%chk=000297719.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297719

0 1
Br 2.051029 -1.006954 0.575194
Br 5.378756 -1.853011 -0.067489
O 0.077141 1.270467 -1.420664
N -0.425173 0.340778 0.658610
N 1.506269 1.725245 0.346059
C -1.784280 -0.056306 0.340354
C -2.782265 0.896038 0.033674
C -2.085357 -1.437505 0.366563
C -4.085860 0.449469 -0.231004
C -3.400346 -1.848637 0.105513
C -4.391021 -0.911214 -0.191955
C -2.473899 2.354243 -0.032889
C -1.034925 -2.460850 0.651479
C 0.332051 1.123410 -0.243384
C 2.762757 1.541776 -0.407425
C 3.366791 0.179375 -0.139570
C 4.629717 -0.147790 -0.384595
H -4.863427 1.171111 -0.474205
H -3.648422 -2.908026 0.124452
H -0.243659 0.393826 1.662595
H -5.407383 -1.244879 -0.398972
H -1.912718 2.706898 0.840986
H -1.858410 2.570844 -0.928067
H -3.374904 2.975729 -0.110458
H -0.312399 -2.503291 -0.181310
H -0.479589 -2.239381 1.571756
H -1.449199 -3.471533 0.763284
H 1.629438 1.655449 1.359423
H 2.552963 1.651166 -1.506230
H 3.467974 2.358787 -0.127769
H 5.359650 0.549966 -0.800456


%chk=000297719-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297719

0 1
Br 3.519222 -1.524622 -1.065010
Br 6.757465 -0.413214 -0.051258
O 0.084849 0.970533 -1.472913
N -0.565588 0.124615 0.634982
N 1.631824 0.861110 0.279622
C -1.957146 -0.107568 0.361430
C -2.811564 0.958321 -0.045860
C -2.460700 -1.427931 0.565771
C -4.179354 0.662624 -0.272722
C -3.836299 -1.672126 0.348977
C -4.694311 -0.635784 -0.078668
C -2.303901 2.374739 -0.216708
C -1.536046 -2.554715 0.994761
C 0.353976 0.670360 -0.273433
C 2.752506 1.265697 -0.565528
C 3.929539 0.302114 -0.508711
C 5.168216 0.687473 -0.118561
H -4.846183 1.472564 -0.590973
H -4.229556 -2.684080 0.501038
H -0.181416 -0.364407 1.447004
H -5.756611 -0.838103 -0.253839
H -1.610076 2.654526 0.598039
H -1.740220 2.475384 -1.162175
H -3.140946 3.093431 -0.223547
H -0.649288 -2.623132 0.336634
H -1.167346 -2.427836 2.033991
H -2.060546 -3.523979 0.959666
H 1.794895 0.729649 1.278539
H 2.349365 1.327817 -1.594078
H 3.120416 2.274996 -0.290247
H 5.366123 1.716745 0.197280


