%chk=000075303.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075303

0 1
 Br  -1.892500      -2.890100     -5.0000002E-04
 N  -0.3537000       3.021000     -1.9999999E-04
 C   0.3926000      0.6744000       0.000000    
 C   5.6600001E-02 -0.7004000      1.9999999E-04
 C  -0.6345000       1.632300       0.000000    
 C   -1.296300      -1.076900      1.9999999E-04
 C    1.745600       1.050700     -9.9999997E-05
 C    1.083600      -1.658500      1.9999999E-04
 C   -1.973400       1.240200       0.000000    
 C   -2.303600     -0.1117000      1.9999999E-04
 C    2.752900      8.5400000E-02 -9.9999997E-05
 C    2.422700      -1.266500       0.000000    
 H    2.065800       2.088000     -1.9999999E-04
 H   0.8860000      -2.726200      3.0000001E-04
 H   -2.770300       1.979900     -9.9999997E-05
 H   -3.354200     -0.3921000      9.9999997E-05
 H    3.795800      0.3891000     -1.9999999E-04
 H    3.207900      -2.016900      9.9999997E-05
 H   -1.123300       3.678400      1.9999999E-04
 H   0.5883000       3.380700      6.9999998E-04


%chk=000075303-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000075303

0 1
Br -1.891034 -2.977659 0.000005
N -0.361222 3.048848 -0.000039
C 0.396515 0.692518 -0.000011
C 0.051432 -0.723433 0.000005
C -0.659913 1.687302 0.000027
C -1.337929 -1.085612 -0.000010
C 1.782388 1.055756 -0.000064
C 1.113475 -1.687412 0.000069
C -2.005392 1.264539 0.000040
C -2.341125 -0.115520 -0.000017
C 2.794986 0.091646 -0.000029
C 2.454210 -1.294397 0.000068
H 2.078372 2.111724 -0.000190
H 0.858094 -2.751631 0.000116
H -2.810938 2.007870 0.000086
H -3.394126 -0.413575 0.000002
H 3.846091 0.400748 -0.000090
H 3.244745 -2.052925 0.000109
H -1.115228 3.729339 0.000186
H 0.592599 3.392675 0.000538


