%chk=000127051.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127051

0 1
 Br  -4.080900       2.047600     -0.4465000    
 N   0.6096000     -0.1136000     -8.0000004E-03
 N    4.820100      0.2024000      0.2511000    
 N   -1.606100      0.7821000     -0.1850000    
 C    3.452400      0.3496000     -0.2404000    
 C    2.602700       1.097400      0.7894000    
 C    2.841700      -1.026700     -0.5116000    
 C    1.149800       1.211100      0.3285000    
 C    1.385700     -0.9104000     -0.9648000    
 C  -0.7789000     -0.2798000      5.9500001E-02
 C   -1.284600      -1.546600      0.3798000    
 C   -2.661500      -1.727100      0.4506000    
 C   -2.938700      0.5684000     -0.1068000    
 C   -3.511300     -0.6544000      0.2041000    
 H    3.481500      0.9225000      -1.175100    
 H    3.006400       2.102500      0.9622000    
 H    2.630600      0.5714000       1.753400    
 H    2.882300      -1.642000      0.3976000    
 H    3.419200      -1.554800      -1.280300    
 H   0.5717000       1.671300       1.139800    
 H    1.079900       1.870700     -0.5454000    
 H    1.336200     -0.4360000      -1.952900    
 H   0.9797000      -1.922400      -1.074600    
 H    4.821000     -0.3246000       1.123800    
 H    5.203900       1.119500      0.4762000    
 H  -0.6258000      -2.384600      0.5873000    
 H   -3.071600      -2.700900      0.7008000    
 H   -4.586200     -0.7906000      0.2593000    


%chk=000127051-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127051

0 1
Br -3.696513 2.148830 1.419927
N 0.570510 -0.055051 -0.507228
N 4.689906 0.212800 0.762900
N -1.472563 0.733746 0.350153
C 3.459827 0.300312 -0.053482
C 2.406176 1.327432 0.452324
C 2.808658 -1.097623 -0.154378
C 1.131224 1.312132 -0.422554
C 1.519535 -1.065821 -1.010374
C -0.742179 -0.324720 -0.148328
C -1.361933 -1.614483 -0.265441
C -2.699943 -1.764193 0.139277
C -2.735348 0.549940 0.717636
C -3.439813 -0.667549 0.652856
H 3.770660 0.604613 -1.075583
H 2.840538 2.346723 0.447643
H 2.135679 1.084482 1.499538
H 2.559988 -1.459622 0.864183
H 3.535373 -1.805161 -0.593757
H 0.351141 1.972464 -0.016408
H 1.382803 1.657902 -1.449284
H 1.786351 -0.818152 -2.060928
H 1.053999 -2.062317 -1.019820
H 4.513949 -0.116172 1.720288
H 5.245469 1.075958 0.765802
H -0.824028 -2.475320 -0.667037
H -3.181541 -2.744263 0.052997
H -4.479124 -0.754886 0.971076


