%chk=000014362.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014362

0 1
 Br   2.401600       2.003500       1.825200    
 O   0.9396000     -1.8500000E-02  -2.279400    
 O  -0.1438000      0.3226000       2.276900    
 O   0.5229000      -3.775200      0.3223000    
 N   0.6342000      -1.898100      -1.000300    
 N   9.2399999E-02  -1.727800       1.275600    
 C  -0.1821000      0.2524000     -0.1467000    
 C   -1.679500      0.2519000     -0.5029000    
 C   0.3355000       1.698100     -0.1318000    
 C   -2.469900      0.9969000      0.5846000    
 C   0.5367000     -0.5351000      -1.237600    
 C  -5.4900002E-02 -0.3490000       1.249400    
 C   -1.875400      0.8594000      -1.890700    
 C   -3.973400      0.9941000      0.3479000    
 C    1.820000       1.764100      6.1299998E-02
 C   0.4073000      -2.554200      0.2036000    
 C    2.688700       1.714800     -0.9575000    
 H   -2.049700     -0.7823000     -0.5409000    
 H  -0.1400000       2.312900      0.6402000    
 H   0.1282000       2.218900      -1.073000    
 H   -2.167700       2.044200      0.6717000    
 H   -2.342200      0.5302000       1.564000    
 H   -1.687100       1.935300      -1.929900    
 H   -2.924500      0.7385000      -2.188500    
 H   -1.317400      0.3628000      -2.685600    
 H   -4.490600       1.429900       1.209300    
 H   -4.349300     -2.4499999E-02  0.2092000    
 H   -4.244800       1.588600     -0.5294000    
 H   0.9838000      -2.468200      -1.765500    
 H   4.2599998E-02  -2.172500       2.188000    
 H    3.758600       1.779000     -0.7810000    
 H    2.384600       1.693300      -1.995300    


%chk=000014362-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014362

0 1
Br 2.987806 0.586053 1.215387
O 1.016093 -0.149151 -2.226759
O -0.368726 0.137183 2.378379
O 0.441731 -3.963531 0.357718
N 0.604082 -2.030513 -0.950382
N -0.035779 -1.884323 1.315680
C -0.145202 0.195639 -0.082324
C -1.710269 0.286653 -0.507227
C 0.477059 1.623028 0.016045
C -2.489219 1.310268 0.370730
C 0.561663 -0.636516 -1.161516
C -0.155761 -0.482141 1.303874
C -1.901749 0.587370 -2.012817
C -4.012414 1.049026 0.372016
C 1.983912 1.732196 -0.063778
C 0.336630 -2.717375 0.246257
C 2.689893 2.554073 -0.867430
H -2.134434 -0.720175 -0.304565
H 0.130116 2.052198 0.974526
H 0.075555 2.246399 -0.802127
H -2.292015 2.333918 -0.004518
H -2.126755 1.273995 1.413522
H -1.358115 1.497350 -2.323022
H -2.975009 0.749407 -2.214655
H -1.560752 -0.237202 -2.660057
H -4.530977 1.797254 0.998170
H -4.242198 0.049426 0.786524
H -4.450535 1.104008 -0.641172
H 0.978881 -2.601837 -1.714922
H -0.150579 -2.349956 2.221795
H 3.779894 2.620509 -0.837502
H 2.161575 3.172768 -1.602649


