%chk=000293279.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293279

0 1
Br 5.158142 -0.288003 -0.509560
O 0.810646 -1.057073 0.894186
O 0.871859 -2.393790 -0.967350
O 3.564737 0.626841 -0.776845
N -0.797304 -0.788633 -0.876151
C 2.176043 -0.979348 0.426299
C 2.611234 0.501317 0.300672
C 2.180837 -1.766250 -0.898044
C -0.021342 -1.728241 -0.077942
C 1.522193 1.464432 -0.193505
C 1.846457 2.913594 0.142431
C -1.896989 -0.057655 -0.374122
C -2.635706 0.743091 -1.275237
C -2.270243 -0.126394 0.984182
C -3.746435 1.444567 -0.810767
C -3.389279 0.583068 1.420129
C -4.132157 1.367452 0.532297
H 2.764273 -1.487515 1.223556
H 3.062283 0.847292 1.256319
H 2.304910 -1.129269 -1.791760
H 2.891162 -2.608044 -0.923702
H -0.632561 -2.469080 0.475365
H 1.391738 1.346932 -1.289572
H 0.555944 1.161421 0.274285
H -0.426320 -0.548814 -1.793506
H 2.814644 3.214989 -0.279803
H 1.887499 3.086060 1.224176
H 1.085396 3.590385 -0.265346
H -2.351422 0.804400 -2.321194
H -1.685393 -0.705550 1.693884
H -4.321074 2.059148 -1.503922
H -3.682593 0.527303 2.468706
H -5.001579 1.915567 0.882839


%chk=000293279-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000293279

0 1
Br 5.435473 -0.322676 0.890729
O 0.773413 -1.081216 0.852116
O 0.778969 -2.382535 -1.103028
O 4.022558 0.559393 -0.204696
N -0.884245 -0.722908 -0.914170
C 2.150471 -0.995557 0.290755
C 2.664886 0.458028 0.383158
C 2.035701 -1.581689 -1.139184
C -0.100711 -1.696766 -0.178101
C 1.879599 1.506559 -0.440106
C 2.121288 2.947431 0.048321
C -2.008371 -0.063948 -0.370404
C -2.952788 0.548277 -1.242352
C -2.210186 0.015341 1.036958
C -4.076487 1.216948 -0.717243
C -3.348922 0.676404 1.545845
C -4.288759 1.282194 0.680768
H 2.789681 -1.638662 0.924561
H 2.681673 0.762255 1.447996
H 1.963480 -0.794431 -1.910920
H 2.844421 -2.281223 -1.391897
H -0.724759 -2.434460 0.358792
H 2.159985 1.419008 -1.508042
H 0.810071 1.229940 -0.359497
H -0.819456 -0.808011 -1.930464
H 3.193887 3.204640 0.005971
H 1.774196 3.077675 1.089861
H 1.570473 3.668699 -0.581600
H -2.805237 0.492325 -2.328611
H -1.468767 -0.406552 1.722263
H -4.793048 1.682980 -1.403347
H -3.493492 0.728326 2.631206
H -5.165397 1.798413 1.085361


