%chk=000206362.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206362

0 1
Br 6.836847 -0.081651 0.413342
O -4.701411 0.150946 -0.401426
O -4.267972 0.452288 1.778551
N -1.741817 1.280812 0.021285
C 2.559713 -0.033905 0.172493
C 1.628022 -0.082073 -1.049118
C 4.033679 -0.073543 -0.255489
C 0.190975 -0.047104 -0.621248
C 4.945001 -0.020623 0.960878
C -0.546629 -1.223913 -0.440522
C -0.453541 1.189442 -0.378195
C -1.882389 -1.149575 -0.031041
C -2.431547 0.121352 0.191056
C -3.843945 0.280271 0.664682
H 2.334358 -0.883055 0.847930
H 2.357101 0.882351 0.762256
H 1.849425 0.766726 -1.730542
H 1.835503 -0.992841 -1.649147
H 4.233649 -0.991007 -0.847501
H 4.254639 0.772697 -0.939231
H 4.816359 0.910541 1.539335
H 4.787700 -0.876883 1.639085
H -0.086413 -2.196663 -0.618008
H 0.076752 2.141835 -0.506539
H -2.477634 -2.050986 0.108630
H -5.655523 0.275762 -0.141216


%chk=000206362-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206362

0 1
Br 6.921376 -0.290106 0.549706
O -4.558964 -0.833647 0.568298
O -4.541288 1.488674 0.681270
N -1.790103 1.434918 -0.122707
C 2.566738 -0.058819 0.177205
C 1.660557 0.071753 -1.081768
C 4.069710 -0.092436 -0.201624
C 0.187987 0.099132 -0.722701
C 4.946837 -0.234385 1.043594
C -0.569102 -1.087656 -0.556138
C -0.488284 1.330767 -0.494811
C -1.924155 -1.007193 -0.174683
C -2.495737 0.272900 0.037906
C -3.929415 0.427033 0.452705
H 2.293209 -0.980791 0.728266
H 2.364206 0.789937 0.859873
H 1.934707 0.997278 -1.624119
H 1.871541 -0.776621 -1.761264
H 4.262875 -0.936943 -0.890266
H 4.339847 0.833731 -0.743424
H 4.857557 0.622182 1.729831
H 4.770996 -1.177325 1.584739
H -0.103624 -2.064817 -0.729960
H 0.045503 2.281514 -0.622020
H -2.538854 -1.899952 -0.042128
H -5.503218 -0.687927 0.844523


