%chk=000250023.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250023

0 1
Br 0.175354 1.903868 -1.336976
O 3.409381 1.843440 -0.761973
N -0.780313 -0.265798 0.429657
N -1.383149 0.955308 0.112811
N 3.365353 0.079191 0.675367
N 2.764569 -0.888146 1.378626
C -1.472344 -1.507853 0.145370
C -3.591898 -0.202806 -0.051549
C -2.679163 1.000644 -0.067191
C -2.803730 -1.474758 -0.064660
C 0.636664 -0.169775 0.450247
C -0.677094 -2.767836 0.098110
C -3.300175 2.332969 -0.331648
C 1.271102 0.818231 -0.267675
C 1.453742 -1.036737 1.287897
C 2.700777 1.036577 -0.206766
H -4.291979 -0.175019 -0.913615
H -4.232764 -0.163443 0.858460
H -3.371721 -2.379803 -0.259493
H 0.200559 -2.685539 -0.562001
H -1.274157 -3.609302 -0.286641
H -0.322254 -3.066873 1.096719
H -2.582414 3.160626 -0.197024
H -4.140399 2.523072 0.350359
H -3.677216 2.395932 -1.362390
H 0.989341 -1.817447 1.901886
H 4.388129 0.138981 0.796194


%chk=000250023-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250023

0 1
Br 0.963949 1.528963 -2.116181
O 3.801801 1.469211 -0.745358
N -0.768625 -0.216052 0.130195
N -1.449988 1.011799 -0.099933
N 3.273227 0.073717 1.043124
N 2.476149 -0.707923 1.836477
C -1.433288 -1.476492 -0.005734
C -3.587990 -0.236725 0.342718
C -2.763141 0.993431 -0.035591
C -2.798719 -1.492707 0.034183
C 0.629451 -0.088194 0.322560
C -0.589675 -2.686487 -0.349347
C -3.483229 2.289510 -0.313174
C 1.491407 0.676585 -0.472355
C 1.193288 -0.772094 1.473787
C 2.915766 0.815602 -0.125993
H -4.551801 -0.225166 -0.201376
H -3.854161 -0.168471 1.422713
H -3.329190 -2.420421 -0.196568
H 0.077697 -2.476234 -1.205539
H -1.250340 -3.525564 -0.621352
H 0.046971 -3.020663 0.489415
H -2.763109 3.106588 -0.474311
H -4.150890 2.552980 0.530325
H -4.121815 2.195491 -1.212993
H 0.545509 -1.354185 2.133391
H 4.254946 0.131206 1.329016


