%chk=000216180.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216180

0 1
Br 2.281264 2.755117 -0.858010
Cl 2.264515 -2.413870 1.113343
O -2.557291 0.755074 -1.423584
N -4.396494 -0.184554 0.641050
N 3.453952 0.288415 0.375830
C -2.194459 -0.237595 -0.447274
C -0.700999 -0.116051 -0.256749
C -2.942882 0.033868 0.882071
C -0.037516 1.069761 -0.612241
C 0.023934 -1.190454 0.274992
C 1.333646 1.170583 -0.422112
C 1.399378 -1.076673 0.460146
C 2.097881 0.108273 0.121790
H -2.470584 -1.230264 -0.873872
H -2.774185 1.094981 1.175969
H -2.517166 -0.589891 1.694728
H -0.615606 1.896229 -1.045752
H -0.479821 -2.121307 0.542717
H -3.538190 0.877647 -1.414589
H -4.950110 0.282323 1.352905
H -4.624861 -1.173266 0.683339
H 4.010858 -0.524543 0.600500
H 3.964739 1.003196 -0.124497


%chk=000216180-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216180

0 1
Br 2.183286 2.874441 -0.973633
Cl 2.450751 -2.424517 1.152405
O -2.710321 0.639511 -1.401794
N -4.382380 0.100234 0.606632
N 3.511561 0.298006 0.306168
C -2.196423 -0.339932 -0.455790
C -0.692785 -0.185281 -0.298910
C -2.945121 -0.115520 0.902418
C -0.053121 1.025533 -0.655261
C 0.085024 -1.234314 0.248993
C 1.325787 1.176133 -0.451303
C 1.459749 -1.049673 0.442983
C 2.151030 0.152413 0.108038
H -2.420790 -1.371266 -0.814913
H -2.549717 0.805688 1.366180
H -2.741940 -0.959488 1.594163
H -0.654043 1.817231 -1.109418
H -0.371777 -2.193572 0.514479
H -3.659380 0.778410 -1.082659
H -4.861181 0.747208 1.238687
H -4.922983 -0.758681 0.459163
H 4.049447 -0.469477 0.700578
H 3.975329 1.163913 0.043492


