%chk=000127585.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127585

0 1
 Br   4.758800       2.813300      3.9999999E-04
 C   0.2405000     -0.1178000     -9.9999997E-05
 C  -0.3934000      -1.384500     -9.9999997E-05
 C  -0.6086000       1.018500     -9.9999997E-05
 C   -1.795800      -1.484300       0.000000    
 C   -2.013500      0.9239000     -9.9999997E-05
 C   -2.615000     -0.3474000      9.9999997E-05
 C    1.680100     -5.2600000E-02 -9.9999997E-05
 C    2.428300      -1.258800     -9.9999997E-05
 C   0.3774000      -2.550200       0.000000    
 C    1.766800      -2.488700      9.9999997E-05
 C  -0.1022000       2.432500     -3.0000001E-04
 C   -2.445500      -2.843800       0.000000    
 C   -2.830100       2.068200     -9.9999997E-05
 C   -4.016800     -0.4489000      9.9999997E-05
 C    2.423100       1.154900     -1.9999999E-04
 C    3.833500      -1.230100      9.9999997E-05
 C   -4.220600       1.953800      1.9999999E-04
 C   -4.813700      0.6958000      9.9999997E-05
 C    3.820700       1.169700     -9.9999997E-05
 C    4.526000     -2.3399999E-02  9.9999997E-05
 H  -4.2100001E-02  -3.550300     -3.1900000E-02
 H    2.328500      -3.421100     -6.6000000E-03
 H   0.4540000       2.613300      0.9266000    
 H   0.4533000       2.613600     -0.9276000    
 H  -0.7790000       3.278300      3.9999999E-04
 H   -3.441100      -2.873900      0.4450000    
 H   -2.503600      -3.235800      -1.020400    
 H   -1.910500      -3.557200      0.6345000    
 H   -2.510800       3.098900     -8.9999998E-04
 H   -4.556700      -1.387900     -3.2499999E-02
 H    2.034500       2.149400     -6.9999998E-04
 H    4.405500      -2.156300      1.9999999E-04
 H   -4.841400       2.845200     -1.5000000E-03
 H   -5.895900      0.6055000     -7.1999999E-03
 H    5.612600     -3.5599999E-02  3.0000001E-04


%chk=000127585-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127585

0 1
Br 4.738071 2.777891 -1.062228
C 0.217783 -0.075099 0.075522
C -0.423137 -1.390522 0.057672
C -0.600951 1.081729 0.221572
C -1.835829 -1.531223 -0.040447
C -2.027065 0.953960 0.069630
C -2.649995 -0.352802 -0.108075
C 1.692819 -0.032598 -0.039970
C 2.462129 -1.237597 0.152516
C 0.407948 -2.573185 0.213109
C 1.777617 -2.499423 0.323441
C -0.051357 2.439825 0.645369
C -2.446316 -2.926094 -0.056015
C -2.874459 2.119600 0.061049
C -4.078019 -0.403978 -0.299579
C 2.411206 1.140655 -0.432216
C 3.885668 -1.199589 0.089544
C -4.251549 2.027991 -0.127544
C -4.861256 0.747516 -0.310966
C 3.809820 1.133389 -0.507894
C 4.577499 -0.019945 -0.219943
H -0.077222 -3.550675 0.270749
H 2.375847 -3.404404 0.480648
H 0.927728 2.344359 1.138118
H 0.059715 3.153731 -0.195147
H -0.734193 2.907361 1.375664
H -3.533781 -2.911300 -0.209328
H -2.013253 -3.549617 -0.859704
H -2.266192 -3.452208 0.901057
H -2.424270 3.109585 0.172006
H -4.569869 -1.368332 -0.449937
H 1.875730 2.039911 -0.732001
H 4.447292 -2.124741 0.262900
H -4.866696 2.934249 -0.146456
H -5.943333 0.674613 -0.465640
H 5.669172 0.003168 -0.269876


