%chk=000237565.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237565

0 1
Br -1.322854 5.548437 -0.120299
O -0.678995 0.850536 2.269837
O -0.320953 -1.328438 2.684356
N 3.400764 -0.801802 -0.178956
C -0.414991 -0.543958 0.278328
C 0.963905 -1.069296 -0.153904
C -0.622751 0.914960 -0.065155
C 2.135075 -0.216269 0.369310
C -1.582056 -1.374384 -0.229233
C -0.451903 -0.509925 1.832690
C -0.770809 1.655341 1.140001
C -0.690874 1.572691 -1.278418
C 3.893164 -1.925341 0.688823
C 4.458564 0.246057 -0.368115
C -2.855845 -1.167012 0.329899
C -1.428442 -2.315012 -1.255201
C -0.979236 3.024013 1.173842
C -0.901637 2.967566 -1.281291
C -1.039682 3.657405 -0.079175
C -3.952128 -1.902052 -0.123387
C -2.531013 -3.048601 -1.707507
C 4.847191 -2.817160 -0.106724
C 4.111679 1.136177 -1.562325
C -3.792473 -2.846960 -1.143227
H 1.020896 -1.102030 -1.263465
H 1.082807 -2.121253 0.182261
H 2.020676 0.830538 0.006832
H 2.122601 -0.163786 1.478948
H -0.586971 1.030956 -2.218620
H 4.387433 -1.566755 1.617621
H 3.016407 -2.530433 1.013200
H 4.617702 0.866336 0.540240
H 5.422941 -0.273586 -0.570883
H -2.997470 -0.427603 1.119189
H -0.455453 -2.488446 -1.714460
H -1.088989 3.564090 2.113282
H -0.957334 3.494591 -2.234937
H -4.934414 -1.738511 0.319087
H -2.400693 -3.780900 -2.503541
H 5.788302 -2.306694 -0.340869
H 4.399015 -3.113674 -1.064800
H 5.088319 -3.728550 0.449845
H 4.942741 1.805484 -1.807039
H 3.227403 1.755091 -1.371637
H 3.893666 0.529169 -2.451379
H -4.648182 -3.421208 -1.494346


%chk=000237565-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237565

0 1
Br -1.395807 5.637468 0.582609
O -0.665400 0.604997 2.399942
O -0.203284 -1.688290 2.477156
N 3.436821 -0.719194 -0.239403
C -0.430255 -0.537481 0.232222
C 0.962439 -0.994812 -0.311173
C -0.661498 0.958401 0.072991
C 2.142377 -0.113787 0.155281
C -1.601797 -1.388369 -0.322216
C -0.410116 -0.689242 1.787207
C -0.785593 1.550446 1.346875
C -0.759830 1.770078 -1.069041
C 3.904246 -1.750645 0.729563
C 4.483498 0.284784 -0.571647
C -2.924230 -0.872375 -0.283868
C -1.401370 -2.699873 -0.820056
C -1.004470 2.918598 1.553366
C -0.976256 3.163397 -0.914331
C -1.093686 3.708726 0.384529
C -4.014798 -1.642436 -0.740136
C -2.493076 -3.470298 -1.279824
C 4.813096 -2.814945 0.086762
C 4.249744 0.968020 -1.932438
C -3.804302 -2.947004 -1.242045
H 0.935763 -1.005690 -1.416018
H 1.141018 -2.031742 0.026057
H 2.057590 0.884003 -0.308861
H 2.086557 0.048274 1.261786
H -0.682005 1.339624 -2.072817
H 4.428322 -1.276713 1.597375
H 3.012285 -2.253000 1.147857
H 4.576712 1.059804 0.230966
H 5.453096 -0.244034 -0.608056
H -3.105478 0.138906 0.097376
H -0.398411 -3.133952 -0.855567
H -1.097916 3.340407 2.556076
H -1.055389 3.811884 -1.790740
H -5.027103 -1.225146 -0.701366
H -2.317047 -4.481376 -1.663557
H 5.736464 -2.373913 -0.330721
H 4.280371 -3.325149 -0.734657
H 5.113221 -3.568883 0.838146
H 5.065817 1.681855 -2.150960
H 3.299929 1.533429 -1.954034
H 4.214855 0.211640 -2.735741
H -4.649999 -3.546593 -1.596173


