   -3.280500     -1.4900000E-02 -0.1165000    
 C    6.822000      0.3035000       1.153600    
 C    6.603800       1.106100      -1.114500    
 C    7.407300      0.7417000     -3.4200002E-02
 C   -4.258100      0.9453000      4.7800001E-02
 C   -3.583900      -1.355800     -0.2486000    
 C   -5.595000      0.5486000      8.2900003E-02
 C   -4.920600      -1.752300     -0.2132000    
 C   -5.926300     -0.8002000     -4.6900000E-02
 C   -3.866500       3.031400      -1.025000    
 C   -6.983800       1.765200       1.581800    
 H   0.8581000     -0.5694000       1.023200    
 H   0.1374000      -2.742100      0.5940000    
 H   0.7348000      -2.758600      -1.071900    
 H    2.698600      -3.652100     -0.4139000    
 H    2.150200      -3.689400       1.269500    
 H    4.222000      -2.117600      0.4471000    
 H    3.129100      -1.638100       1.778500    
 H   0.5730000      0.9085000     -0.9922000    
 H   0.6988000     -0.4999000      -2.052500    
 H    2.711800       1.310000     -0.3254000    
 H    2.846400      0.7589000       1.327500    
 H   -1.389400      -1.175700      -1.482100    
 H    4.993200     -0.1010000       2.197800    
 H    4.598600       1.318400      -1.854400    
 H    7.447900      2.2399999E-02   1.995400    
 H    7.059700       1.446600      -2.039400    
 H   -2.815500      -2.117400     -0.3442000    
 H   -6.971300      -1.099700     -1.8500000E-02
 H   -3.131000       2.606300      -1.715300    
 H   -3.554100       4.046300     -0.7643000    
 H   -4.847100       3.081500      -1.508500    
 H   -7.377200      0.8693000       2.072500    
 H   -7.774400       2.519700       1.545000    
 H   -6.141900       2.168200       2.153600    


%chk=000129499-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129499

0 1
Br -5.591260 -3.604889 0.345475
F 7.860219 2.496409 -0.199976
O -1.144274 1.002195 0.553634
O -3.989008 2.343727 -0.154647
O -6.596464 1.595385 0.407209
N 2.501166 -1.162064 -0.002393
N -1.087379 -0.626100 -1.101388
C 1.048595 -1.497763 -0.083276
C 1.003659 -3.028971 -0.375190
C 2.469501 -3.410590 -0.725350
C 3.285504 -2.414949 0.121619
C 0.383720 -0.617699 -1.177772
C 2.848049 -0.076530 0.930633
C 4.199118 0.569960 0.629933
C -1.760775 0.166881 -0.185772
C 4.972708 1.129616 1.676866
C 4.679929 0.661293 -0.700428
C -3.250027 -0.069205 -0.101360
C 6.198129 1.781921 1.411692
C 5.903482 1.303657 -0.989987
C 6.633652 1.852612 0.078125
C -4.211030 0.978758 0.016489
C -3.677262 -1.426819 -0.011174
C -5.576909 0.641314 0.308304
C -5.026674 -1.726476 0.220060
C -5.979722 -0.707023 0.398818
C -2.858168 2.851685 -0.950537
C -6.422697 2.699942 1.378845
H 0.529044 -1.274189 0.875536
H 0.675802 -3.578642 0.525549
H 0.296300 -3.278944 -1.187150
H 2.674179 -3.242883 -1.798269
H 2.704340 -4.462316 -0.489175
H 4.316821 -2.270930 -0.246122
H 3.348816 -2.764173 1.183004
H 0.726820 0.423803 -1.047553
H 0.696352 -0.963644 -2.178797
H 2.053179 0.692759 0.859253
H 2.842705 -0.427789 1.993863
H -1.623944 -1.240578 -1.714998
H 4.617946 1.057748 2.712107
H 4.080804 0.212602 -1.500034
H 6.804486 2.218619 2.210572
H 6.287471 1.380399 -2.011652
H -2.937013 -2.230390 -0.063409
H -7.033080 -0.919125 0.597109
H -1.949289 2.909144 -0.331525
H -3.180345 3.850402 -1.283163
H -2.675086 2.203941 -1.828726
H -6.311813 2.291251 2.401332
H -7.352911 3.282938 1.306427
H -5.549771 3.318719 1.118874


