%chk=000131601.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131601

0 1
 Br   8.608200     -7.0299998E-02  0.4711000    
 P   -4.886100     -0.2870000      0.5214000    
 O   -4.393400      0.9960000       1.376700    
 O   -6.356100      0.1412000     -4.3000001E-03
 O   -4.853700      -1.572200       1.297800    
 O    2.033700      -2.311300      0.6700000    
 N    2.563000     -0.1796000     -0.1551000    
 N    3.507500       3.077900      -1.403100    
 C   -3.860600     -0.3022000     -0.9366000    
 C   -2.407300     -0.5431000     -0.6446000    
 C   -1.567200      0.5366000     -0.3994000    
 C   -1.917700      -1.843600     -0.6218000    
 C   0.2825000     -0.9898000     -0.1033000    
 C  -0.2175000      0.3123000     -0.1277000    
 C  -0.5678000      -2.067800     -0.3502000    
 C   -4.461400       2.302300      0.8333000    
 C   -7.006200     -0.6704000     -0.9662000    
 C    1.689600      -1.223400      0.1805000    
 C   -3.936100       3.288900       1.854400    
 C   -8.354400     -6.4199999E-02  -1.292600    
 C    3.972100     -0.1305000     -1.8600000E-02
 C    4.682200      0.9945000     -0.4071000    
 C    4.614300      -1.238600      0.5126000    
 C    6.069400       1.012900     -0.2606000    
 C    6.001600      -1.220400      0.6589000    
 C    6.728900     -9.4599999E-02  0.2725000    
 C    4.032700       2.146500     -0.9579000    
 H   -4.209400      -1.093300      -1.611000    
 H   -3.977100      0.6262000      -1.507000    
 H   -1.929000       1.557600     -0.4237000    
 H   -2.571300      -2.690600     -0.8110000    
 H   0.3945000       1.181400      9.4400004E-02
 H  -0.1989000      -3.090100     -0.3404000    
 H   -5.506000       2.538400      0.6068000    
 H   -3.890500       2.377300     -9.2100002E-02
 H   -7.129000      -1.680300     -0.5630000    
 H   -6.406000     -0.7223000      -1.878100    
 H   -2.894700       3.062900       2.106500    
 H   -4.510300       3.225300       2.784600    
 H   -3.992600       4.312600       1.474000    
 H   -8.236100      0.9522000      -1.682600    
 H   -8.971600      1.0800000E-02 -0.3912000    
 H   -8.885200     -0.6675000      -2.034400    
 H    2.163400      0.6414000     -0.5980000    
 H    4.135300      -2.148800      0.8374000    
 H    6.637400       1.891000     -0.5622000    
 H    6.501900      -2.090900       1.075900    


%chk=000131601-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131601

0 1
Br 8.913478 0.094004 0.905285
P -4.942652 -0.546879 -0.098042
O -4.549890 0.495392 1.239524
O -6.364224 0.149785 -0.829141
O -5.070410 -2.059018 0.377629
O 2.160183 -2.175541 0.748779
N 2.829655 -0.178530 -0.283736
N 3.742267 2.810510 -1.839775
C -3.709672 -0.200126 -1.483147
C -2.270105 -0.416075 -1.065014
C -1.332691 0.642998 -1.152047
C -1.832504 -1.680049 -0.585246
C 0.454868 -0.820167 -0.322126
C 0.015172 0.447530 -0.787874
C -0.490084 -1.874430 -0.216776
C -4.525905 1.973259 1.051235
C -7.703286 -0.295295 -0.335215
C 1.865781 -1.126393 0.100230
C -4.315917 2.573188 2.439009
C -8.730183 0.246351 -1.325052
C 4.207372 -0.166884 0.014740
C 4.988479 0.937365 -0.471690
C 4.858811 -1.180254 0.767888
C 6.381503 1.014108 -0.209403
C 6.240922 -1.095599 1.027089
C 6.993129 -0.004450 0.538251
C 4.339282 1.974521 -1.223491
H -4.012349 -0.898379 -2.284162
H -3.894559 0.826202 -1.839598
H -1.654886 1.627785 -1.510537
H -2.553705 -2.498767 -0.482778
H 0.690542 1.310053 -0.848895
H -0.143723 -2.839280 0.166757
H -5.480450 2.302965 0.597611
H -3.691823 2.242640 0.371383
H -7.860406 0.109265 0.683070
H -7.714758 -1.399967 -0.283822
H -3.373019 2.206918 2.878370
H -5.143966 2.292220 3.111169
H -4.270979 3.676355 2.373973
H -8.549584 -0.160646 -2.334399
H -8.682362 1.347529 -1.378108
H -9.748412 -0.044679 -1.006871
H 2.500928 0.596370 -0.867136
H 4.271296 -2.021694 1.137778
H 6.955899 1.862433 -0.589670
H 6.727938 -1.883245 1.608979


