%chk=000041342.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041342

0 1
 Br   3.051300       2.487800      -1.272500    
 C  -0.3863000      -1.424400      0.2661000    
 C   0.5947000     -0.3442000      0.7779000    
 C   -1.627400     -0.8535000     -0.4619000    
 C   0.2829000      -2.477400     -0.6468000    
 C    1.333800      0.4307000     -0.3199000    
 C   -2.373300      0.2260000      0.3293000    
 C    2.244600       1.527100      0.2424000    
 C   -3.592000      0.7850000     -0.4108000    
 C    1.453800      -3.205700     -2.4000001E-03
 C    3.371800       1.008500       1.122300    
 C   -4.353700       1.840100      0.3762000    
 H  -0.7580000      -1.951600       1.156200    
 H   7.8299999E-02  0.3558000       1.443300    
 H    1.331000     -0.8431000       1.418900    
 H   -2.322100      -1.675100     -0.6793000    
 H   -1.326800     -0.4392000      -1.432300    
 H   0.6129000      -2.020700      -1.587000    
 H  -0.4682000      -3.229300     -0.9217000    
 H    1.931100     -0.2589000     -0.9277000    
 H   0.5997000      0.8863000     -0.9954000    
 H   -1.707400       1.069500      0.5390000    
 H   -2.689500     -0.1858000       1.295300    
 H    1.658500       2.280700      0.7785000    
 H   -4.276900     -3.6800001E-02 -0.6517000    
 H   -3.269300       1.218900      -1.364800    
 H    1.162300      -3.646600      0.9561000    
 H    2.302900      -2.537400      0.1659000    
 H    1.797000      -4.014300     -0.6559000    
 H    2.983800      0.5701000       2.046700    
 H    3.965000      0.2449000      0.6069000    
 H    4.052500       1.817000       1.411700    
 H   -4.725100       1.429600       1.320500    
 H   -5.211300       2.199900     -0.2006000    
 H   -3.711200       2.696700      0.6031000    


%chk=000041342-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041342

0 1
Br 3.042757 2.673904 -1.285575
C -0.386254 -1.388616 0.244994
C 0.649205 -0.358207 0.786465
C -1.570962 -0.733208 -0.518030
C 0.265099 -2.499612 -0.627741
C 1.400632 0.436706 -0.316497
C -2.393567 0.285574 0.303069
C 2.312783 1.521143 0.276519
C -3.675169 0.752872 -0.425437
C 1.381403 -3.302886 0.074839
C 3.510403 1.010540 1.081579
C -4.489666 1.781953 0.387480
H -0.815307 -1.889517 1.142348
H 0.130159 0.354587 1.458586
H 1.380876 -0.896947 1.418111
H -2.250317 -1.544854 -0.853502
H -1.201486 -0.248180 -1.445096
H 0.660889 -2.054656 -1.563224
H -0.536289 -3.199122 -0.941438
H 2.011422 -0.246642 -0.935817
H 0.669415 0.918162 -0.990779
H -1.775847 1.175681 0.540817
H -2.674428 -0.168225 1.277364
H 1.729428 2.265355 0.845931
H -4.308546 -0.130247 -0.647965
H -3.397454 1.190154 -1.406290
H 1.021957 -3.731460 1.029948
H 2.264024 -2.675701 0.298872
H 1.725196 -4.139689 -0.560574
H 3.148486 0.460841 1.972292
H 4.128474 0.324785 0.476042
H 4.146876 1.841538 1.427572
H -4.802746 1.359886 1.361318
H -5.401376 2.095380 -0.153506
H -3.890669 2.689306 0.592926


