%chk=000098160.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098160

0 1
 Br  -4.969500      -1.764700      0.1758000    
 C   0.3401000     -5.5000000E-02 -0.2426000    
 C  -0.8544000      0.4676000      0.5575000    
 C    1.664800      0.3258000      0.4224000    
 C   -2.180600      5.7999998E-02 -8.9800000E-02
 C    2.856800     -0.2270000     -0.3619000    
 C   -3.374000      0.5602000      0.7327000    
 C    4.211800      0.1510000      0.2434000    
 C   -4.755100      0.1829000      0.1887000    
 C    5.403300     -0.3805000     -0.5544000    
 C   -5.064300      0.7230000      -1.197400    
 C    6.721100     -4.1400000E-02  0.1255000    
 H   0.3078000      0.3520000      -1.260600    
 H   0.2745000      -1.146500     -0.3282000    
 H  -0.8095000      7.4299999E-02   1.580400    
 H  -0.8006000       1.560800      0.6281000    
 H    1.742900       1.417700      0.4884000    
 H    1.691000     -6.3600004E-02   1.447300    
 H   -2.226200      0.4710000      -1.103900    
 H   -2.202200      -1.032600     -0.1821000    
 H    2.812800      0.1435000      -1.393700    
 H    2.780300      -1.320100     -0.4148000    
 H   -3.280200      0.1763000       1.757300    
 H   -3.316800       1.653600      0.8089000    
 H    4.261000     -0.2345000       1.269500    
 H    4.283200       1.243600      0.3127000    
 H   -5.519500      0.5381000      0.8888000    
 H    5.323300      -1.468600     -0.6600000    
 H    5.393600      4.5800000E-02  -1.563900    
 H   -4.410800      0.2928000      -1.963500    
 H   -4.947400       1.811400      -1.222400    
 H   -6.096400      0.4930000      -1.485200    
 H    7.560300     -0.4278000     -0.4614000    
 H    6.773100     -0.4849000       1.125000    
 H    6.844600       1.041900      0.2228000    


%chk=000098160-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000098160

0 1
Br -5.117938 -1.777921 0.520272
C 0.334831 -0.001299 -0.265955
C -0.880522 0.475962 0.560318
C 1.690377 0.296954 0.413878
C -2.235783 0.129738 -0.097523
C 2.907648 -0.166438 -0.418002
C -3.433450 0.651524 0.725410
C 4.262320 0.104325 0.275074
C -4.832136 0.255321 0.224280
C 5.480095 -0.354288 -0.559584
C -5.132046 0.570967 -1.244025
C 6.828499 -0.090605 0.145375
H 0.311722 0.480610 -1.265862
H 0.248273 -1.093282 -0.445282
H -0.839373 0.016686 1.570060
H -0.810344 1.573685 0.714258
H 1.772779 1.387182 0.607502
H 1.716617 -0.197574 1.407461
H -2.262957 0.556754 -1.120120
H -2.321513 -0.969244 -0.206682
H 2.892687 0.342083 -1.404849
H 2.815189 -1.252849 -0.627456
H -3.328124 0.327803 1.778639
H -3.409722 1.764314 0.735845
H 4.279937 -0.409811 1.258947
H 4.355295 1.189598 0.490611
H -5.608073 0.671777 0.888775
H 5.382401 -1.437073 -0.780010
H 5.465983 0.164497 -1.539971
H -4.455417 0.025914 -1.922412
H -4.994288 1.657555 -1.417049
H -6.170245 0.307144 -1.505028
H 7.682111 -0.429488 -0.470294
H 6.878574 -0.621966 1.114586
H 6.965393 0.988543 0.348214


