%chk=000293465.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293465

0 1
Br 3.958983 -0.345104 2.069360
O 1.584012 -0.652306 -1.326288
N 1.361064 1.541443 -0.579183
N 3.461967 0.415322 -0.529564
C -0.984063 1.194996 0.487720
C -0.088330 1.452479 -0.733211
C -0.958892 2.564305 -0.180525
C -2.154069 0.288638 0.349071
C -1.974954 -0.993499 -0.194095
C -3.423334 0.695469 0.784078
C 2.090604 0.342867 -0.828197
C -3.064226 -1.860877 -0.299506
C -4.508703 -0.178667 0.674727
C -4.331678 -1.455989 0.134087
C 4.297140 -0.788903 -0.704066
C 4.248572 -1.607463 0.588147
H -0.511863 1.101651 1.476363
H -0.357775 0.973285 -1.692729
H -1.817784 2.892943 -0.765678
H -0.522623 3.407887 0.347532
H 1.690595 2.176301 0.145923
H -0.984308 -1.306055 -0.534445
H -3.560752 1.688798 1.205223
H -2.925295 -2.854951 -0.721569
H -5.494122 0.137064 1.012066
H 3.913853 1.265032 -0.212348
H -5.177770 -2.134229 0.050275
H 3.912865 -1.402202 -1.558282
H 5.337037 -0.481186 -0.948803
H 5.176295 -2.164686 0.783974
H 3.396952 -2.312062 0.600942


%chk=000293465-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000293465

0 1
Br 6.005276 0.077837 1.493536
O 1.346152 -0.892163 -0.773089
N 1.288712 1.441884 -0.547673
N 3.350058 0.305276 -0.577755
C -1.006096 1.017881 0.532128
C -0.151221 1.509330 -0.645051
C -0.909438 2.519649 0.228826
C -2.250842 0.212651 0.275818
C -2.130159 -1.079702 -0.301405
C -3.535026 0.692983 0.632866
C 1.953481 0.217230 -0.640466
C -3.278003 -1.874261 -0.512905
C -4.684598 -0.102857 0.419893
C -4.558606 -1.389616 -0.152368
C 4.174432 -0.900452 -0.615685
C 4.716153 -1.324856 0.753357
H -0.410392 0.682674 1.390764
H -0.566263 1.315475 -1.642182
H -1.769975 3.019311 -0.226344
H -0.329827 3.140032 0.919735
H 1.819130 2.313962 -0.588263
H -1.131310 -1.437494 -0.580477
H -3.630835 1.689328 1.081471
H -3.176402 -2.870130 -0.959681
H -5.673586 0.277616 0.700661
H 3.809246 1.186703 -0.341686
H -5.448535 -2.007842 -0.317769
H 3.519774 -1.713890 -0.985388
H 5.009383 -0.773136 -1.329091
H 5.314966 -2.246867 0.697762
H 3.923747 -1.406255 1.511460


