%chk=000142478.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000142478

0 1
 Br  -5.888100     -0.5444000     -0.6917000    
 N   0.6501000     -0.1480000      7.6300003E-02
 N  -9.3999997E-02  0.5748000      0.7653000    
 N    2.444500       2.645500     -0.1507000    
 C    2.967800     -0.8452000     -0.4981000    
 C    2.068400      9.0300001E-02  0.3950000    
 C    4.472200     -0.5523000     -0.2907000    
 C    2.665900     -0.6488000      -2.004700    
 C    2.738900      -2.337700     -0.1648000    
 C    2.242700     -0.1152000       1.907600    
 C    2.278000       1.521600      8.7099999E-02
 C   -1.433000      0.3156000      0.4281000    
 C   -2.139700     -0.6700000       1.110900    
 C   -2.044100       1.047000     -0.5860000    
 C   -3.469300     -0.9268000      0.7763000    
 C   -3.373800      0.7903000     -0.9205000    
 C   -4.086400     -0.1967000     -0.2394000    
 H    5.087500      -1.194000     -0.9330000    
 H    4.724600      0.4843000     -0.5372000    
 H    4.786000     -0.7415000      0.7405000    
 H    1.623100     -0.8863000      -2.241300    
 H    2.860900      0.3787000      -2.329000    
 H    3.293100      -1.304900      -2.620000    
 H    3.041700      -2.575300      0.8601000    
 H    1.686100      -2.616700     -0.2809000    
 H    3.323600      -2.984400     -0.8298000    
 H    3.289100     -7.8999996E-03   2.211500    
 H    1.684200      0.6188000       2.502900    
 H    1.898300      -1.106100       2.223000    
 H   -1.666600      -1.242800       1.904100    
 H   -1.496400       1.818200      -1.121100    
 H   -4.010400      -1.699100       1.317100    
 H   -3.839900       1.368500      -1.714200    


%chk=000142478-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000142478

0 1
Br -6.168720 -0.428401 -0.399708
N 0.709934 -0.293410 0.361868
N -0.084469 0.678106 0.050168
N 2.657635 2.591850 -0.404097
C 3.020495 -0.940930 -0.353175
C 2.162031 0.112553 0.488673
C 4.522759 -0.556009 -0.315430
C 2.524164 -0.920127 -1.824340
C 2.837793 -2.367148 0.229398
C 2.451343 0.078378 2.018891
C 2.417636 1.490264 -0.014793
C -1.479823 0.324823 -0.032972
C -2.012508 -0.967640 0.228151
C -2.340585 1.387688 -0.402013
C -3.397244 -1.189048 0.119608
C -3.730575 1.174327 -0.514710
C -4.240930 -0.114248 -0.251060
H 5.098917 -1.288649 -0.909982
H 4.700820 0.444874 -0.747441
H 4.931381 -0.569031 0.711173
H 1.476659 -1.263095 -1.899522
H 2.588477 0.093276 -2.261214
H 3.148926 -1.594201 -2.437896
H 3.302032 -2.470396 1.226608
H 1.769704 -2.631292 0.309428
H 3.328900 -3.096819 -0.440411
H 3.523055 0.239221 2.218969
H 1.877954 0.872036 2.526794
H 2.145271 -0.894773 2.435071
H -1.335049 -1.777994 0.514088
H -1.901627 2.371345 -0.596099
H -3.821086 -2.177560 0.318470
H -4.398272 1.991530 -0.799794


