%chk=000187224.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187224

0 1
Br 6.559504 0.005319 -0.032328
O -3.102987 -2.545544 -0.398068
N -0.398828 -1.045615 -0.166472
N -0.354779 1.221118 0.188346
N -2.842379 1.544259 0.209178
N -4.137167 -0.500704 -0.107782
N -5.234250 1.544283 0.372851
C -1.726368 -0.619472 -0.107302
C 0.405136 0.086439 0.018361
C -1.670744 0.781483 0.111195
C 1.869868 0.053643 0.017825
C -2.998627 -1.355911 -0.218637
C -4.059508 0.801627 0.127309
C 2.577176 1.149434 -0.506703
C 2.565843 -1.047621 0.544635
C 3.974073 1.137584 -0.521438
C 3.962546 -1.062856 0.529611
C 4.650512 0.029008 -0.006943
H -0.114489 -1.996956 -0.331918
H -2.790928 2.521063 0.489499
H 2.029650 2.013521 -0.894889
H 2.027579 -1.887860 0.982732
H 4.522427 1.989076 -0.929843
H 4.503532 -1.918749 0.938174
H -5.292476 2.472207 -0.026910
H -6.099619 1.013223 0.254518


%chk=000187224-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187224

0 1
Br 6.629955 0.085181 -0.092881
O -3.111445 -2.615422 0.402478
N -0.439203 -1.061530 0.171377
N -0.369606 1.198548 -0.093232
N -2.839893 1.516412 -0.083608
N -4.166091 -0.503204 0.175267
N -5.209586 1.572580 -0.047538
C -1.766254 -0.631981 0.146082
C 0.382401 0.054959 0.026058
C -1.674335 0.759072 -0.017416
C 1.845697 0.025977 0.001951
C -3.030982 -1.357105 0.254057
C -4.055781 0.816361 0.019464
C 2.552426 1.252719 -0.134400
C 2.587354 -1.182565 0.108949
C 3.959693 1.276973 -0.162655
C 3.996967 -1.170736 0.081691
C 4.670049 0.061701 -0.053898
H -0.164244 -2.036780 0.283099
H -2.783999 2.528765 -0.203942
H 1.977699 2.179776 -0.217056
H 2.082997 -2.150397 0.213162
H 4.494702 2.224915 -0.267303
H 4.559591 -2.104708 0.164009
H -5.217968 2.581610 -0.167315
H -6.085446 1.060875 0.028602


