%chk=000291705.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291705

0 1
Br 1.574455 -3.859391 0.686897
O -1.251965 -1.455001 0.381663
O 4.213931 -1.851052 -1.241525
O -0.192766 -1.483271 -1.658304
N 1.012471 -1.447016 0.351318
C 2.246334 -0.884675 -0.267384
C 3.094182 -0.119320 0.761715
C 2.416856 1.142292 1.218930
C 3.080055 -2.037945 -0.871825
C 2.361964 2.258353 0.369620
C 1.836630 1.209720 2.493988
C 2.395147 -3.370050 -1.018118
C -0.150783 -1.419478 -0.444367
C 1.726429 3.427999 0.792960
C 1.202604 2.383601 2.912160
C -2.557621 -1.622769 -0.263934
C 1.144414 3.492952 2.063555
C -3.100602 -0.277971 -0.653214
C -4.030322 0.373690 0.169082
C -2.678306 0.326164 -1.847050
C -4.543542 1.618075 -0.208851
C -3.192285 1.570339 -2.219026
C -4.126986 2.216134 -1.402330
H 1.982544 -0.203117 -1.128852
H 3.344176 -0.777066 1.621438
H 4.083776 0.119907 0.302334
H 0.884018 -1.213093 1.347573
H 2.817009 2.216283 -0.618510
H 1.883781 0.355430 3.166087
H 3.098413 -4.171180 -1.310349
H 1.586313 -3.317577 -1.780716
H 1.684144 4.291986 0.130798
H 0.752407 2.432165 3.902830
H -3.126698 -2.116229 0.546674
H -2.450351 -2.306572 -1.127751
H 0.648173 4.404809 2.390011
H -4.351564 -0.083444 1.103425
H -1.937542 -0.177711 -2.476186
H -5.267157 2.122365 0.429090
H -2.863639 2.037442 -3.146072
H -4.528397 3.184720 -1.695083


%chk=000291705-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291705

0 1
Br 2.806002 -3.905754 1.132166
O -1.381022 -1.314808 0.379590
O 3.727090 -1.755882 -1.874945
O -0.237123 -1.597083 -1.672002
N 0.870682 -0.991138 0.297417
C 2.156417 -0.724709 -0.352457
C 3.178339 -0.132013 0.673069
C 2.673137 1.139938 1.338483
C 2.792193 -1.947431 -1.054639
C 2.562116 2.349068 0.603378
C 2.288272 1.136319 2.703724
C 2.309307 -3.363122 -0.766434
C -0.244933 -1.313366 -0.439330
C 2.075882 3.523338 1.216926
C 1.800000 2.311081 3.321967
C -2.682490 -1.605368 -0.321750
C 1.690348 3.507592 2.578880
C -3.325777 -0.341588 -0.849381
C -4.250231 0.379924 -0.052044
C -3.012739 0.134384 -2.149347
C -4.850540 1.561578 -0.540932
C -3.612365 1.315691 -2.638799
C -4.532352 2.031434 -1.836644
H 2.014824 0.018260 -1.163727
H 3.406923 -0.899801 1.434280
H 4.106933 0.058629 0.105883
H 0.738519 -0.720727 1.274262
H 2.865540 2.371869 -0.451089
H 2.389362 0.213973 3.290942
H 2.832324 -4.075083 -1.419206
H 1.218163 -3.465330 -0.829114
H 1.999269 4.450150 0.637522
H 1.510106 2.291821 4.378435
H -3.284809 -2.075894 0.470839
H -2.473396 -2.325980 -1.131060
H 1.312872 4.419423 3.054631
H -4.496899 0.015952 0.953111
H -2.289961 -0.418617 -2.759676
H -5.564891 2.111312 0.082053
H -3.365823 1.676200 -3.643675
H -4.999568 2.946256 -2.218606


