%chk=000179067.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179067

0 1
Br -0.488922 -2.075412 0.794533
Cl 5.970086 -0.509102 0.095619
O -3.755295 -0.972183 1.134044
N 0.128888 0.458386 -0.152657
N -0.356735 1.675819 -0.553253
N -4.426246 0.189727 -0.714093
C 1.555189 0.220550 -0.099863
C -2.107293 0.282796 -0.045675
C -0.911144 -0.406156 0.173745
C -1.711591 1.586529 -0.498273
C 2.103234 -0.859275 -0.813015
C 2.360499 1.089601 0.655405
C -3.467392 -0.235042 0.205644
C 3.478763 -1.085876 -0.746345
C 3.736614 0.861921 0.713002
C 4.274065 -0.224515 0.016425
C -5.831476 -0.244978 -0.588922
H -2.356199 2.414336 -0.751954
H 1.469797 -1.511070 -1.418056
H 1.914982 1.936599 1.183615
H 3.927240 -1.921718 -1.286230
H 4.381909 1.523488 1.293945
H -4.191680 0.746755 -1.524309
H -6.136839 -0.850334 -1.457925
H -6.500616 0.626538 -0.501185
H -5.963738 -0.867979 0.320276


%chk=000179067-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179067

0 1
Br -0.657662 -2.389044 0.649632
Cl 6.151302 -0.275048 0.104595
O -3.786696 -1.417893 0.782875
N 0.131421 0.317307 -0.148275
N -0.363723 1.600333 -0.449494
N -4.478056 0.300698 -0.635921
C 1.556770 0.144607 -0.088306
C -2.122154 0.118276 -0.102941
C -0.910304 -0.577955 0.081677
C -1.715058 1.453961 -0.425232
C 2.179667 -0.999040 -0.639647
C 2.332119 1.174869 0.494721
C -3.506329 -0.411633 0.061331
C 3.583300 -1.131252 -0.574856
C 3.734948 1.051372 0.551946
C 4.340534 -0.106006 0.023256
C -5.900814 -0.045802 -0.555351
H -2.336902 2.330090 -0.605528
H 1.588364 -1.774509 -1.132313
H 1.833623 2.064165 0.888302
H 4.076027 -2.011352 -0.996928
H 4.343255 1.839640 1.003692
H -4.185848 1.035745 -1.280715
H -6.290974 -0.383243 -1.533645
H -6.502510 0.813160 -0.205196
H -5.998200 -0.872040 0.166818


