%chk=000237008.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237008

0 1
Br -2.929537 0.166747 0.000903
Cl -1.205235 -2.673948 -0.000413
N 1.082376 1.193946 0.000237
N 0.981043 -1.265436 -0.000721
N 3.050903 -0.123178 -0.000607
C -0.272987 1.242501 0.000489
C -1.053389 0.052348 0.000569
C -0.897150 2.591891 0.000364
C 1.680720 -0.061891 -0.000068
C -0.369141 -1.175229 0.000149
H -1.535837 2.738477 0.887583
H -0.146788 3.400687 -0.001159
H -1.538197 2.737404 -0.885292
H 3.522152 -1.014787 -0.002480
H 3.599268 0.722569 -0.001753


%chk=000237008-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237008

0 1
Br -2.991229 0.139169 0.001448
Cl -1.224127 -2.762707 0.000209
N 1.096282 1.190734 -0.000708
N 0.994796 -1.247982 -0.000797
N 3.046056 -0.114538 -0.001218
C -0.267353 1.249195 -0.000007
C -1.046837 0.050448 0.000262
C -0.891642 2.621964 0.000464
C 1.676196 -0.054658 -0.001163
C -0.342006 -1.176365 -0.000219
H -1.534883 2.764037 0.887840
H -0.093419 3.378509 -0.000481
H -1.536922 2.763824 -0.885447
H 3.505561 -1.021352 -0.001211
H 3.577728 0.751823 -0.001169


