%chk=000184652.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184652

0 1
Br -4.698310 -2.603130 -1.249651
Br -3.569537 -1.480610 1.494525
O 0.287274 1.986342 -0.261428
O -0.256844 3.637871 -1.705559
O 2.603203 -2.388689 0.316300
N 1.866319 3.737476 2.093733
C -2.718603 1.891029 0.346039
C -2.148734 0.668041 -0.376006
C -1.953283 2.053835 -0.994131
C -4.204567 2.141598 0.315464
C -2.056422 2.326502 1.625945
C -3.016475 -0.321748 -1.050262
C -0.619242 2.682102 -1.066375
C -3.651065 -1.287629 -0.384452
C 1.658423 2.479443 -0.198663
C 2.566535 1.268182 -0.259507
C 1.780505 3.183338 1.085747
C 2.068245 -0.001650 0.047937
C 3.907855 1.447424 -0.619785
C 2.947162 -1.088063 -0.023087
C 4.767010 0.341071 -0.669469
C 4.299761 -0.938496 -0.377109
C 1.253349 -2.774431 0.269323
C 0.451143 -2.533378 -0.850890
C 0.816362 -3.513956 1.374785
C -0.841688 -3.063836 -0.854360
C -0.480724 -4.031630 1.343455
C -1.308431 -3.804927 0.237244
H -1.253160 0.190757 0.072450
H -2.551727 2.324160 -1.881452
H -4.435155 3.202590 0.481820
H -4.710569 1.567009 1.106546
H -4.673273 1.852375 -0.633131
H -2.462020 1.774387 2.485604
H -2.211336 3.396149 1.821097
H -0.967916 2.154965 1.625805
H -3.086772 -0.230542 -2.141575
H 1.833170 3.187557 -1.058280
H 1.025661 -0.130691 0.340454
H 4.292300 2.437634 -0.855818
H 5.813387 0.483871 -0.944112
H 4.949984 -1.810799 -0.411760
H 0.830777 -1.963996 -1.695625
H 1.480098 -3.677532 2.220932
H -1.490491 -2.901356 -1.715500
H -0.850230 -4.611706 2.189108
H -2.323247 -4.203013 0.226974


%chk=000184652-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184652

0 1
Br -4.833936 -0.759038 -3.770025
Br -2.710838 -1.788014 -1.495603
O -0.036131 1.914291 0.347292
O 0.363171 3.740945 -1.059025
O 2.998557 -2.769910 -0.147974
N 1.512760 1.559329 3.350930
C -3.053322 2.725448 0.101864
C -2.692055 1.489335 -0.745175
C -1.879130 2.815571 -0.925773
C -4.292928 3.549923 -0.248131
C -2.771101 2.661072 1.601262
C -3.537524 1.006661 -1.859988
C -0.438582 2.902137 -0.582223
C -3.659866 -0.276554 -2.284367
C 1.434650 1.938297 0.714934
C 2.187043 0.895470 -0.095973
C 1.471979 1.720824 2.170602
C 2.207647 -0.459941 0.308699
C 2.837698 1.300763 -1.287031
C 2.869936 -1.408623 -0.500821
C 3.512758 0.340133 -2.072622
C 3.531179 -1.016317 -1.687284
C 1.988590 -3.435826 0.601165
C 0.609155 -3.208886 0.388059
C 2.438510 -4.422707 1.503502
C -0.328165 -3.979773 1.111232
C 1.488732 -5.189849 2.213356
C 0.103983 -4.969481 2.024759
H -2.141934 0.715525 -0.201321
H -2.101845 3.412095 -1.816350
H -4.215034 4.557125 0.199721
H -5.201438 3.066691 0.157138
H -4.433861 3.682733 -1.335006
H -3.642601 2.223297 2.122389
H -2.607375 3.675521 2.010977
H -1.886572 2.048920 1.835967
H -4.132321 1.751981 -2.404548
H 1.810246 2.951906 0.474392
H 1.725597 -0.768765 1.242289
H 2.802986 2.350360 -1.597587
H 4.022565 0.647435 -2.991382
H 4.046204 -1.776845 -2.281370
H 0.274076 -2.456085 -0.332857
H 3.514061 -4.574798 1.633315
H -1.399644 -3.809057 0.955059
H 1.832130 -5.956364 2.916448
H -0.629310 -5.563054 2.580382


