%chk=000202507.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202507

0 1
Br 5.670028 0.429348 1.038685
O -0.731904 -1.579367 0.430664
O -2.751627 -1.934844 -0.645739
N -2.184207 -3.031659 1.320918
C -0.306181 -0.459000 -0.443514
C 1.159796 -0.261679 -0.056296
C -1.181173 0.740735 -0.115542
C 1.916706 0.687261 -0.762639
C 1.750289 -1.001973 0.974293
C -2.387050 0.940324 -0.804561
C -0.805736 1.636570 0.896299
C -0.382802 -0.883044 -1.833802
C 3.259164 0.895526 -0.439773
C 3.095136 -0.800234 1.303618
C -3.193950 2.040236 -0.502690
C -1.615892 2.734951 1.196275
C 3.832035 0.146805 0.591948
C -2.807956 2.941123 0.494541
C -1.978134 -2.160516 0.257272
C -0.427970 -1.242959 -2.982355
H 1.455790 1.265417 -1.565788
H 1.159776 -1.740795 1.522131
H -2.708812 0.217257 -1.562392
H 0.116999 1.481043 1.456772
H 3.845910 1.632779 -0.989657
H 3.552787 -1.380075 2.106136
H -4.128097 2.189213 -1.042151
H -1.318128 3.429034 1.980235
H -3.437014 3.798648 0.728396
H -0.474881 -1.553395 -3.968364
H -1.442848 -3.236075 1.971194
H -2.942452 -3.695552 1.263985


%chk=000202507-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202507

0 1
Br 5.815557 0.551239 0.706912
O -0.727254 -1.588571 0.673091
O -2.880308 -1.854482 -0.301030
N -2.229575 -2.969987 1.657768
C -0.331069 -0.541131 -0.350408
C 1.158441 -0.262962 -0.028422
C -1.215858 0.702866 -0.154908
C 1.738275 0.972317 -0.403336
C 1.976969 -1.261455 0.549748
C -2.074126 1.185444 -1.167637
C -1.171137 1.367298 1.097408
C -0.395386 -1.118650 -1.709268
C 3.112258 1.220182 -0.192208
C 3.351668 -1.026257 0.774708
C -2.872689 2.328048 -0.936987
C -1.975130 2.501743 1.330785
C 3.903418 0.214816 0.399003
C -2.826915 2.989208 0.310946
C -2.043352 -2.116618 0.589974
C -0.359464 -1.598197 -2.841831
H 1.119524 1.752558 -0.858028
H 1.537212 -2.220573 0.833391
H -2.129678 0.655773 -2.123572
H -0.508055 0.991626 1.884893
H 3.552412 2.178288 -0.482142
H 3.978096 -1.799015 1.229248
H -3.537642 2.693632 -1.727159
H -1.936998 3.006714 2.302353
H -3.450314 3.872491 0.489813
H -0.352160 -2.025182 -3.827717
H -1.496816 -3.108418 2.349053
H -3.122303 -3.447643 1.743660


