%chk=000063782.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063782

0 1
 Br   6.380300     -0.9169000     -0.1085000    
 F   -5.180200      -1.965800     -1.1000000E-03
 O  -0.1684000      -1.903100      0.1020000    
 N   0.4163000      0.3784000      6.3400000E-02
 N   -1.316000       2.006100     -3.9299998E-02
 C   -1.911700     -0.3628000      4.2500000E-02
 C  -5.9000000E-02   1.691600      3.1500001E-02
 C  -0.4768000     -0.7137000      9.2500001E-02
 C   -2.268800      0.9826000     -4.6300001E-02
 C    1.820000      7.2800003E-02  2.2900000E-02
 C   -2.891500      -1.362600      5.7799999E-02
 C   -3.625300       1.320200     -0.1195000    
 C   0.9061000       2.854400      0.1411000    
 C    2.454600     -7.6099999E-02  -1.203800    
 C    2.525900     -6.8800002E-02   1.211200    
 C   -4.239100      -1.012800     -1.5000000E-02
 C   -4.606400      0.3277000     -0.1048000    
 C    3.817200     -0.3716000      -1.243000    
 C    3.888600     -0.3641000       1.171800    
 C    4.534200     -0.5156000     -5.5199999E-02
 H   -2.626600      -2.414100      0.1232000    
 H   -3.926800       2.363000     -0.1849000    
 H    1.614000       2.829600     -0.6918000    
 H    1.460600       2.785900       1.081100    
 H   0.3702000       3.807600      0.1170000    
 H    1.903800      3.4899998E-02  -2.133900    
 H    2.030800      4.7899999E-02   2.171400    
 H   -5.655900      0.6008000     -0.1616000    
 H    4.305200     -0.4863000      -2.207500    
 H    4.432500     -0.4730000       2.106500    


%chk=000063782-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063782

0 1
Br 6.475310 -0.877264 0.020545
F -5.262397 -1.996757 -0.000708
O -0.063920 -1.928809 0.021261
N 0.386283 0.381671 0.008406
N -1.359490 2.042342 -0.000504
C -1.936869 -0.375418 0.005867
C -0.074442 1.722765 0.003835
C -0.509343 -0.747301 0.012904
C -2.311153 1.006526 -0.001122
C 1.812556 0.084013 0.011145
C -2.923873 -1.393904 0.006296
C -3.692729 1.351276 -0.008042
C 0.955660 2.825645 0.008849
C 2.504901 -0.035847 -1.212653
C 2.486653 -0.100072 1.237080
C -4.263899 -1.005009 -0.000783
C -4.674911 0.349603 -0.007982
C 3.887877 -0.320751 -1.216215
C 3.869416 -0.385728 1.246064
C 4.553769 -0.487020 0.016452
H -2.624012 -2.445676 0.011943
H -3.959957 2.411466 -0.013152
H 1.609935 2.780060 -0.879990
H 1.612784 2.767557 0.895048
H 0.421244 3.785917 0.015939
H 1.966382 0.079064 -2.158858
H 1.934215 -0.034113 2.179818
H -5.741766 0.590718 -0.013229
H 4.431101 -0.416942 -2.160223
H 4.398477 -0.531813 2.191707


