%chk=000267816.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267816

0 1
Br -2.056598 -3.517642 0.863437
O 2.346562 -0.079717 1.556054
O 1.518595 2.872103 0.031283
O 3.777811 1.149669 -1.562048
O 4.053608 -1.472594 -1.332500
O -4.209878 -1.303629 -0.510444
N 0.094044 -0.038398 0.844192
N -1.424999 1.711882 -0.145723
N -3.607871 0.903794 -0.776910
C 1.293103 0.785103 1.107540
C 1.792649 1.489271 -0.186930
C 3.311342 1.146532 -0.237867
C 3.383809 -0.195105 0.538066
C 3.067067 -1.454850 -0.282575
C -1.104149 0.420189 0.282951
C -0.063800 -1.425180 1.129569
C -2.009713 -0.661300 0.191839
C -1.335405 -1.800858 0.730011
C -3.351217 -0.473567 -0.365429
C -2.749787 1.867515 -0.671388
H 1.106111 1.490925 1.958224
H 1.278215 1.170337 -1.120338
H 3.913733 1.944206 0.261657
H 4.320331 -0.309346 1.125454
H 2.055490 -1.424793 -0.729727
H 3.165261 -2.365343 0.337754
H 0.719045 -1.988763 1.606093
H 2.036025 3.425540 -0.603214
H 3.797431 0.232816 -1.969887
H -0.760998 2.482743 -0.058239
H 3.967040 -2.293320 -1.864672
H -2.988256 2.894578 -0.992331


%chk=000267816-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267816

0 1
Br -2.503349 -3.425113 1.357490
O 2.288983 -0.347741 1.459844
O 1.264742 2.675607 -0.260613
O 3.956657 1.447337 -1.353517
O 4.440569 -1.166792 -1.478590
O -4.546470 -1.047604 -0.200524
N -0.021264 -0.161338 0.823273
N -1.377560 1.636223 -0.238833
N -3.686633 1.089704 -0.708669
C 1.229132 0.590061 1.044696
C 1.748907 1.293452 -0.230866
C 3.285441 1.173001 -0.100195
C 3.436819 -0.247472 0.510005
C 3.346837 -1.402081 -0.510620
C -1.188243 0.366374 0.286023
C -0.303658 -1.475985 1.272399
C -2.225904 -0.591515 0.346962
C -1.636102 -1.750279 0.975062
C -3.561922 -0.260097 -0.182145
C -2.663553 1.918379 -0.713436
H 1.086209 1.327594 1.858237
H 1.414518 0.759065 -1.142761
H 3.632595 1.920740 0.639206
H 4.352722 -0.349727 1.112400
H 2.363944 -1.406924 -1.022177
H 3.482924 -2.365810 0.013601
H 0.462371 -2.073345 1.755475
H 1.781619 3.178629 -0.940662
H 4.287144 0.577254 -1.733827
H -0.599562 2.318005 -0.299615
H 4.577568 -1.947409 -2.067067
H -2.790881 2.930606 -1.116657


