%chk=000296221.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296221

0 1
Br 2.850897 1.977850 -1.677109
O -1.062665 -2.138636 1.456590
N 2.923004 -1.038812 1.173479
N 4.587885 0.267822 0.133910
C 0.579764 -0.678885 0.614377
C -1.913646 -0.227484 0.345039
C -0.815448 -1.109319 0.860405
C 0.923346 0.325517 -0.305277
C -2.003873 1.108975 0.756419
C -2.874941 -0.767540 -0.518770
C 1.619653 -1.337133 1.319893
C 2.259967 0.650401 -0.478423
C 3.259535 -0.037392 0.271207
C -3.051635 1.907833 0.291206
C -3.915975 0.038840 -0.988783
C -4.004292 1.374707 -0.584458
H 0.147319 0.840849 -0.881723
H -1.264863 1.520963 1.443733
H -2.812942 -1.815716 -0.815013
H 1.377452 -2.143111 2.035411
H -3.127743 2.945464 0.612616
H -4.661957 -0.377444 -1.664286
H -4.818603 2.000484 -0.947983
H 4.924819 0.959346 -0.515721
H 5.277941 -0.244177 0.666761


%chk=000296221-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296221

0 1
Br 3.060592 2.155920 -1.607342
O -1.019947 -2.372127 0.853443
N 2.932672 -1.016308 1.216045
N 4.704976 0.288427 0.428465
C 0.626289 -0.677905 0.452096
C -1.925264 -0.251842 0.161767
C -0.783504 -1.168465 0.507646
C 1.070746 0.380888 -0.393813
C -1.886624 1.149967 0.395743
C -3.116936 -0.836056 -0.346476
C 1.620168 -1.343093 1.223024
C 2.426374 0.716563 -0.417514
C 3.362251 0.008583 0.402002
C -3.014852 1.950664 0.112465
C -4.235821 -0.033596 -0.644620
C -4.187129 1.363623 -0.417712
H 0.365602 0.904630 -1.044847
H -0.994734 1.608478 0.836393
H -3.142285 -1.921172 -0.491405
H 1.326859 -2.175537 1.870565
H -2.981990 3.027626 0.310389
H -5.145637 -0.491759 -1.047446
H -5.059203 1.987545 -0.643320
H 5.105488 1.023827 -0.149405
H 5.294909 -0.275479 1.037357


