%chk=000148470.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148470

0 1
 Br  -4.642600      -2.223400      1.6799999E-02
 O   -2.204100     -0.6783000     -2.4000001E-03
 O  -4.7300000E-02   2.059400     -2.9000000E-03
 N   0.4242000     -0.2445000     -2.2600001E-02
 N    3.920100      0.9011000      2.3399999E-02
 C   -1.865500      0.6083000     -6.6000000E-03
 C    1.816000     -0.2892000     -9.8999999E-03
 C  -0.4054000      0.8866000     -1.8700000E-02
 C   -2.891200       1.461700     -3.9999999E-04
 C    2.494400      -1.502900     -1.6200000E-02
 C   -4.033800      0.6266000      8.8000000E-03
 C    2.568600      0.8742000      9.8999999E-03
 C   -3.562700     -0.6657000      7.1999999E-03
 C    3.884700      -1.516100     -2.9000000E-03
 C    4.544700     -0.2980000      1.6500000E-02
 H  -4.0300000E-02  -1.150300     -3.2600001E-02
 H   -2.868000       2.541800     -2.3000001E-03
 H    1.951900      -2.444600     -3.1500001E-02
 H   -5.069300      0.9376000      1.5600000E-02
 H    2.151700       1.871000      1.6700000E-02
 H    4.434500      -2.450300     -7.6000001E-03
 H    5.628700     -0.2538000      2.7600000E-02


%chk=000148470-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000148470

0 1
Br -4.525875 -2.394964 -0.010727
O -2.246744 -0.720590 -0.004191
O 0.001780 2.168291 0.006321
N 0.426442 -0.162202 -0.000993
N 4.038542 0.868813 0.004521
C -1.842786 0.648708 0.000391
C 1.842384 -0.208954 -0.000331
C -0.399272 0.964554 0.002116
C -2.969473 1.457972 0.002368
C 2.466477 -1.485765 -0.004186
C -4.127874 0.596776 -0.000971
C 2.677468 0.948531 0.003978
C -3.648811 -0.704280 -0.004895
C 3.871748 -1.564896 -0.003610
C 4.621032 -0.365118 0.000801
H -0.058074 -1.066277 -0.004218
H -2.953641 2.545257 0.005851
H 1.858427 -2.399231 -0.007584
H -5.173434 0.893689 -0.000569
H 2.236312 1.946764 0.006967
H 4.378302 -2.534986 -0.006545
H 5.716371 -0.380891 0.001405


