%chk=000055946.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055946

0 1
 Br  -2.147900      -2.692800      8.9999998E-04
 F    3.385600      -1.450700     -1.9999999E-04
 F    3.596200      0.4208000      -1.086300    
 F    3.570800      0.4263000       1.093900    
 N   0.9473000       1.260000     -1.1000000E-03
 N   0.6251000     -0.9391000     -1.9999999E-04
 C  -0.4133000       1.089500     -1.1000000E-03
 C  -0.5890000     -0.2915000     -5.0000002E-04
 C    1.523300      2.0099999E-02 -8.9999998E-04
 C   -1.892600     -0.8160000     -1.9999999E-04
 C   -2.972000      7.6399997E-02 -5.0000002E-04
 C   -1.473000       1.997000     -1.5000000E-03
 C   -2.763600       1.457700     -1.4000000E-03
 C    2.988800     -0.1437000     -1.0000000E-03
 C   -4.385800     -0.4140000      9.9999997E-05
 H    1.435100       2.146000     -1.5000000E-03
 H   -1.308600       3.068600     -2.0000001E-03
 H   -3.607500       2.144500     -1.7000000E-03
 H   -4.587700      -1.010500      0.8958000    
 H   -5.104800      0.4130000     -3.0000001E-04
 H   -4.588000      -1.011800     -0.8948000    


%chk=000055946-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000055946

0 1
Br -2.166794 -2.742348 0.000637
F 3.427078 -1.510020 0.003692
F 3.636841 0.453802 -1.130673
F 3.636484 0.456982 1.132271
N 0.995180 1.293044 -0.000380
N 0.641847 -0.971458 0.000574
C -0.395389 1.127744 -0.000641
C -0.595003 -0.298584 0.000022
C 1.553290 0.010414 0.000641
C -1.915266 -0.811321 -0.000067
C -3.019010 0.071661 -0.000784
C -1.469347 2.038922 -0.001392
C -2.760941 1.482402 -0.001417
C 3.035262 -0.173249 0.001454
C -4.450057 -0.428783 -0.000967
H 1.506488 2.175330 -0.000528
H -1.322643 3.122838 -0.001925
H -3.627615 2.153068 -0.001993
H -4.655678 -1.056896 0.885416
H -5.161196 0.414093 -0.001639
H -4.655131 -1.057842 -0.886802


