%chk=000245279.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245279

0 1
Br 6.046303 0.852721 0.131266
O -4.535988 -0.378450 -0.051338
O -3.250994 -2.843791 0.201539
N 0.246300 -1.062967 -0.192789
N -0.750542 1.117931 -0.199402
N -3.146278 1.429405 -0.120020
N -1.698170 3.311957 -0.415852
N -2.220398 -2.263890 0.097000
C -0.900069 -0.280150 -0.132831
C 1.599107 -0.579248 -0.104785
C -2.180872 -0.844549 -0.034793
C 2.524360 -1.030997 -1.062699
C 1.994773 0.284232 0.930833
C -1.953231 1.931451 -0.214142
C -3.394055 -0.005606 -0.071636
C 3.851679 -0.605719 -0.985877
C 3.323180 0.709719 0.997866
C 4.238040 0.264997 0.038618
H 0.121797 -2.089076 -0.215042
H 0.154785 1.535573 -0.431021
H 2.212385 -1.705951 -1.861936
H 1.283638 0.599010 1.696211
H 4.577468 -0.953168 -1.726618
H 3.639719 1.377824 1.803323
H -2.551907 3.875315 -0.470737
H -1.018129 3.737527 0.204763


%chk=000245279-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245279

0 1
Br 6.193195 0.716309 0.096532
O -4.590280 -0.486265 -0.054838
O -3.068610 -2.999559 -0.146296
N 0.228399 -0.957590 -0.174306
N -0.831835 1.187372 -0.130150
N -3.238178 1.423452 -0.075803
N -1.862291 3.316735 -0.125677
N -2.035572 -2.230044 -0.160495
C -0.906639 -0.192305 -0.121952
C 1.584984 -0.540395 -0.106268
C -2.185506 -0.827098 -0.106868
C 2.537784 -1.167500 -0.951453
C 2.020301 0.444524 0.823362
C -2.033685 1.947847 -0.109717
C -3.429030 -0.004075 -0.078277
C 3.898967 -0.807199 -0.886185
C 3.379657 0.821885 0.877442
C 4.307654 0.197007 0.018568
H -0.040428 -1.961665 -0.260368
H 0.083716 1.637310 -0.218421
H 2.210319 -1.930015 -1.665928
H 1.321647 0.865236 1.554904
H 4.627204 -1.295409 -1.539638
H 3.711385 1.572094 1.600896
H -2.713644 3.874660 -0.123060
H -0.956615 3.778787 -0.126104


