%chk=000157084.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157084

0 1
 Br   6.598800     -0.9655000      0.1129000    
 O  -0.3403000      -1.119700      0.2240000    
 N   -1.562600      0.8572000     -5.5799998E-02
 N   0.8139000      0.8778000     -8.6900003E-02
 C   -2.865000      0.2191000     -2.6100000E-02
 C  -0.3581000      9.8200001E-02  3.9400000E-02
 C    2.142500      0.4544000     -4.1600000E-02
 C   -1.522100       2.311100     -0.2772000    
 C   -2.968400      -1.052500     -0.5194000    
 C   -3.914200      0.9258000      0.4945000    
 C    3.175000       1.380800     -0.1873000    
 C    2.438300     -0.8953000      0.1505000    
 C   -4.220700      -1.666500     -0.4899000    
 C   -5.166500      0.3120000      0.5241000    
 C   -5.319700     -0.9841000      3.1800002E-02
 C    4.503300      0.9575000     -0.1411000    
 C    3.766600      -1.318400      0.1969000    
 C    4.799100     -0.3921000      5.1100001E-02
 H   0.7168000       1.880400     -0.1945000    
 H   -2.492700       2.726000     -0.5609000    
 H  -0.8522000       2.538200      -1.112900    
 H   -1.159400       2.798600      0.6326000    
 H   -2.164300      -1.594700      -1.001100    
 H   -3.820100       1.918200      0.9218000    
 H    2.959600       2.435700     -0.3376000    
 H    1.705800      -1.679300      0.2712000    
 H   -4.344300      -2.669500     -0.8882000    
 H   -6.020800      0.8396000      0.9382000    
 H   -6.295100      -1.461200      5.3100001E-02
 H    5.296100       1.692100     -0.2565000    
 H    3.981600      -2.373400      0.3469000    


%chk=000157084-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157084

0 1
Br 6.785250 -0.828879 0.181249
O -0.331198 -1.200454 0.007003
N -1.545251 0.810378 -0.257910
N 0.810907 0.850719 -0.052622
C -2.840843 0.191625 -0.093382
C -0.353835 0.061386 -0.096974
C 2.157060 0.397119 0.006485
C -1.503672 2.261363 -0.541599
C -3.113933 -1.115050 -0.577333
C -3.878482 0.928206 0.538701
C 3.171102 1.393857 0.047211
C 2.531946 -0.973480 0.022939
C -4.405658 -1.662896 -0.426434
C -5.169671 0.373957 0.672973
C -5.442023 -0.926120 0.191823
C 4.533925 1.040533 0.099582
C 3.897687 -1.327418 0.071780
C 4.886219 -0.324499 0.109359
H 0.702820 1.864172 -0.007975
H -2.486376 2.577830 -0.921214
H -0.766190 2.478662 -1.336377
H -1.272083 2.875739 0.353709
H -2.318480 -1.693921 -1.047874
H -3.676807 1.923825 0.949050
H 2.898738 2.457282 0.035961
H 1.757231 -1.741175 0.007212
H -4.602110 -2.672670 -0.803774
H -5.956498 0.956080 1.165658
H -6.442350 -1.358770 0.299849
H 5.303040 1.817220 0.130540
H 4.180433 -2.384120 0.084385


