%chk=000021611.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021611

0 1
 Br  -5.526600     -0.1366000      -1.440200    
 O  -0.1504000       2.359500      0.3996000    
 O  -0.2521000      -2.271100      0.5177000    
 N  -0.6145000      5.7200000E-02  0.5753000    
 C   -2.013300      9.8700002E-02  0.9525000    
 C    1.484900      0.6889000      6.8000001E-03
 C    1.453300     -0.6974000      4.2500000E-02
 C   -2.942400      1.5500000E-02 -0.2538000    
 C   0.1506000       1.181500      0.3466000    
 C   9.8200001E-02  -1.111000      0.4057000    
 C    2.633300       1.385100     -0.3094000    
 C    2.568500      -1.460500     -0.2363000    
 C   -4.409600      3.3900000E-02  0.1469000    
 C    3.776100      0.6326000     -0.5949000    
 C    3.744000     -0.7764000     -0.5589000    
 H   -2.200000       1.029700       1.499800    
 H   -2.210500     -0.7425000       1.627100    
 H   -2.721700     -0.8998000     -0.8187000    
 H   -2.730300      0.8490000     -0.9361000    
 H    2.658200       2.468100     -0.3377000    
 H    2.544100      -2.543500     -0.2091000    
 H   -4.665500     -0.8052000      0.7994000    
 H   -4.689500      0.9737000      0.6304000    
 H    4.703800       1.138800     -0.8490000    
 H    4.647500      -1.336600     -0.7858000    


%chk=000021611-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021611

0 1
Br -5.643619 0.002309 -1.498840
O -0.278278 2.379017 0.422053
O -0.322791 -2.324250 0.635768
N -0.630791 0.034697 0.620148
C -2.051628 0.065165 0.983473
C 1.514046 0.695441 -0.002801
C 1.500708 -0.720107 0.062028
C -2.964492 0.020879 -0.273919
C 0.148367 1.200061 0.351898
C 0.125794 -1.164679 0.459469
C 2.674476 1.401221 -0.352596
C 2.647580 -1.476388 -0.220397
C -4.438096 0.054258 0.136034
C 3.840537 0.644866 -0.641847
C 3.827344 -0.771547 -0.576593
H -2.229757 0.993497 1.555611
H -2.248822 -0.806037 1.633774
H -2.753694 -0.899826 -0.846292
H -2.734039 0.884737 -0.922235
H 2.673234 2.494670 -0.398971
H 2.626054 -2.569268 -0.166396
H -4.737462 -0.823813 0.729507
H -4.716686 0.983833 0.656777
H 4.765628 1.160875 -0.919988
H 4.742486 -1.328012 -0.805268


