%chk=000228808.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228808

0 1
Br 3.894735 0.243890 0.033041
O -1.731664 1.695619 0.720104
O -0.527785 1.278128 -1.122794
N -2.396089 -1.068351 0.341851
C -1.010916 -0.545677 0.510356
C -0.010194 -1.445100 -0.241263
C -1.026831 0.854124 -0.112094
C 1.406016 -1.126842 0.145540
C 2.097801 -0.159609 -0.451455
H -0.698481 -0.439737 1.585746
H -0.228142 -2.513718 -0.037257
H -0.161705 -1.328959 -1.340767
H 1.822487 -1.745796 0.942794
H -3.046900 -0.553090 0.933102
H -2.450603 -2.049872 0.595568
H 1.718932 0.487682 -1.245539
H -1.804959 2.621408 0.364066


%chk=000228808-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228808

0 1
Br 4.105092 0.082698 -0.048847
O -1.949603 1.680783 0.809513
O -0.527021 1.372915 -0.999616
N -2.397022 -1.099001 0.365252
C -1.044437 -0.530967 0.540907
C -0.003318 -1.363272 -0.250098
C -1.100358 0.905891 0.003659
C 1.425444 -1.061741 0.169184
C 2.260857 -0.312485 -0.582220
H -0.721492 -0.463661 1.608570
H -0.210409 -2.436141 -0.063574
H -0.152226 -1.178527 -1.327038
H 1.767653 -1.471826 1.128932
H -3.137605 -0.572537 0.837256
H -2.449928 -2.108651 0.524839
H 1.996108 0.159369 -1.531529
H -2.016033 2.601252 0.435807


