%chk=000186715.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186715

0 1
Br -4.831893 2.195477 -0.210052
O 0.187592 2.221329 0.045699
O 0.655215 -2.433313 0.027698
N 2.028709 0.757483 -0.176189
N 2.177282 -0.631349 0.154797
N -0.069459 -0.155324 0.050936
C 3.140000 1.600189 0.361974
C 3.402893 -1.239430 -0.447542
C 4.458480 1.058278 -0.217433
C 4.616943 -0.443227 0.062412
C 0.644057 1.108423 0.029468
C 0.880958 -1.250932 0.024781
C -1.501187 -0.300660 0.092112
C -2.321815 0.833796 -0.055315
C -2.071270 -1.574009 0.278716
C -3.703667 0.660875 -0.011045
C -3.459644 -1.705763 0.315354
C -4.292700 -0.590699 0.171620
H 3.164392 1.596535 1.473949
H 2.946761 2.645940 0.028131
H 3.365547 -1.236372 -1.559196
H 3.439848 -2.300888 -0.109878
H 5.308077 1.620880 0.215019
H 4.490030 1.243207 -1.310879
H 5.536593 -0.828082 -0.418692
H 4.743976 -0.612133 1.151484
H -1.889040 1.832384 -0.197195
H -1.441142 -2.462786 0.391062
H -3.900886 -2.693564 0.458866
H -5.375852 -0.704965 0.202638


%chk=000186715-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186715

0 1
Br -4.837963 2.239628 -0.320310
O 0.199071 2.265122 0.177581
O 0.679797 -2.486692 -0.086392
N 2.009979 0.766513 -0.052459
N 2.158421 -0.649720 0.047049
N -0.040783 -0.159726 0.059630
C 3.137081 1.607906 0.385647
C 3.403337 -1.247292 -0.467382
C 4.442037 1.066415 -0.236933
C 4.608991 -0.444345 0.067759
C 0.659102 1.099016 0.069004
C 0.897938 -1.250568 0.002419
C -1.471991 -0.307622 0.099039
C -2.302381 0.830582 -0.093867
C -2.054839 -1.582783 0.326517
C -3.696803 0.659255 -0.053525
C -3.458475 -1.708035 0.356386
C -4.304631 -0.591687 0.167985
H 3.205808 1.598149 1.493762
H 2.911840 2.636518 0.061881
H 3.395586 -1.236319 -1.577569
H 3.415600 -2.296706 -0.132379
H 5.295577 1.637992 0.168777
H 4.421286 1.227607 -1.331798
H 5.531439 -0.832349 -0.399615
H 4.697699 -0.598132 1.160389
H -1.860321 1.815632 -0.248239
H -1.418156 -2.458749 0.456708
H -3.902763 -2.693804 0.529651
H -5.392685 -0.694504 0.193583


