%chk=000299427.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299427

0 1
Br 3.169245 1.011308 0.581060
O 1.311514 -2.020626 0.707169
N -3.114135 0.744995 0.336062
N 0.856658 -0.315144 -0.820902
N 2.969415 -1.423860 -0.795585
C -0.491288 -0.009612 -0.448611
C -0.843660 1.366707 -0.364818
C -1.467721 -1.003969 -0.210631
C -2.181635 1.692240 0.045605
C -2.777582 -0.566442 0.208226
C 0.052758 2.457103 -0.653076
C -1.264400 -2.421831 -0.380406
C -2.574848 3.081573 0.169936
C -3.803428 -1.546898 0.498186
C -0.347551 3.754904 -0.526863
C -2.258496 -3.316966 -0.116880
C -1.684130 4.072823 -0.104803
C -3.545878 -2.873773 0.342424
C 1.668800 -1.306952 -0.204072
C 4.086226 -1.640355 0.147879
C 4.521962 -0.346959 0.785981
C 5.655289 -0.118502 1.429714
H 1.064937 2.232607 -0.985500
H -0.291439 -2.774258 -0.725664
H 1.270778 0.321545 -1.507952
H -3.599226 3.284600 0.489208
H -4.770580 -1.172999 0.838548
H 0.331931 4.577892 -0.742385
H -2.097560 -4.386234 -0.244355
H -1.960758 5.123163 -0.013879
H -4.304575 -3.626202 0.558006
H 3.209233 -0.836317 -1.596406
H 4.927759 -2.122325 -0.403630
H 3.761976 -2.364989 0.943989
H 5.914313 0.827532 1.892185
H 6.427994 -0.869578 1.557039


%chk=000299427-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299427

0 1
Br 4.963943 1.186126 1.414160
O 1.277688 -1.314982 1.479057
N -3.429150 0.667327 -0.102777
N 0.800963 -0.059936 -0.472177
N 2.944286 -0.931230 -0.118929
C -0.596440 0.148518 -0.289230
C -1.088517 1.491510 -0.297771
C -1.515582 -0.937708 -0.175723
C -2.532084 1.693922 -0.229725
C -2.936948 -0.611074 -0.061173
C -0.235400 2.650047 -0.355111
C -1.132596 -2.323765 -0.210221
C -3.052002 3.035219 -0.282276
C -3.891577 -1.681235 0.067117
C -0.774556 3.933817 -0.394839
C -2.086690 -3.330221 -0.099352
C -2.197899 4.129326 -0.372431
C -3.479539 -3.008572 0.052725
C 1.643479 -0.810243 0.381701
C 4.010619 -1.506947 0.701184
C 5.262502 -0.653158 0.749348
C 6.509961 -1.050447 0.413905
H 0.853997 2.530255 -0.321159
H -0.078126 -2.590089 -0.308444
H 1.261994 0.589388 -1.114321
H -4.139702 3.146776 -0.239995
H -4.943524 -1.397115 0.165527
H -0.110652 4.804693 -0.424981
H -1.775866 -4.380333 -0.123946
H -2.603895 5.146037 -0.408825
H -4.213477 -3.816223 0.148999
H 3.165498 -0.644866 -1.073586
H 4.305617 -2.510162 0.330917
H 3.580980 -1.640752 1.711623
H 7.383797 -0.401964 0.510204
H 6.670797 -2.067737 0.035323


