%chk=000021758.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021758

0 1
 Br  -2.874300      -2.710400      0.3354000    
 O    1.827700     -0.8536000     -0.8882000    
 O  -0.3015000       2.552600     -0.3532000    
 N  -5.9599999E-02  0.2689000     -0.1434000    
 N   -2.209500       1.350700     -0.1120000    
 N   -4.175100      0.1579000      0.1322000    
 C    1.373500      0.3358000     -0.2431000    
 C    2.008900      0.4741000       1.138300    
 C    3.530200      0.4356000       1.036800    
 C    3.982900     -0.7759000      0.2290000    
 C    3.239800     -0.8474000      -1.098600    
 C  -0.6915000     -0.9534000      1.8900000E-02
 C  -0.8342000       1.450700     -0.2103000    
 C   -2.016100      -1.078400      0.1171000    
 C   -2.801200      0.1928000      4.1099999E-02
 H    1.647200       1.195800     -0.8676000    
 H    1.686200     -0.3539000       1.783100    
 H    1.687300       1.401900       1.625100    
 H    3.974600      0.4089000       2.037700    
 H    3.885900       1.351900      0.5501000    
 H    5.064000     -0.7388000      5.9700001E-02
 H    3.768400      -1.682000      0.8089000    
 H    3.508200     -8.8999998E-03  -1.752000    
 H    3.502500      -1.771700      -1.622800    
 H  -5.5100001E-02  -1.829500      8.5500002E-02
 H   -4.681100     -0.7134000      0.2512000    
 H   -4.722900       1.010000      8.2599998E-02


%chk=000021758-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021758

0 1
Br -3.004472 -2.817769 0.120576
O 1.824540 -0.947447 -0.842411
O -0.196846 2.551537 -0.119712
N -0.103046 0.207987 -0.135622
N -2.226180 1.362921 0.001914
N -4.223080 0.179321 0.155558
C 1.373589 0.304862 -0.228751
C 2.034185 0.522116 1.148121
C 3.574247 0.526583 0.990004
C 4.048545 -0.758878 0.269836
C 3.289449 -0.935228 -1.057516
C -0.735334 -1.010325 -0.071459
C -0.848572 1.468502 -0.084905
C -2.110998 -1.072574 0.039524
C -2.855647 0.168955 0.066579
H 1.593570 1.169728 -0.888741
H 1.720469 -0.296406 1.824850
H 1.672780 1.478177 1.565569
H 4.054962 0.617590 1.980704
H 3.880646 1.416334 0.402883
H 5.135577 -0.717765 0.064483
H 3.863034 -1.640393 0.913197
H 3.541212 -0.113308 -1.762762
H 3.506507 -1.901622 -1.540538
H -0.095391 -1.892115 -0.137856
H -4.758309 -0.684824 0.202563
H -4.690237 1.084340 0.165411


