%chk=000074063.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074063

0 1
 Br   1.084300      -4.602700      0.3554000    
 O  -0.2676000       2.146000      0.1365000    
 O   -3.727700      -1.916800     -0.1184000    
 N    1.793500      0.5607000      0.3489000    
 N   -1.868000      -3.694600      7.1900003E-02
 C  -0.5497000     -0.2071000      0.1440000    
 C   -1.453000      -1.270000      7.6700002E-02
 C   0.8208000     -0.4625000      0.2729000    
 C   -2.477700       1.443900     -5.5300001E-02
 C   -3.381000      0.3810000     -0.1222000    
 C   -1.029100       1.188600      7.9899997E-02
 C   -2.901600      -1.014800     -5.8800001E-02
 C  -0.9856000      -2.588300      0.1380000    
 C    1.282200      -1.777800      0.3335000    
 C   0.3810000      -2.838400      0.2662000    
 C    3.140900      0.6226000     -4.8599999E-02
 C   -2.945000       2.762200     -0.1163000    
 C   -4.751600      0.6364000     -0.2504000    
 C    4.055300       1.432400      0.6314000    
 C   -4.311600       3.012300     -0.2440000    
 C   -5.212900       1.951700     -0.3112000    
 C    3.571300     -0.1374000      -1.140100    
 C    5.388300       1.481700      0.2234000    
 C    3.627800       2.257600       1.801200    
 C    4.904200     -8.8200003E-02  -1.548100    
 C    5.812600      0.7213000     -0.8663000    
 H    2.339600      -1.993600      0.4672000    
 H    1.449200       1.412800      0.7791000    
 H   -2.264800       3.608300     -6.6500001E-02
 H   -5.477000     -0.1709000     -0.3050000    
 H   -4.673400       4.035400     -0.2914000    
 H   -6.276300       2.149300     -0.4106000    
 H   -1.492000      -4.632700      0.1210000    
 H   -2.865100      -3.565500     -1.9099999E-02
 H    2.883700     -0.7563000      -1.710400    
 H    6.109100       2.108100      0.7422000    
 H    3.139000       1.634200       2.557500    
 H    4.480500       2.742100       2.289600    
 H    2.940300       3.047300       1.480800    
 H    5.233500     -0.6751000      -2.400600    
 H    6.850100      0.7609000      -1.185300    


%chk=000074063-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000074063

0 1
Br 1.052556 -4.726385 0.181436
O -0.172397 2.192878 0.195905
O -3.813970 -1.974809 -0.091824
N 1.791547 0.562322 0.076603
N -1.916886 -3.703910 -0.048247
C -0.535196 -0.199579 0.047469
C -1.486153 -1.289255 0.007254
C 0.880294 -0.479720 0.054029
C -2.454524 1.459807 0.036073
C -3.391037 0.388158 -0.028432
C -1.000553 1.190169 0.093224
C -2.932826 -1.022744 -0.038883
C -1.036182 -2.659181 0.005820
C 1.311268 -1.850385 0.106315
C 0.388340 -2.880072 0.083075
C 3.196162 0.531504 -0.127630
C -2.919811 2.800665 0.052430
C -4.780802 0.671279 -0.077324
C 3.986500 1.509081 0.559963
C -4.299140 3.072157 0.001203
C -5.233388 2.003365 -0.063777
C 3.813367 -0.367338 -1.040700
C 5.381484 1.524384 0.329632
C 3.339103 2.498150 1.511603
C 5.207962 -0.332705 -1.245797
C 6.000845 0.610929 -0.554638
H 2.374976 -2.073843 0.206150
H 1.301726 1.489607 0.196109
H -2.177388 3.602394 0.105096
H -5.475913 -0.172268 -0.124674
H -4.654539 4.108258 0.011942
H -6.306925 2.217671 -0.102653
H -1.576680 -4.664620 -0.036248
H -2.921636 -3.440852 -0.086072
H 3.197836 -1.057477 -1.626258
H 5.992793 2.265136 0.858648
H 2.730749 1.983913 2.278905
H 4.103181 3.104461 2.026001
H 2.659889 3.196043 0.984174
H 5.667453 -1.027649 -1.957114
H 7.084414 0.644563 -0.710086


