%chk=000249942.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249942

0 1
Br 7.181681 -0.205973 1.841775
Br 7.069779 -3.035561 -0.075937
C -1.292107 0.094365 -0.351562
C -2.630872 0.618148 0.185681
C -0.118024 0.956538 0.131612
C -3.804974 -0.244120 -0.297308
C 1.220469 0.432792 -0.406296
C -5.143827 0.279762 0.239615
C 2.394533 1.294543 0.077649
C -6.318069 -0.582338 -0.243342
C 3.731916 0.770906 -0.462455
C -7.656661 -0.058327 0.293476
C 4.904850 1.629735 0.026160
C -8.832258 -0.919952 -0.188752
C 6.253616 1.144944 -0.528641
C -10.167308 -0.402951 0.342784
C 6.633040 -0.201979 0.002736
C 6.598910 -1.320899 -0.717558
H -1.313398 0.072885 -1.458178
H -1.144027 -0.955583 -0.032860
H -2.609961 0.638867 1.292418
H -2.779425 1.668047 -0.132388
H -0.266931 2.006621 -0.185605
H -0.096910 0.976268 1.238459
H -3.656877 -1.293963 0.021452
H -3.826006 -0.265663 -1.403938
H 1.198617 0.411446 -1.512841
H 1.368389 -0.617428 -0.087498
H -5.123141 0.300838 1.346321
H -5.292234 1.329631 -0.078676
H 2.416340 1.310483 1.184936
H 2.244319 2.345333 -0.236472
H -6.338859 -0.603731 -1.349987
H -6.169902 -1.632150 0.075381
H 3.709593 0.751125 -1.568658
H 3.879470 -0.280715 -0.143881
H -7.806399 0.991330 -0.024349
H -7.637438 -0.036479 1.400015
H 4.931718 1.636303 1.135233
H 4.752385 2.685045 -0.275128
H -8.684672 -1.970222 0.130528
H -8.853975 -0.940988 -1.295923
H 7.044452 1.887460 -0.278940
H 6.217264 1.127463 -1.639848
H -10.362751 0.623660 0.012851
H -10.193456 -0.404988 1.438389
H -10.999767 -1.023899 -0.006352
H 6.288287 -1.348326 -1.762698


%chk=000249942-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249942

0 1
Br 7.121637 -0.310381 1.922313
Br 7.485446 -3.070888 -0.284266
C -1.306564 0.080758 -0.321071
C -2.668573 0.606478 0.185674
C -0.108965 0.945450 0.132881
C -3.867473 -0.254921 -0.271200
C 1.253156 0.421576 -0.375437
C -5.229172 0.272185 0.235035
C 2.448554 1.291562 0.074079
C -6.429066 -0.587210 -0.223438
C 3.810620 0.765685 -0.432526
C -7.790592 -0.059467 0.282725
C 4.994844 1.648958 0.014964
C -8.990938 -0.918224 -0.177201
C 6.374861 1.164616 -0.509077
C -10.346849 -0.382158 0.331586
C 6.793811 -0.205718 -0.012752
C 6.949562 -1.284787 -0.815206
H -1.323249 0.031512 -1.430187
H -1.161189 -0.961225 0.033402
H -2.652958 0.653268 1.294863
H -2.812466 1.649583 -0.166580
H -0.255818 1.987745 -0.220603
H -0.091612 0.993560 1.241924
H -3.724442 -1.297940 0.081413
H -3.882938 -0.302113 -1.380430
H 1.234066 0.369125 -1.484358
H 1.402524 -0.618578 -0.017853
H -5.214302 0.317998 1.344294
H -5.371372 1.315835 -0.116260
H 2.467312 1.343154 1.182797
H 2.298547 2.332094 -0.283436
H -6.444062 -0.633026 -1.332771
H -6.287342 -1.630899 0.127923
H 3.791388 0.708078 -1.541657
H 3.961987 -0.270314 -0.068345
H -7.933529 0.984365 -0.067887
H -7.777638 -0.014587 1.392080
H 5.024029 1.703579 1.120575
H 4.842308 2.685009 -0.348824
H -8.848430 -1.960673 0.174114
H -9.002282 -0.963221 -1.285560
H 7.153736 1.897329 -0.220454
H 6.352042 1.132130 -1.616935
H -10.526619 0.647533 -0.031593
H -10.372371 -0.355680 1.437512
H -11.187850 -1.012998 -0.010921
H 6.767630 -1.215853 -1.891927


