%chk=000036183.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036183

0 1
 Br   1.311200      -2.260900       2.434000    
 Br   5.382500       1.039400      -1.667000    
 Br  -5.505200       1.043000       1.493200    
 Br  -1.180900      -2.328800      -2.277300    
 Br   4.086100      -3.767000       1.284100    
 Br   6.127300      -2.112800     -0.7710000    
 Br  -6.174200      -2.138000      0.6418000    
 Br  -4.006500      -3.828500      -1.247500    
 O   0.2029000      0.5457000       1.931700    
 O    3.019900       2.833900     -0.9068000    
 O   -3.114600       2.832100      0.8287000    
 O  -0.1181000      0.5003000      -1.781100    
 N    1.373600       1.995600      0.5214000    
 N   -1.381300       1.989000     -0.4967000    
 C   0.4947000       3.148000      0.5759000    
 C  -0.5264000       3.143900     -0.5493000    
 C    2.249900     -6.5399997E-02  0.8584000    
 C    3.098700      0.6223000      3.5999999E-03
 C   -3.126800      0.6026000     -3.4100000E-02
 C   -2.225600     -0.1005000     -0.8201000    
 C    1.135800      0.8186000       1.199200    
 C    2.539500       1.955900     -0.2143000    
 C   -2.589200       1.945500      0.1815000    
 C   -1.098700      0.7829000      -1.118000    
 C    2.508600      -1.360400       1.258100    
 C    4.250700      5.1399998E-02 -0.4967000    
 C   -4.301000      3.4800000E-02  0.4159000    
 C   -2.450900      -1.408300      -1.197300    
 C    3.670500      -1.959600      0.7633000    
 C    4.533100      -1.260700     -0.1056000    
 C   -4.550900      -1.289800      4.5499999E-02
 C   -3.634900      -2.004300     -0.7533000    
 H  -1.4900000E-02   3.150800       1.546300    
 H    1.106100       4.054400      0.5054000    
 H   -1.145100       4.045300     -0.4792000    
 H  -1.4800000E-02   3.153200      -1.518700    


%chk=000036183-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000036183

0 1
Br 1.449636 -2.446563 2.319568
Br 5.606324 1.204327 -1.539272
Br -5.647786 1.172952 1.486001
Br -1.395878 -2.492462 -2.253529
Br 4.347449 -3.816701 1.197115
Br 6.425976 -1.992715 -0.730745
Br -6.422966 -2.043921 0.713049
Br -4.296715 -3.875168 -1.154830
O 0.150110 0.468481 1.882754
O 3.037340 3.010507 -0.796380
O -3.086315 2.994089 0.754664
O -0.134359 0.442957 -1.844520
N 1.405035 1.994662 0.578384
N -1.421200 1.973830 -0.577229
C 0.467614 3.123178 0.603006
C -0.497218 3.113704 -0.608782
C 2.364777 -0.104962 0.865628
C 3.238716 0.661527 0.050227
C -3.250613 0.630702 -0.058829
C -2.356592 -0.138868 -0.849191
C 1.168301 0.742781 1.203390
C 2.624624 2.019296 -0.151410
C -2.653202 1.997552 0.131714
C -1.163889 0.716401 -1.182020
C 2.669849 -1.427951 1.215790
C 4.442115 0.127167 -0.431253
C -4.455903 0.091355 0.412321
C -2.642926 -1.469989 -1.183893
C 3.892286 -1.990505 0.733919
C 4.771544 -1.219235 -0.082359
C -4.766454 -1.263405 0.078693
C -3.866980 -2.037735 -0.712290
H -0.102193 3.076158 1.545953
H 1.058488 4.055019 0.578070
H -1.100771 4.037452 -0.588057
H 0.072878 3.069684 -1.551655


