%chk=000249392.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249392

0 1
Br -3.513159 2.640364 0.002832
O 0.914899 -2.847506 0.148113
N -3.976239 -0.296058 0.117356
C 0.114388 0.619298 0.030761
C -0.319573 -0.744018 0.086511
C 1.585760 0.644762 0.011005
C 2.067104 -0.702993 0.054456
C 0.905167 -1.645184 0.103999
C -1.641710 -1.097895 0.116462
C -0.817538 1.642506 0.004997
C -2.620007 -0.047737 0.090372
C 2.475228 1.704447 -0.039355
C -2.173420 1.294574 0.035170
C 3.420912 -0.977849 0.047271
C 3.855925 1.416322 -0.046394
C 4.323198 0.105054 -0.004111
C -4.518065 -1.666816 0.174056
H -1.939901 -2.143300 0.158720
H -0.511893 2.688514 -0.037466
H 2.128222 2.733402 -0.072784
H 3.783645 -2.005772 0.080465
H 4.566611 2.242967 -0.085893
H 5.393421 -0.093163 -0.010493
H -4.659662 0.455004 0.097467
H -4.184863 -2.197888 1.084806
H -4.209527 -2.262385 -0.704935
H -5.620221 -1.633849 0.188114


%chk=000249392-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249392

0 1
Br -3.539463 2.760645 -0.002960
O 0.904826 -2.878783 0.147178
N -4.018470 -0.353307 0.118512
C 0.118535 0.639316 0.029614
C -0.316833 -0.716039 0.084214
C 1.601762 0.663418 0.010309
C 2.073992 -0.686011 0.053170
C 0.893605 -1.617232 0.101647
C -1.666288 -1.072718 0.113856
C -0.841813 1.666864 0.003754
C -2.668845 -0.047032 0.089168
C 2.522374 1.725549 -0.039404
C -2.205523 1.309772 0.033518
C 3.443433 -0.989894 0.046962
C 3.910939 1.421253 -0.045680
C 4.372015 0.082614 -0.003241
C -4.541665 -1.717412 0.178381
H -1.951411 -2.128182 0.155694
H -0.558359 2.722790 -0.038492
H 2.189623 2.768976 -0.072958
H 3.777768 -2.032332 0.080299
H 4.638844 2.239792 -0.084168
H 5.447719 -0.122664 -0.009259
H -4.675864 0.426702 0.097509
H -4.206049 -2.247956 1.091410
H -4.233569 -2.316824 -0.701157
H -5.642581 -1.676505 0.193627


