%chk=000002440.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002440

0 1
 Br   2.702400      -3.481200      0.4894000    
 O    2.087900      -1.505700      -1.817200    
 O    1.585000       3.095900     -0.7265000    
 O    3.755300       3.622100     -0.3424000    
 O   2.3100000E-02   2.096400       2.144900    
 O   0.8210000      3.0000001E-04   2.512200    
 O  -0.1361000      -4.147800       1.537600    
 N   -3.343800       2.233700     -0.6732000    
 N   -4.439100      0.8624000      0.9782000    
 N   -2.147500       1.229100      -2.457700    
 N   -4.533200       3.203600       1.101600    
 C    2.992100       1.338400      9.0099998E-02
 C    3.913100      0.5551000     -0.8693000    
 C    3.394900       1.273100       1.574300    
 C    3.420900      0.4415000      -2.315200    
 C    2.040100     -0.2019000      -2.381400    
 C    2.363900       1.858400       2.537400    
 C    2.853000       2.795700     -0.3377000    
 C   0.9541000      -1.948600      -1.187400    
 C    1.012000       1.204300       2.400500    
 C   -1.450000      -1.907700      -1.024000    
 C  -0.2747000      -1.478600      -1.640700    
 C   -2.770000      -1.407900      -1.505500    
 C    1.019400      -2.843200     -0.1239000    
 C   -1.390700      -2.804300      4.2800002E-02
 C  -0.1561000      -3.271900      0.4929000    
 C   -3.236400     -0.1411000     -0.8167000    
 C   -2.930800       1.103500      -1.283700    
 C   -3.992400     -0.2257000      0.3170000    
 C   -4.083100       2.042600      0.4361000    
 C  -5.4299999E-02  -3.590700       2.847400    
 H    1.999100      0.8825000      3.0300001E-02
 H    4.900800       1.034000     -0.8842000    
 H    4.073400     -0.4517000     -0.4645000    
 H    4.350000       1.792200       1.722800    
 H    3.565400      0.2224000       1.842500    
 H    3.393500       1.428600      -2.789200    
 H    4.137800     -0.1723000      -2.873400    
 H    1.754500     -0.2975000      -3.436100    
 H    1.312900      0.4601000      -1.899400    
 H    2.692900       1.730800       3.574700    
 H    2.263800       2.937100       2.371800    
 H  -0.3547000     -0.8264000      -2.503800    
 H   -3.528700      -2.188800      -1.346700    
 H   -2.767300      -1.298700      -2.596500    
 H   -2.303300      -3.143400      0.5271000    
 H    1.499900       4.033800      -1.001000    
 H  -0.8505000       1.658900       2.055700    
 H   -4.280000      -1.175100      0.7554000    
 H   -2.269000      0.5560000      -3.202500    
 H   -1.928000       2.177500      -2.739800    
 H   0.8186000      -2.939500       2.950500    
 H   3.7500001E-02  -4.412200       3.563200    
 H  -0.9655000      -3.029100       3.076800    
 H   -5.091100       3.111600       1.939300    
 H   -4.291200       4.113000      0.7331000    


%chk=000002440-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000002440

0 1
Br 2.659548 -4.147040 0.229053
O 2.273869 -1.486843 -1.193756
O 3.943437 3.616758 -1.329408
O 4.968628 3.910723 0.726022
O -0.679379 2.743951 1.939646
O 0.570078 0.997685 1.090619
O -0.307530 -5.208864 0.558062
N -4.635216 1.745495 -0.548634
N -2.551690 1.653479 0.667303
N -5.227422 0.083593 -2.061872
N -4.035940 3.453623 0.944573
C 3.335490 2.053803 0.424238
C 4.053994 0.741088 -0.054470
C 3.035280 2.064358 1.948254
C 3.777288 0.384327 -1.535892
C 2.347576 -0.118442 -1.767422
C 1.726527 2.806639 2.294041
C 4.159610 3.265851 0.021557
C 1.023014 -2.061814 -1.008257
C 0.489367 2.104146 1.725389
C -1.436671 -2.108258 -1.171913
C -0.194846 -1.485899 -1.448073
C -2.744525 -1.449739 -1.600755
C 0.991618 -3.311911 -0.325624
C -1.453959 -3.336771 -0.480086
C -0.244167 -3.944497 -0.064172
C -3.082946 -0.145851 -0.878845
C -4.309626 0.563551 -1.156105
C -2.245759 0.460705 0.059507
C -3.739038 2.258319 0.340864
C -0.295847 -5.171667 2.035975
H 2.378626 2.107494 -0.121947
H 5.144109 0.819563 0.120779
H 3.684926 -0.088097 0.575737
H 3.881443 2.526385 2.489309
H 2.942012 1.019877 2.293091
H 3.943196 1.270125 -2.178206
H 4.478914 -0.403517 -1.869199
H 2.108671 -0.175266 -2.848244
H 1.606536 0.523028 -1.253540
H 1.596201 2.881825 3.390894
H 1.734091 3.850233 1.923475
H -0.178598 -0.535019 -1.988252
H -3.569791 -2.175412 -1.445628
H -2.709935 -1.247455 -2.694148
H -2.392110 -3.855815 -0.258106
H 4.528553 4.391715 -1.553683
H -1.577179 2.219165 1.396412
H -1.271722 0.052180 0.346706
H -5.082224 -0.786183 -2.565702
H -6.073953 0.626969 -2.220811
H 0.629518 -4.699695 2.415140
H -0.337119 -6.223789 2.355354
H -1.179293 -4.623177 2.417438
H -3.380079 3.876888 1.597905
H -4.904756 3.921082 0.701406


