%chk=000295382.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295382

0 1
Br -7.317807 -1.049468 0.000712
O 6.031333 -0.892217 0.000319
O -0.365331 -0.949339 -0.000075
N 0.795897 1.064623 -0.000531
N -1.568327 1.041083 -0.000420
C 2.137854 0.548184 -0.000211
C -2.889542 0.497365 -0.000201
C 3.182454 1.488649 0.000773
C 2.421781 -0.834948 -0.000960
C 4.780246 -0.312165 0.000234
C 4.513516 1.060357 0.000993
C 3.739192 -1.266452 -0.000733
C -0.370387 0.267210 -0.000389
C -3.958322 1.421646 -0.000810
C -3.147740 -0.885577 0.000653
C -5.273148 0.956770 -0.000534
C -4.465670 -1.340697 0.000919
C -5.516592 -0.418984 0.000331
C 7.181228 -0.013572 0.001356
H 2.973587 2.556774 0.001369
H 1.606515 -1.569935 -0.001696
H 0.719688 2.080957 -0.000419
H -1.510559 2.060002 -0.000875
H 5.312468 1.794956 0.001757
H 3.987317 -2.327517 -0.001280
H -3.772080 2.492834 -0.001499
H -2.321625 -1.607869 0.001087
H -6.100079 1.669560 -0.001000
H -4.665421 -2.414840 0.001587
H 7.193866 0.596818 0.908608
H 7.194611 0.597968 -0.905111
H 8.010977 -0.733077 0.001245


%chk=000295382-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295382

0 1
Br -7.537968 -0.762621 0.000918
O 6.194083 -0.813147 0.000854
O -0.403640 -1.176345 -0.000516
N 0.778613 0.865424 -0.000677
N -1.553304 0.884923 -0.000680
C 2.131889 0.411426 -0.000266
C -2.902971 0.444466 -0.000322
C 3.149330 1.397702 0.000211
C 2.500950 -0.962819 -0.000343
C 4.874252 -0.329758 0.000509
C 4.514249 1.040073 0.000595
C 3.860126 -1.318595 0.000046
C -0.388183 0.088841 -0.000949
C -3.913148 1.445569 -0.000091
C -3.283220 -0.925002 -0.000181
C -5.278163 1.097336 0.000268
C -4.650983 -1.273189 0.000184
C -5.636088 -0.266157 0.000406
C 7.272187 0.176718 0.001364
H 2.880204 2.462631 0.000295
H 1.723087 -1.727512 -0.000689
H 0.675695 1.882346 -0.000622
H -1.436966 1.900404 -0.000717
H 5.271924 1.828937 0.000957
H 4.158319 -2.371481 -0.000010
H -3.636488 2.507974 -0.000194
H -2.512470 -1.697088 -0.000365
H -6.044671 1.877152 0.000440
H -4.938277 -2.328708 0.000292
H 7.234287 0.814739 0.906364
H 7.234883 0.815021 -0.903463
H 8.202361 -0.410161 0.001578


