%chk=000257305.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257305

0 1
Br -5.647199 -0.060248 -0.507305
O 1.160407 -1.669571 0.245998
O 0.692464 3.073467 0.324479
O 3.863068 -0.251875 0.603078
N 2.524989 1.664598 0.499945
C 0.435247 0.609014 0.225106
C 1.398076 -0.360906 0.310765
C -1.002504 0.458597 0.052277
C 1.101265 1.946391 0.340828
C 2.788503 0.279455 0.491915
C -1.571390 -0.826032 -0.048687
C -1.845164 1.586443 -0.016710
C 2.321314 -2.595628 0.356218
C -2.949328 -0.983655 -0.214769
C -3.221745 1.435386 -0.182478
C -3.760344 0.149720 -0.279957
C 1.661141 -3.948262 0.242513
H 3.236881 2.382286 0.603638
H -0.936378 -1.714217 0.002344
H -1.425136 2.595135 0.059551
H 3.016259 -2.364869 -0.469627
H 2.806663 -2.413901 1.330708
H -3.377745 -1.983737 -0.291665
H -3.863844 2.316383 -0.234494
H 2.404047 -4.755412 0.305450
H 0.923620 -4.111625 1.041960
H 1.125434 -4.062640 -0.711280


%chk=000257305-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257305

0 1
Br -5.756327 -0.027577 -0.521321
O 1.201647 -1.681808 0.255216
O 0.675146 3.138712 0.322263
O 3.906853 -0.236896 0.609739
N 2.525256 1.690067 0.500094
C 0.430287 0.644169 0.228105
C 1.418370 -0.332317 0.317127
C -1.018600 0.488976 0.053511
C 1.134877 1.969848 0.345823
C 2.781086 0.312695 0.492850
C -1.611791 -0.807180 -0.046673
C -1.878124 1.627554 -0.022089
C 2.343388 -2.659214 0.359022
C -3.001542 -0.961513 -0.215157
C -3.268946 1.480368 -0.190626
C -3.819116 0.185461 -0.285827
C 1.718599 -4.043111 0.241449
H 3.238774 2.412052 0.601930
H -0.979459 -1.695566 0.007562
H -1.448804 2.630007 0.051845
H 3.060157 -2.444613 -0.451825
H 2.849909 -2.500997 1.326390
H -3.439663 -1.960754 -0.290337
H -3.911832 2.363287 -0.246611
H 2.511988 -4.809518 0.308299
H 0.994967 -4.223187 1.054645
H 1.201499 -4.164649 -0.725602


