%chk=000148681.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148681

1 1
 Br  -3.601800       3.280100     -0.7248000    
 O   0.6831000     -0.2424000     -2.0999999E-03
 O   0.2410000      -2.476200      0.3356000    
 N    4.333600      0.5286000     -7.0000000E-02
 C    2.838300      0.8085000     -0.1119000    
 C    4.695400     -0.4616000      -1.167600    
 C    5.098700       1.826600     -0.2853000    
 C    4.702300     -5.8699999E-02   1.284700    
 C    2.080500     -0.4915000      7.1999997E-02
 C  -0.1267000      -1.327100      0.1468000    
 C   -1.555500     -0.9350000      4.8000000E-02
 C   -1.930400      0.3301000      0.4518000    
 C   -3.272600      0.6976000      0.3580000    
 C   -2.464100      -1.848800     -0.4453000    
 C   -4.210600     -0.2082000     -0.1373000    
 C   -3.806400      -1.481300     -0.5389000    
 C   -3.704800       2.059400      0.7863000    
 H    2.596700       1.529000      0.6788000    
 H    2.600700       1.274300      -1.075900    
 H    4.251400     -0.1236000      -2.108500    
 H    5.786600     -0.4797000      -1.258000    
 H    4.356400      -1.465500     -0.9006000    
 H    4.822200       2.525700      0.5095000    
 H    6.170900       1.612200     -0.2483000    
 H    4.824400       2.230400      -1.264400    
 H    4.285800      0.5791000       2.069900    
 H    4.333200      -1.083800       1.366500    
 H    5.794600     -7.5199999E-02   1.358900    
 H    2.313400      -1.216600     -0.7121000    
 H    2.276800     -0.9390000       1.050500    
 H   -1.211400       1.040200      0.8511000    
 H   -2.161100      -2.841500     -0.7645000    
 H   -5.259300      6.5899998E-02 -0.2166000    
 H   -4.536700      -2.186100     -0.9257000    
 H   -3.065900       2.467400       1.575200    
 H   -4.739900       2.071700       1.140900    


%chk=000148681-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000148681

1 1
Br -3.542807 3.242283 -1.438857
O 0.714980 -0.307190 0.165373
O 0.217579 -2.572069 -0.037202
N 4.403018 0.513449 -0.010034
C 2.864917 0.617349 0.118583
C 4.797625 -0.102350 -1.354159
C 4.971553 1.933306 0.068753
C 4.990240 -0.320713 1.129607
C 2.125706 -0.728061 0.118448
C -0.209495 -1.400872 0.062920
C -1.618119 -0.953610 0.076288
C -1.977583 0.409797 0.216368
C -3.338634 0.795464 0.197116
C -2.625209 -1.947590 -0.070744
C -4.335334 -0.204416 0.039882
C -3.980359 -1.566812 -0.087989
C -3.722531 2.237633 0.346687
H 2.658605 1.159553 1.056959
H 2.512780 1.231677 -0.727431
H 4.331041 0.478058 -2.164567
H 5.893547 -0.067922 -1.451658
H 4.458005 -1.146647 -1.397873
H 4.711646 2.370754 1.044523
H 6.065475 1.889380 -0.042364
H 4.537154 2.539884 -0.740251
H 4.643436 0.089781 2.090181
H 4.664587 -1.365645 1.028566
H 6.088586 -0.271151 1.075668
H 2.300659 -1.328592 -0.792686
H 2.353106 -1.355346 0.999164
H -1.196872 1.169029 0.322818
H -2.328735 -2.996294 -0.173841
H -5.391665 0.087290 0.014281
H -4.760009 -2.325765 -0.203282
H -3.062468 2.800226 1.022179
H -4.775622 2.381133 0.625272


