%chk=000252100.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252100

0 1
Br 6.644528 -0.776405 -0.569565
O -2.548166 2.942337 0.199505
N -4.078953 0.291669 -0.088634
N 0.742193 0.839237 -0.401538
N -2.656385 -1.243734 0.924549
N -0.215209 -1.069217 0.638968
N -1.582579 2.242369 0.036877
N -1.193938 -2.845834 1.840048
C -2.811099 -0.004278 0.307976
C -0.363215 0.179544 0.118811
C -1.657531 0.854514 0.095082
C 2.105841 0.397514 -0.392396
C -4.406981 1.447436 -0.948130
C -5.225882 -0.559514 0.311308
C -1.372301 -1.681962 1.128269
C 3.094749 1.406481 -0.423924
C 2.476619 -0.957623 -0.417355
C 4.442370 1.054797 -0.477672
C 3.828934 -1.302303 -0.466874
C 4.797570 -0.297170 -0.497829
H 0.594957 1.821077 -0.685928
H -4.488921 2.380452 -0.347882
H -5.356673 1.283051 -1.480655
H -3.619186 1.616225 -1.705575
H -5.398835 -1.350024 -0.440032
H -6.138651 0.046046 0.425062
H -5.032573 -1.064874 1.279669
H 2.816791 2.459626 -0.398156
H 1.718103 -1.745474 -0.392822
H 5.207002 1.833735 -0.500027
H 4.116815 -2.355335 -0.483528
H -1.991111 -3.390690 2.128119
H -0.275785 -3.254676 1.919677


%chk=000252100-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252100

0 1
Br 6.806974 -0.539133 -0.630887
O -2.444738 2.952819 0.259140
N -4.095358 0.386374 0.007550
N 0.751986 0.736265 -0.247373
N -2.722291 -1.308526 0.841536
N -0.284616 -1.278922 0.504078
N -1.444997 2.143473 0.024787
N -1.369039 -3.086672 1.495049
C -2.831413 -0.043457 0.318245
C -0.363507 0.015434 0.105716
C -1.633249 0.758610 0.086458
C 2.117575 0.379127 -0.308028
C -4.366452 1.447697 -0.979470
C -5.273232 -0.364490 0.486559
C -1.470185 -1.837735 0.938085
C 3.038477 1.415812 -0.630281
C 2.605788 -0.936892 -0.083032
C 4.418310 1.151621 -0.726257
C 3.988244 -1.201963 -0.179616
C 4.882393 -0.160748 -0.498688
H 0.500726 1.728284 -0.410198
H -4.539327 2.422669 -0.494718
H -5.253119 1.148388 -1.567745
H -3.511020 1.559986 -1.663906
H -5.648523 -1.057035 -0.291762
H -6.071194 0.354885 0.741516
H -4.998680 -0.956360 1.369971
H 2.674819 2.435540 -0.804954
H 1.897769 -1.727792 0.166612
H 5.116221 1.956335 -0.972987
H 4.359789 -2.216362 -0.007238
H -2.212045 -3.558985 1.811106
H -0.453591 -3.521254 1.576130


