%chk=000209230.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209230

0 1
Br 2.124312 -3.049877 0.093836
N -1.240163 -0.482344 -0.143183
C -2.650505 -0.745183 0.284204
C -3.550651 0.387902 -0.232870
C -0.331614 -1.602178 0.257877
C 1.015852 -1.474002 -0.463107
C -4.991609 0.219712 0.266320
C 1.822986 -0.237934 -0.203897
C -5.896756 1.336720 -0.247567
C 2.951376 -0.001246 -1.013838
C 1.497089 0.679173 0.803659
C 3.732125 1.136804 -0.817261
C 2.284135 1.820594 0.995971
C 3.400008 2.052007 0.189728
H -2.668483 -0.765496 1.397069
H -3.036039 -1.729523 -0.059549
H -3.535095 0.420537 -1.338806
H -3.144053 1.365411 0.099061
H -0.191385 -1.537841 1.363499
H -0.767831 -2.608773 0.059046
H 0.878915 -1.620517 -1.561631
H -1.204243 -0.346614 -1.159505
H -5.007768 0.207707 1.374268
H -5.392227 -0.762107 -0.053917
H -6.922719 1.214794 0.117968
H -5.547457 2.322746 0.080761
H -5.938632 1.353220 -1.342611
H 3.225237 -0.716755 -1.788610
H 0.617406 0.521682 1.430639
H 4.603726 1.312862 -1.445194
H 2.020434 2.529408 1.779292
H 4.011432 2.939112 0.342249


%chk=000209230-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209230

0 1
Br 2.642880 -3.052065 0.086627
N -1.363152 -1.659224 -0.561118
C -2.073740 -0.653814 0.251910
C -3.151610 0.069206 -0.578970
C -0.222148 -2.371314 0.030222
C 1.094421 -1.763688 -0.515138
C -3.956342 1.095364 0.250210
C 1.427777 -0.356768 -0.090258
C -5.030505 1.825545 -0.584237
C 1.749452 0.613563 -1.073406
C 1.417279 0.032320 1.276121
C 2.040287 1.946412 -0.705154
C 1.713294 1.360061 1.646940
C 2.022829 2.324018 0.656691
H -1.337048 0.086387 0.616647
H -2.550160 -1.106727 1.158210
H -3.852424 -0.679552 -1.008312
H -2.661948 0.572738 -1.435278
H -0.230737 -2.329586 1.139175
H -0.245952 -3.440472 -0.248301
H 1.124584 -1.871907 -1.610109
H -1.986841 -2.249963 -1.117470
H -3.257798 1.837745 0.686740
H -4.438743 0.579821 1.105692
H -5.590425 2.556081 0.027930
H -4.571249 2.372940 -1.428744
H -5.760277 1.109024 -1.006655
H 1.766308 0.321907 -2.130329
H 1.203775 -0.713380 2.050648
H 2.282411 2.685345 -1.477068
H 1.709376 1.644591 2.705113
H 2.254228 3.355392 0.945572


