%chk=000294344.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294344

0 1
Br -0.211297 1.455691 1.835020
O -1.620454 -0.379053 -1.556536
O 0.513950 -1.857256 -1.255837
O -0.313276 -2.998461 -1.308922
N -1.798536 0.335661 0.615305
N 3.587474 1.643050 0.170643
C -3.012872 0.914223 -0.063535
C 0.198055 -1.085585 -0.046635
C -1.124609 -0.365132 -0.258008
C -2.853635 0.421189 -1.545464
C 0.116243 -2.002675 1.188325
C -2.977946 2.439831 0.026387
C -4.275620 0.345248 0.584503
C 1.361818 -0.097310 0.024477
C 1.445844 -2.664487 1.521304
C 1.347743 1.035615 0.856489
C 2.514256 -0.330916 -0.740627
C 2.473384 1.877418 0.906464
C 3.597006 0.556242 -0.644390
H -3.643950 -0.259521 -1.887207
H -2.683286 1.223211 -2.275322
H -0.666413 -2.769209 1.000636
H -0.251173 -1.420587 2.062868
H -3.826581 2.895400 -0.492610
H -3.011306 2.771363 1.072880
H -2.053921 2.851420 -0.400336
H -4.312062 -0.748813 0.514875
H -4.306381 0.589951 1.655141
H -5.183366 0.747092 0.124584
H 1.898265 -3.144460 0.645946
H 2.174506 -1.936997 1.904015
H 1.319508 -3.431011 2.295754
H 2.567413 -1.192009 -1.411751
H 2.492588 2.767396 1.550597
H 4.510802 0.403327 -1.232103
H 0.343430 -3.710648 -1.033328


%chk=000294344-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000294344

0 1
Br 0.626108 2.051736 1.798223
O -0.991235 0.733547 -1.221881
O 0.290791 -1.997930 -0.870033
O -0.929745 -2.879739 -0.723899
N -2.156349 -0.182515 0.579716
N 3.960972 1.314121 -0.626498
C -3.169544 0.703405 -0.118274
C 0.224226 -0.902406 0.184911
C -1.042220 -0.104871 -0.084789
C -2.366717 1.325077 -1.324182
C 0.205627 -1.537368 1.599671
C -3.656749 1.781796 0.872715
C -4.335757 -0.185789 -0.601584
C 1.502570 -0.092190 -0.096793
C 1.410851 -2.453403 1.889151
C 1.818265 1.143239 0.524402
C 2.477492 -0.589499 -1.003154
C 3.035385 1.805671 0.242822
C 3.666722 0.128945 -1.236945
H -2.771055 1.039483 -2.309482
H -2.256284 2.420311 -1.255750
H -0.750220 -2.082176 1.692672
H 0.158861 -0.722665 2.342421
H -4.405115 2.439690 0.392810
H -4.122299 1.305750 1.752919
H -2.813926 2.404223 1.222908
H -3.970951 -0.969067 -1.289099
H -4.816289 -0.682604 0.258727
H -5.096167 0.423146 -1.125518
H 1.520410 -3.249608 1.128726
H 2.360075 -1.888886 1.910701
H 1.285667 -2.938985 2.873178
H 2.292545 -1.527799 -1.529174
H 3.272003 2.758645 0.727054
H 4.418685 -0.248636 -1.937566
H -0.541029 -3.663450 -0.235505


