%chk=000238642.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238642

0 1
Br 5.218488 -0.206241 1.042226
O -1.628119 2.599646 -0.122697
N -0.607222 -0.699182 -0.760801
N -1.210478 1.740953 -2.178427
C -1.727004 0.167126 -0.292725
C -3.060835 -0.375901 -0.874695
C -1.925375 0.158851 1.242281
C -3.656983 -1.290317 0.205370
C -3.028000 -0.867542 1.547062
C -1.495247 1.608835 -0.822837
C 0.708966 -0.565100 -0.236012
C 1.593082 -1.657169 -0.418818
C 1.186528 0.624271 0.350612
C 2.928814 -1.546262 -0.043133
C 2.526526 0.727233 0.725901
C 3.387229 -0.353901 0.526062
H -2.923036 -0.894616 -1.837381
H -3.748071 0.467564 -1.084547
H -2.223213 1.172631 1.587619
H -0.992997 -0.072358 1.783561
H -3.440569 -2.350606 -0.011050
H -4.756738 -1.202847 0.234432
H -3.788296 -0.429360 2.217575
H -2.617444 -1.741781 2.080689
H -0.906196 -1.676557 -0.862582
H -0.970049 2.654122 -2.537805
H -0.892824 0.955872 -2.726148
H 1.237878 -2.584283 -0.862730
H 0.528787 1.476637 0.524568
H 3.607691 -2.388216 -0.192128
H 2.890608 1.653898 1.175757


%chk=000238642-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238642

0 1
Br 5.234564 -0.442287 1.109788
O -2.310325 2.699954 -0.471577
N -0.692141 -0.605498 -0.749661
N -0.891325 1.787806 -2.073136
C -1.798998 0.286336 -0.318980
C -3.139971 -0.351878 -0.804766
C -2.001160 0.334815 1.227965
C -3.439600 -1.457323 0.238122
C -2.928165 -0.870443 1.591853
C -1.675687 1.709597 -0.943810
C 0.636264 -0.545758 -0.283236
C 1.485319 -1.676294 -0.468049
C 1.186574 0.618820 0.328512
C 2.834943 -1.650392 -0.065671
C 2.536637 0.644833 0.737877
C 3.352873 -0.485565 0.538214
H -3.076591 -0.718223 -1.846699
H -3.920277 0.428448 -0.768240
H -2.479898 1.298511 1.471378
H -1.037189 0.292610 1.761688
H -2.900224 -2.391817 -0.010037
H -4.514548 -1.707551 0.265551
H -3.773385 -0.526331 2.214023
H -2.387940 -1.636001 2.175772
H -0.992422 -1.524802 -1.082332
H -0.795530 2.682468 -2.551025
H -0.368490 0.968088 -2.382513
H 1.084758 -2.586872 -0.931285
H 0.576368 1.513219 0.479185
H 3.468829 -2.529093 -0.216207
H 2.942637 1.546024 1.206495


