%chk=000184884.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184884

0 1
Br -5.540598 2.140460 0.072109
N -0.295827 0.898284 0.003480
N 2.532988 1.709189 -0.026749
N 2.198708 -1.907414 -0.037871
C 4.290860 0.094246 -0.057015
C 0.390328 -0.327770 -0.009748
C 2.810077 0.434309 -0.036231
C 4.967262 1.480893 -0.059506
C 1.774731 -0.615686 -0.027688
C -0.568507 -1.411079 -0.002472
C 3.791507 2.497333 -0.039411
C -1.881674 -0.797965 0.015909
C -1.675829 0.628668 0.019181
C -0.104438 -2.721385 -0.013246
C -3.182586 -1.308170 0.029586
C -2.754777 1.528963 0.035893
C 1.287948 -2.916141 -0.030806
C -4.256480 -0.420985 0.046181
C -4.023882 0.967677 0.048989
H 4.571842 -0.519542 0.817681
H 4.549012 -0.511600 -0.944174
H 5.622549 1.610378 0.815933
H 5.599319 1.618500 -0.950673
H 3.817949 3.150852 0.855536
H 3.794732 3.159313 -0.928482
H 0.154104 1.807046 0.002039
H -0.790124 -3.564686 -0.008328
H -3.349686 -2.384716 0.027242
H -2.592558 2.604493 0.038285
H 1.712408 -3.927044 -0.039836
H -5.277458 -0.803320 0.056991


%chk=000184884-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184884

0 1
Br -5.441501 2.338041 0.074788
N -0.211028 0.804867 0.000406
N 2.421186 1.633566 -0.028215
N 2.244213 -2.018757 -0.040056
C 4.305064 0.129015 -0.055721
C 0.420109 -0.432022 -0.012059
C 2.802528 0.366664 -0.037424
C 4.888115 1.576435 -0.055797
C 1.809807 -0.718408 -0.029901
C -0.563165 -1.479169 -0.003773
C 3.628193 2.511571 -0.039098
C -1.861173 -0.814382 0.015234
C -1.597192 0.605396 0.017410
C -0.093088 -2.811405 -0.014591
C -3.199416 -1.269623 0.030590
C -2.636521 1.560052 0.034627
C 1.309180 -3.019377 -0.032539
C -4.252272 -0.330952 0.047951
C -3.950062 1.056857 0.049689
H 4.610210 -0.470443 0.820165
H 4.589954 -0.462516 -0.943739
H 5.523880 1.752718 0.827831
H 5.505933 1.760019 -0.950618
H 3.594644 3.167348 0.851339
H 3.574882 3.172403 -0.924820
H 0.370345 1.659393 -0.003961
H -0.772546 -3.669463 -0.009431
H -3.430794 -2.339899 0.029311
H -2.436935 2.634326 0.036400
H 1.713246 -4.037384 -0.041323
H -5.293898 -0.661770 0.060125


