%chk=000279714.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279714

0 1
Br -2.977018 -0.391160 3.009133
O 0.979820 -0.564277 -0.445791
O 3.167216 2.039746 1.890561
O 4.547538 -0.054621 0.384708
O 2.671834 -2.644956 -2.037733
O -1.397385 0.802382 -2.463080
O -4.821085 -0.616270 0.263770
N -0.975505 0.605103 -0.177295
N -1.412773 0.277425 1.060400
N -3.143007 0.087746 -1.126067
C 3.132694 0.004414 0.537316
C 2.679398 1.481337 0.665642
C 2.408856 -0.680838 -0.641193
C 1.153815 1.558100 0.783663
C 0.495932 0.801359 -0.366760
C 2.647874 -2.198774 -0.682334
C -1.809211 0.503867 -1.366803
C -2.648318 -0.089135 1.219648
C -3.680407 -0.255967 0.163702
H 2.966936 -0.539477 1.500082
H 3.073396 2.103077 -0.168615
H 2.674700 -0.216941 -1.618170
H 0.850317 1.145200 1.777174
H 0.819235 2.614736 0.819743
H 0.652037 1.289863 -1.365426
H 1.873925 -2.742009 -0.107942
H 3.660296 -2.459382 -0.308260
H 4.108240 1.775234 2.030486
H 4.832997 0.259119 -0.500699
H 1.767169 -2.614523 -2.421623
H -3.763315 0.017021 -1.948838


%chk=000279714-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279714

0 1
Br -3.384793 -0.547831 2.953463
O 1.033487 -0.723706 -0.400829
O 3.189567 2.100017 1.871047
O 4.664721 0.093958 0.342352
O 2.281985 -2.799989 -1.938477
O -1.302756 0.827796 -2.517372
O -4.964350 -0.323469 0.170394
N -0.972579 0.486941 -0.203017
N -1.460636 0.155083 1.046291
N -3.122953 0.262057 -1.150246
C 3.200476 0.022139 0.530846
C 2.623386 1.443303 0.697459
C 2.502274 -0.721182 -0.627680
C 1.097448 1.404389 0.875078
C 0.480103 0.646406 -0.308602
C 2.883186 -2.199706 -0.749174
C -1.764079 0.544000 -1.387056
C -2.736939 -0.103899 1.187935
C -3.738709 -0.083221 0.081535
H 3.081610 -0.534751 1.476607
H 2.879294 2.019506 -0.226941
H 2.713355 -0.207247 -1.595795
H 0.846973 0.896202 1.820801
H 0.701931 2.434762 0.922356
H 0.661605 1.172497 -1.267324
H 2.572407 -2.728060 0.176752
H 3.972660 -2.301612 -0.873596
H 4.168680 1.929111 1.863136
H 4.860477 0.482389 -0.550853
H 1.302569 -2.650982 -1.885909
H -3.734198 0.302496 -1.973781


