%chk=000189882.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189882

0 1
Br -0.804990 -2.607630 1.558420
Br -1.190337 2.738770 -0.493345
Br 3.843658 -0.033921 -0.085907
O -2.749783 -0.082811 1.921903
O -4.830287 -0.292787 -2.246162
O 1.553455 2.584840 -2.106931
O 2.710154 3.153359 -0.266273
O 2.682856 -2.732665 -1.176308
N -3.035404 0.711844 -0.223055
N 2.073492 -2.215186 0.974954
C -0.804866 0.108718 0.532645
C 1.328637 -1.053229 0.631025
C -0.062274 -1.027076 0.846450
C 1.232645 1.213772 -0.240469
C -0.150818 1.218095 -0.027377
C 1.973223 0.076154 0.100610
C -2.282496 0.178750 0.831729
C -4.510825 0.766889 -0.073673
C -5.195152 -0.359956 -0.862071
C 1.929637 2.409368 -0.801124
C 2.742724 -3.007698 0.000281
C 3.487630 -4.167914 0.588309
H -4.845373 1.765867 -0.433809
H -4.788150 0.706459 1.008198
H -2.732624 0.569012 -1.195301
H 2.025909 -2.512811 1.951998
H -6.293171 -0.323478 -0.757773
H -4.830953 -1.363650 -0.562917
H 4.251274 -3.854642 1.314081
H 4.013193 -4.717972 -0.211940
H 2.822820 -4.888287 1.084573
H -5.220852 0.498048 -2.669399
H 1.999149 3.371867 -2.530544


%chk=000189882-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189882

0 1
Br -1.039039 -2.357099 1.561683
Br -0.993314 3.103737 -0.437440
Br 3.950662 0.129310 -0.100582
O -2.618404 0.816054 2.083946
O -4.778286 -0.448223 -2.308755
O 2.139817 2.544406 -2.161645
O 2.606285 3.461725 -0.074089
O 2.684039 -2.669333 -1.282617
N -3.121261 0.265015 -0.126010
N 1.995389 -2.174865 0.897863
C -0.779683 0.364560 0.550860
C 1.327508 -0.958657 0.596644
C -0.068109 -0.821960 0.832021
C 1.335705 1.367449 -0.245187
C -0.055342 1.442399 -0.008393
C 2.018275 0.173321 0.083385
C -2.254325 0.504665 0.911119
C -4.577049 0.382986 0.021169
C -5.266659 -0.611925 -0.924601
C 2.092121 2.564530 -0.769606
C 2.634975 -2.983437 -0.065392
C 3.281583 -4.237911 0.509427
H -4.901482 1.421085 -0.205586
H -4.837020 0.181007 1.075600
H -2.773883 0.036361 -1.063134
H 1.831304 -2.579713 1.822979
H -6.367426 -0.498241 -0.865611
H -4.994923 -1.646536 -0.660975
H 4.333697 -4.019029 0.769680
H 3.279406 -5.024085 -0.260641
H 2.773409 -4.612028 1.415901
H -5.162131 0.377207 -2.699972
H 2.646263 3.337324 -2.491245


