%chk=000252437.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252437

0 1
Br -2.637412 -2.654635 0.231351
O -5.805470 0.930924 0.232918
O -1.504514 0.303849 -1.455532
N -2.961276 0.746154 0.227248
C 1.073207 -0.503724 0.329068
C 2.480687 -0.955668 -0.081570
C 0.026909 -1.571310 -0.026158
C 3.530200 0.110091 0.261943
C -1.359912 -1.161623 0.458715
C 4.939558 -0.341095 -0.144729
C -3.748241 0.366286 1.426284
C -3.661214 1.756144 -0.618042
C -1.943043 -0.013086 -0.361907
C 5.989544 0.724026 0.198238
C -5.159186 -0.093237 1.013732
C -5.076073 1.269162 -0.966522
C 7.400117 0.274209 -0.207895
C 8.449482 1.330659 0.130987
H 1.049650 -0.283573 1.412691
H 0.819639 0.445975 -0.188001
H 2.504117 -1.167762 -1.168969
H 2.735060 -1.909878 0.418557
H 0.010908 -1.722314 -1.129501
H 0.314371 -2.547360 0.414031
H 3.504345 0.331182 1.346188
H 3.279421 1.061726 -0.246337
H -1.342166 -0.932788 1.548941
H 4.965863 -0.559003 -1.230088
H 5.190945 -1.293703 0.360004
H -3.237784 -0.411099 2.028866
H -3.826995 1.272160 2.075180
H -3.705010 2.710834 -0.048140
H -3.069226 1.948466 -1.545244
H 5.740303 1.676676 -0.307641
H 5.964413 0.944861 1.282512
H -5.141652 -1.033860 0.435654
H -5.835861 -0.192741 1.881088
H -5.060338 0.393451 -1.638978
H -5.700080 2.070533 -1.401048
H 7.427209 0.055879 -1.293514
H 7.651903 -0.678233 0.298197
H 8.251007 2.276688 -0.385532
H 8.475577 1.543817 1.205589
H 9.452319 1.001041 -0.162636


%chk=000252437-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252437

0 1
Br -2.637421 -2.912143 0.225867
O -5.870681 1.215287 0.353215
O -1.501287 0.179225 -1.542778
N -3.066336 0.586213 0.129702
C 1.056493 -0.548232 0.321792
C 2.491617 -0.976015 -0.063278
C 0.019415 -1.650076 -0.022670
C 3.549208 0.105214 0.252895
C -1.390881 -1.263627 0.423977
C 4.985878 -0.321637 -0.125067
C -3.801341 0.283575 1.378075
C -3.650455 1.711212 -0.641103
C -1.999175 -0.120915 -0.410711
C 6.047173 0.758095 0.185013
C -5.298800 0.060743 1.061445
C -5.143295 1.443271 -0.909454
C 7.484379 0.327190 -0.187766
C 8.538961 1.411139 0.123829
H 1.023845 -0.321971 1.408797
H 0.793333 0.381115 -0.217286
H 2.520859 -1.212331 -1.146728
H 2.753650 -1.913672 0.470163
H 0.014071 -1.821052 -1.113255
H 0.305538 -2.594897 0.476132
H 3.513554 0.350521 1.335263
H 3.290334 1.039604 -0.287135
H -1.428343 -1.065729 1.508384
H 5.021074 -0.569779 -1.206531
H 5.244847 -1.255795 0.416362
H -3.399512 -0.618086 1.863903
H -3.698690 1.141823 2.072013
H -3.543439 2.642108 -0.050076
H -3.082765 1.808852 -1.580861
H 5.792911 1.691220 -0.360265
H 6.010772 1.010563 1.265733
H -5.413443 -0.859431 0.449856
H -5.882681 -0.036225 1.991346
H -5.257634 0.561342 -1.574921
H -5.624288 2.320254 -1.371976
H 7.519461 0.074190 -1.267190
H 7.737467 -0.604969 0.357715
H 8.325981 2.342844 -0.433873
H 8.543843 1.660603 1.201940
H 9.557106 1.078480 -0.150495


