%chk=000179070.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179070

0 1
Br 0.604794 0.190992 -1.942534
Cl -1.322165 2.373720 0.883174
Cl -5.927190 0.224559 -0.835274
O 4.114137 -1.594698 0.270819
N -0.212037 -0.416992 0.626782
N 4.033340 0.611732 -0.257356
N 0.155034 -0.774906 1.895409
C 2.027221 -0.517463 0.591134
C -1.600728 -0.252367 0.271614
C 0.903882 -0.253292 -0.190477
C 3.451255 -0.568256 0.194094
C 1.512646 -0.847185 1.891855
C -2.214748 1.011648 0.357851
C -2.339776 -1.372032 -0.146725
C 5.436718 0.594370 -0.728638
C 3.333754 1.907732 -0.351929
C -3.559453 1.169650 0.014111
C -3.683741 -1.222522 -0.491380
C -4.272547 0.044062 -0.407599
H 2.089201 -1.127009 2.762618
H -1.860177 -2.354176 -0.196989
H 6.067078 1.246985 -0.103484
H 5.846988 -0.435050 -0.664546
H 5.502743 0.923379 -1.777698
H 2.967020 2.085374 -1.378445
H 2.471332 1.952177 0.335392
H 4.012056 2.734103 -0.079015
H -4.040289 2.149126 0.078991
H -4.268747 -2.084761 -0.818756


%chk=000179070-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179070

0 1
Br 0.762984 0.494117 -2.025155
Cl -1.279573 2.528325 0.433664
Cl -6.127723 0.134141 -0.751146
O 4.107875 -1.612383 0.266803
N -0.239620 -0.409245 0.555360
N 4.068927 0.655185 -0.292413
N 0.122652 -0.975456 1.792520
C 2.019997 -0.468957 0.539789
C -1.625025 -0.253906 0.232557
C 0.885310 -0.110194 -0.207382
C 3.467053 -0.515231 0.159897
C 1.483099 -1.009713 1.752460
C -2.236788 1.018902 0.130287
C -2.420873 -1.410071 0.058164
C 5.461037 0.593630 -0.769664
C 3.479098 1.999971 -0.208941
C -3.604612 1.150915 -0.177660
C -3.794921 -1.306733 -0.236018
C -4.361853 -0.022572 -0.358336
H 2.038996 -1.424549 2.590581
H -1.945804 -2.389803 0.161971
H 6.134340 1.153919 -0.092064
H 5.775661 -0.460379 -0.793411
H 5.535651 1.031136 -1.783154
H 3.314912 2.429376 -1.215678
H 2.515628 1.970777 0.320374
H 4.162497 2.670677 0.347804
H -4.064256 2.138840 -0.257555
H -4.407067 -2.201818 -0.370656


