%chk=000207190.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207190

0 1
Br -6.883157 -2.863738 0.300555
O 6.538422 -1.502194 0.069189
O 1.554798 2.828403 -0.277479
N 3.761534 -0.861275 -0.089147
N 0.424797 0.849468 -0.454473
N -0.684553 0.092154 -0.369278
C 2.459088 -0.311115 0.402969
C 4.806720 0.213416 -0.157469
C 4.242404 -1.986811 0.777361
C 1.669544 0.119091 -0.852403
C 6.091739 -0.394004 -0.740144
C 5.543544 -2.540479 0.172301
C 0.482923 2.261120 -0.172767
C -0.812862 2.857774 0.218953
C -1.831448 0.668883 -0.018834
C -1.925108 2.082068 0.290329
C -3.036059 -0.189208 0.050937
C -0.790718 4.312855 0.518020
C -4.214984 0.214100 -0.597817
C -3.004148 -1.398928 0.762663
C -5.360972 -0.581367 -0.526089
C -4.148323 -2.198268 0.837913
C -5.314061 -1.777369 0.194794
H 2.574950 0.546976 1.100721
H 1.884792 -1.087505 0.952177
H 5.021878 0.671579 0.832313
H 4.434713 1.027233 -0.817257
H 3.465896 -2.781061 0.786032
H 4.419076 -1.679256 1.830293
H 1.411059 -0.769147 -1.472571
H 2.278542 0.805553 -1.488049
H 5.947749 -0.742629 -1.777878
H 6.946791 0.301769 -0.682203
H 6.033102 -3.274085 0.835971
H 5.374736 -2.977091 -0.828035
H -2.894442 2.486738 0.584421
H -0.442033 4.891071 -0.354813
H -0.082122 4.540081 1.332631
H -1.771606 4.707853 0.809735
H -4.236554 1.142686 -1.168251
H -2.082540 -1.719001 1.251347
H -6.275919 -0.268436 -1.031577
H -4.122084 -3.138102 1.391807


%chk=000207190-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207190

0 1
Br -6.663336 -3.206672 0.515652
O 6.481611 -1.675123 0.396745
O 1.579993 3.033451 -0.563309
N 3.713980 -0.851515 0.097960
N 0.457649 0.968076 -0.599397
N -0.633841 0.153915 -0.439427
C 2.425367 -0.198655 0.407931
C 4.829261 0.113443 -0.094670
C 4.103218 -1.899386 1.076891
C 1.723367 0.258622 -0.894805
C 6.088864 -0.631154 -0.565935
C 5.368455 -2.620655 0.582848
C 0.489426 2.389324 -0.434564
C -0.817696 2.989697 -0.128978
C -1.814151 0.735536 -0.132256
C -1.922418 2.167613 0.018062
C -2.972471 -0.184849 0.025500
C -0.854247 4.487918 0.006819
C -4.189897 0.241659 0.621318
C -2.876950 -1.533561 -0.416968
C -5.281056 -0.641851 0.769013
C -3.955859 -2.427206 -0.275896
C -5.152935 -1.969951 0.316689
H 2.545986 0.679090 1.086652
H 1.767678 -0.927575 0.916979
H 5.057129 0.657468 0.855864
H 4.542758 0.867002 -0.850776
H 3.277497 -2.629563 1.171584
H 4.303720 -1.467662 2.089485
H 1.486375 -0.617616 -1.516449
H 2.365994 0.958147 -1.451888
H 5.899062 -1.090896 -1.559794
H 6.953273 0.050111 -0.629610
H 5.725527 -3.354451 1.324324
H 5.148298 -3.133844 -0.378236
H -2.897309 2.616598 0.231496
H -0.484952 4.967631 -0.918348
H -0.168673 4.819115 0.808504
H -1.870829 4.854642 0.225033
H -4.302172 1.263293 0.997809
H -1.942526 -1.870772 -0.873934
H -6.209847 -0.299653 1.233873
H -3.868216 -3.459940 -0.624893


