%chk=000266622.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266622

0 1
Br 5.665921 -3.488085 0.260019
O 1.095234 -1.640189 -2.066366
O -3.229602 -2.819675 -0.290917
O -4.837401 -0.784044 0.889505
O -2.680687 3.404711 -0.663674
O -0.770571 2.905074 -1.513923
N 3.000721 1.948172 0.131683
N -1.856279 2.582349 -1.036815
C 1.917874 0.293368 -1.003379
C -0.257809 0.292504 -2.343430
C 3.114441 -0.274970 -0.421940
C -1.445175 0.112643 -1.453280
C 3.780903 0.778157 0.286911
C 0.962873 -0.461216 -1.805568
C 1.885661 1.642578 -0.644888
C -2.184171 1.166379 -0.882529
C -1.863269 -1.207659 -1.205035
C 3.674411 -1.565572 -0.437004
C 4.988680 0.566785 0.976321
C -2.983544 -1.491557 -0.422683
C -3.337562 0.893701 -0.094993
C -3.739087 -0.404204 0.138736
C 4.861874 -1.751367 0.247689
C 5.522164 -0.711581 0.948617
C -4.366827 -3.248964 0.509045
C -5.650331 0.275007 1.455698
H -0.012323 1.361514 -2.536287
H -0.497813 -0.118623 -3.354512
H 1.138777 2.392599 -0.896659
H 3.223080 2.847205 0.518915
H -1.288287 -2.045737 -1.627519
H 3.160936 -2.366466 -0.981207
H 5.481950 1.374929 1.508204
H -3.894119 1.744280 0.315395
H 6.457925 -0.922658 1.469191
H -5.296651 -2.873076 0.068901
H -4.248720 -2.905858 1.542529
H -4.289031 -4.340444 0.430347
H -6.078915 0.894515 0.662045
H -5.065662 0.865932 2.167004
H -6.430987 -0.300356 1.970457


%chk=000266622-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266622

0 1
Br 5.750854 -3.544684 0.368118
O 1.084201 -1.706407 -2.034213
O -3.384610 -2.831283 -0.461762
O -4.968418 -0.740077 0.842713
O -2.726210 3.484464 -0.456971
O -0.753675 3.004495 -1.468937
N 3.053417 1.943614 0.073688
N -1.879818 2.624315 -0.934220
C 1.959111 0.274248 -1.024536
C -0.254963 0.298118 -2.398115
C 3.163802 -0.286895 -0.416250
C -1.479495 0.151734 -1.495618
C 3.830876 0.784317 0.266314
C 0.970264 -0.456728 -1.814635
C 1.941514 1.643959 -0.694131
C -2.213092 1.195493 -0.849068
C -1.960029 -1.162476 -1.296966
C 3.725480 -1.588548 -0.395309
C 5.039558 0.601302 0.967418
C -3.089877 -1.479996 -0.511593
C -3.367780 0.905851 -0.071372
C -3.821913 -0.406155 0.107068
C 4.929870 -1.756900 0.308281
C 5.592394 -0.696199 0.984242
C -4.328874 -3.418506 0.513728
C -5.727120 0.363701 1.444293
H -0.025101 1.352029 -2.590425
H -0.473374 -0.203115 -3.358085
H 1.196378 2.398362 -0.947231
H 3.273904 2.867301 0.442568
H -1.421174 -1.996518 -1.758182
H 3.225249 -2.409459 -0.912580
H 5.544744 1.423116 1.485185
H -3.891778 1.755528 0.370440
H 6.528859 -0.887435 1.515239
H -5.362853 -3.111196 0.295221
H -4.063104 -3.124722 1.542578
H -4.203674 -4.503031 0.377429
H -6.095619 1.061272 0.668565
H -5.112582 0.914271 2.181638
H -6.576741 -0.117061 1.950078


