%chk=000285920.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285920

0 1
Br -2.051306 -4.290613 -1.092167
Br 2.061028 -4.284731 1.088868
O -0.237467 -0.072828 2.153057
O 0.233766 -0.070295 -2.152926
C -0.721770 -1.468787 0.272187
C 0.722335 -1.466239 -0.273112
C -0.981596 -2.734471 1.105758
C 0.986163 -2.730368 -1.107778
C -0.679927 -4.012559 0.335399
C 0.688673 -4.010053 -0.338461
C -0.937938 -0.245204 1.174838
C 0.934583 -0.241184 -1.174725
C -2.033459 0.691145 0.816811
C 2.027126 0.698359 -0.815778
C -2.399421 0.936096 -0.516091
C 2.391310 0.944315 0.517379
C -2.695049 1.373391 1.852441
C 2.687643 1.382469 -1.850891
C -3.425220 1.833537 -0.807592
C 3.413262 1.845900 0.809824
C -3.728040 2.262996 1.563262
C 3.716844 2.276114 -1.560769
C -4.102579 2.498528 0.229221
C 4.087469 2.515180 -0.226229
C -5.196685 3.463347 -0.086746
C 5.196578 3.462992 0.089026
H -1.432247 -1.449068 -0.595769
H 1.432740 -1.444978 0.594840
H -0.347466 -2.707856 2.025314
H -2.030075 -2.737420 1.470429
H 0.351832 -2.705018 -2.027244
H 2.034581 -2.729648 -1.472583
H -0.808144 -4.904513 0.995221
H 0.819828 -4.901077 -0.998959
H -1.869183 0.436260 -1.336250
H 1.862614 0.442117 1.337108
H -2.388451 1.201587 2.887457
H 2.383061 1.209015 -2.886218
H -3.697567 2.021477 -1.844899
H 3.685699 2.032678 1.847308
H -4.239140 2.780770 2.372328
H 4.228747 2.793521 -2.369564
H -5.748615 3.187539 -0.995992
H -5.934092 3.544447 0.723335
H -4.787224 4.472212 -0.252510
H 5.308632 4.247805 -0.671467
H 5.052057 3.970550 1.052955
H 6.158090 2.929563 0.146855


%chk=000285920-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285920

0 1
Br -2.063408 -4.602164 -1.178358
Br 2.077322 -4.595002 1.173118
O -0.359418 -0.425717 2.281497
O 0.357686 -0.422336 -2.282241
C -0.740317 -1.690780 0.256905
C 0.741975 -1.687152 -0.257932
C -1.022215 -2.976408 1.078993
C 1.029164 -2.970389 -1.081880
C -0.680318 -4.268534 0.336714
C 0.692862 -4.265055 -0.341510
C -0.982190 -0.475541 1.172623
C 0.978126 -0.469519 -1.172017
C -1.933083 0.607128 0.779691
C 1.923250 0.617329 -0.776469
C -2.459016 0.746572 -0.534647
C 2.440532 0.762063 0.540679
C -2.312614 1.556925 1.770200
C 2.300655 1.569292 -1.765741
C -3.341029 1.802640 -0.838717
C 3.313551 1.824693 0.848380
C -3.200587 2.600598 1.460822
C 3.179962 2.619088 -1.452804
C -3.730524 2.745076 0.148619
C 3.707875 2.764178 -0.139753
C -4.662906 3.891075 -0.194376
C 4.679938 3.880551 0.190407
H -1.406504 -1.670363 -0.621676
H 1.408510 -1.664691 0.620376
H -0.408014 -2.943714 2.000988
H -2.080221 -3.002752 1.394812
H 0.414648 -2.938944 -2.003702
H 2.087187 -2.991784 -1.397995
H -0.825893 -5.160214 0.964038
H 0.842290 -5.155166 -0.970157
H -2.163631 0.056711 -1.331511
H 2.139095 0.075729 1.338391
H -1.895518 1.446194 2.776605
H 1.883248 1.459245 -2.772102
H -3.731309 1.900768 -1.858544
H 3.691162 1.931218 1.872070
H -3.492435 3.315942 2.239116
H 3.464873 3.340312 -2.228249
H -5.376692 3.609793 -0.988158
H -5.238249 4.225034 0.686517
H -4.090355 4.764602 -0.563386
H 4.515320 4.765122 -0.449222
H 4.593970 4.194888 1.245122
H 5.725243 3.550460 0.030964


