%chk=000283468.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283468

0 1
Br 1.666448 2.124970 -1.141987
O -2.327721 1.376504 -0.498581
O -3.684631 -0.452244 -0.818029
O -1.185026 -1.187218 1.172336
O 4.480008 0.754231 -1.827573
N 1.447838 -1.473035 0.707079
N 2.754187 -1.511827 0.374331
N 5.450891 -0.534711 -0.230987
C -1.431863 0.286175 -0.730185
C -2.347531 -0.955248 -0.933759
C -0.609934 -0.008312 0.547869
C -3.670601 0.877590 -0.220128
C -2.015558 -1.910218 0.220870
C 0.828882 -0.294919 0.274461
C -3.895678 0.787110 1.274267
C -4.644574 1.735603 -0.994288
C 1.827685 0.448343 -0.368463
C 3.017765 -0.343257 -0.293255
C 4.343548 0.011610 -0.872731
H -0.823462 0.591985 -1.603879
H -2.307069 -1.424207 -1.934272
H -0.727081 0.798839 1.312594
H -2.907667 -2.204490 0.802939
H -1.447538 -2.796893 -0.098654
H -3.809973 1.771860 1.750022
H -4.888591 0.382626 1.504762
H -3.156239 0.128002 1.755271
H -4.373045 1.772452 -2.059947
H -5.665032 1.337128 -0.930769
H -4.649866 2.768719 -0.624323
H 1.000184 -2.223629 1.224250
H 5.373976 -1.219388 0.502601
H 6.372770 -0.366353 -0.603340


%chk=000283468-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000283468

0 1
Br 1.698567 2.166791 -1.417837
O -2.458526 1.474086 -0.532999
O -3.688925 -0.515955 -0.808202
O -1.190163 -1.029264 1.208051
O 4.786471 0.916730 -1.523922
N 1.473011 -1.229785 0.845528
N 2.813744 -1.341629 0.556252
N 5.368828 -1.011004 -0.341391
C -1.459227 0.422747 -0.731181
C -2.277914 -0.898542 -0.955867
C -0.592819 0.158248 0.537486
C -3.772549 0.846894 -0.209533
C -1.776912 -1.870096 0.128036
C 0.867709 -0.131540 0.261958
C -3.981835 0.761611 1.309444
C -4.857562 1.626286 -0.945981
C 1.895546 0.520955 -0.446551
C 3.082179 -0.257035 -0.247572
C 4.471018 -0.048914 -0.767191
H -0.846465 0.723036 -1.593492
H -2.165679 -1.315901 -1.969853
H -0.699732 1.006872 1.236048
H -2.593285 -2.454919 0.577338
H -1.002492 -2.548599 -0.286264
H -3.986035 1.776726 1.743317
H -4.952805 0.282351 1.524754
H -3.182138 0.169438 1.785478
H -4.635989 1.647097 -2.024626
H -5.839093 1.148048 -0.788340
H -4.901706 2.661491 -0.567411
H 1.003544 -1.894834 1.461065
H 5.059081 -1.767604 0.269411
H 6.337653 -0.945988 -0.647451


