%chk=000035216.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035216

0 1
 Br  -1.010800      -4.202900      -1.322900    
 N   -1.233300      -1.315900      0.1395000    
 N    1.159300      -1.498800      0.1429000    
 N   0.1212000      0.6576000     -3.0700000E-02
 C  -8.2800001E-02  -2.006500      0.1910000    
 C  -0.1961000      -3.488000      0.3157000    
 C   -1.047700      6.2000002E-03  2.9100001E-02
 C    1.183900     -0.1609000      3.1800002E-02
 C   -2.242000      0.8204000     -3.1199999E-02
 C    2.481900      0.4594000     -2.4400000E-02
 C  -0.9952000      -3.995000       1.517700    
 C   -2.224700       2.122800      0.4678000    
 C   -3.411800      0.3019000     -0.5869000    
 C    2.667700       1.752200      0.4750000    
 C    3.566300     -0.2263000     -0.5810000    
 C   -3.377200       2.906600      0.4112000    
 C   -4.564100       1.085900     -0.6436000    
 C    3.925200       2.353400      0.4185000    
 C    4.823800      0.3747000     -0.6372000    
 C   -4.546800       2.388300     -0.1447000    
 C    5.003300       1.664600     -0.1375000    
 H   0.8021000      -3.939700      0.3377000    
 H   -2.035500      -3.651100       1.489200    
 H  -0.5524000      -3.633400       2.452200    
 H   -1.007100      -5.089900       1.550500    
 H   -1.332000       2.552300      0.9159000    
 H   -3.454900     -0.7059000     -0.9926000    
 H    1.850100       2.312300      0.9228000    
 H    3.457400      -1.228900     -0.9881000    
 H   -3.364800       3.920100      0.8016000    
 H   -5.474500      0.6833000      -1.078100    
 H    4.065800       3.357000      0.8092000    
 H    5.663000     -0.1604000      -1.072100    
 H   -5.443900       2.998700     -0.1889000    
 H    5.982300       2.132700     -0.1814000    


%chk=000035216-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035216

0 1
Br -0.416759 -4.180329 -1.818442
N -1.215880 -1.352418 0.120627
N 1.201050 -1.526060 0.076793
N 0.141014 0.651288 0.041395
C -0.053252 -2.064945 0.104268
C -0.136660 -3.574312 0.133790
C -1.075198 0.016812 0.084091
C 1.254844 -0.148160 0.045411
C -2.302687 0.845671 0.092900
C 2.587838 0.496507 0.016153
C -1.251640 -4.147973 1.004175
C -2.210525 2.263871 0.100109
C -3.581991 0.226239 0.092104
C 2.699185 1.913423 0.009896
C 3.764954 -0.299960 -0.007131
C -3.380787 3.048872 0.109325
C -4.749676 1.015366 0.099969
C 3.969550 2.522689 -0.016816
C 5.033317 0.313961 -0.034524
C -4.653332 2.427836 0.109525
C 5.139837 1.725706 -0.038795
H 0.858198 -3.981562 0.364756
H -2.228748 -3.737993 0.705759
H -1.068270 -3.867395 2.060051
H -1.274161 -5.247507 0.933270
H -1.218109 2.723692 0.097381
H -3.633781 -0.866369 0.081174
H 1.782797 2.510424 0.025227
H 3.659626 -1.388707 -0.006383
H -3.305170 4.141671 0.115676
H -5.733486 0.533747 0.096654
H 4.051306 3.615064 -0.021183
H 5.937853 -0.303513 -0.054228
H -5.562428 3.039790 0.115513
H 6.126871 2.201375 -0.060491


