%chk=000190014.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190014

0 1
Br -4.244338 0.384215 2.223687
Br -5.254696 -2.518691 0.612982
Cl -3.064632 -1.968590 -1.432532
Cl -2.274588 -2.347743 1.252186
O -0.301745 2.004172 1.209259
O -1.038263 4.069715 0.646675
O 3.642043 -0.967405 -0.519162
C -2.138325 1.296299 -1.250427
C -2.364836 0.584673 0.092225
C -2.338415 2.113088 0.041971
C -3.658293 -0.118230 0.406833
C -3.240532 1.356191 -2.277645
C -0.758939 1.212090 -1.852383
C -1.207085 2.874370 0.630535
C -3.532944 -1.636083 0.252787
C 0.949158 2.556783 1.720488
C 2.036445 2.115464 0.777503
C 2.256741 0.743249 0.587811
C 2.816299 3.060422 0.100975
C 3.268184 0.352765 -0.292783
C 3.833364 2.637934 -0.766643
C 4.070568 1.281915 -0.978991
C 2.720739 -2.001597 -0.313542
C 1.384979 -1.925208 -0.720664
C 3.282417 -3.163810 0.233624
C 0.586279 -3.061965 -0.565249
C 2.462894 -4.285219 0.371150
C 1.119089 -4.235369 -0.021232
H -1.481283 0.110361 0.562747
H -3.285658 2.663334 0.171568
H -4.488111 0.245602 -0.261617
H -3.219391 0.473413 -2.933019
H -3.127983 2.241021 -2.921133
H -4.243994 1.409983 -1.836957
H -0.649107 0.308323 -2.466360
H 0.037628 1.188396 -1.089901
H -0.549714 2.075475 -2.499102
H 1.036897 2.092060 2.721314
H 0.864965 3.656748 1.822176
H 1.654295 0.009914 1.121935
H 2.635319 4.124913 0.241453
H 4.441891 3.379863 -1.285425
H 4.852991 0.931534 -1.648755
H 0.983049 -1.013457 -1.154719
H 4.328550 -3.176211 0.530985
H -0.460685 -3.030526 -0.872360
H 2.872927 -5.203900 0.790985
H 0.487542 -5.113879 0.095949


%chk=000190014-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190014

0 1
Br -5.035780 2.043173 2.033372
Br -7.124808 -0.532540 0.740505
Cl -4.678590 -1.532233 -0.951336
Cl -4.384308 -1.394963 2.058228
O -0.473015 1.617313 1.215164
O -0.684662 3.869059 0.623898
O 4.312067 -0.833783 -0.465518
C -2.418682 1.162048 -1.217358
C -3.062928 0.939033 0.171886
C -2.361312 2.279759 -0.124013
C -4.554443 0.898341 0.399869
C -3.278319 1.493206 -2.437232
C -1.183345 0.329477 -1.550665
C -1.117074 2.691665 0.586741
C -5.124875 -0.526708 0.589795
C 0.843724 1.929613 1.885851
C 1.993454 1.791157 0.911852
C 2.576003 0.519151 0.689785
C 2.488188 2.924530 0.217585
C 3.632219 0.388008 -0.238960
C 3.561452 2.780263 -0.690304
C 4.137988 1.513672 -0.926433
C 3.624851 -2.075757 -0.425184
C 2.297240 -2.235480 -0.887730
C 4.382919 -3.183394 0.013218
C 1.725765 -3.527578 -0.891749
C 3.799505 -4.469051 -0.002301
C 2.468709 -4.646987 -0.449126
H -2.494280 0.286222 0.842712
H -3.003654 3.143247 -0.325996
H -5.128661 1.380652 -0.407304
H -3.657913 0.569018 -2.909387
H -2.666917 2.032363 -3.183725
H -4.143080 2.137624 -2.198281
H -1.497930 -0.639926 -1.980496
H -0.566172 0.136697 -0.659068
H -0.556576 0.849139 -2.299545
H 0.887019 1.181236 2.692174
H 0.777868 2.949116 2.300924
H 2.211818 -0.357021 1.237549
H 2.020974 3.900756 0.382287
H 3.949390 3.656103 -1.221072
H 4.969095 1.379241 -1.625065
H 1.727043 -1.373907 -1.249403
H 5.410230 -3.021813 0.352993
H 0.698604 -3.657902 -1.250271
H 4.384855 -5.330569 0.337099
H 2.018039 -5.644869 -0.456763


