%chk=000261321.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261321

0 1
Cl 1.895980 0.932566 2.081598
Cl -1.895818 -0.937569 2.079517
O 1.785899 -2.303134 0.598849
O -1.785920 2.301701 0.604392
N 1.140479 -0.802822 -0.980856
N -1.140607 0.805037 -0.978808
C -0.175909 -1.502402 -1.136581
C 0.175761 1.504987 -1.133029
C 1.258884 0.514633 -1.642134
C -1.259101 -0.510845 -1.643193
C -0.030266 -2.675401 -2.107447
C 0.030006 2.680300 -2.101075
C 2.017355 -1.259771 0.010985
C -2.017417 1.259697 0.014138
C 3.273115 -0.468327 0.235268
C -3.273156 0.467732 0.236691
C 3.321622 0.539574 1.204525
C -3.321558 -0.542474 1.203550
C 4.436753 -0.786379 -0.476990
C -4.436876 0.787492 -0.474668
C 4.501692 1.238540 1.471554
C -4.501604 -1.242064 1.469051
C 5.622808 -0.092385 -0.220788
C -5.622907 0.092901 -0.219980
C 5.654850 0.915342 0.750454
C -5.654844 -0.917138 0.748860
H -0.472820 -1.897137 -0.122362
H 0.472794 1.897298 -0.117906
H 1.165913 0.361355 -2.741999
H 2.265566 0.955722 -1.475425
H -1.166278 -0.354962 -2.742704
H -2.265758 -0.952331 -1.477393
H 0.340359 -2.364367 -3.089439
H 0.688052 -3.409551 -1.709537
H -0.980598 -3.200046 -2.249908
H 0.980323 3.205279 -2.242401
H -0.340742 2.371614 -3.083762
H -0.688260 3.413502 -1.701325
H 4.413820 -1.581677 -1.223717
H -4.414024 1.584568 -1.219500
H 4.520098 2.017775 2.233971
H -4.519926 -2.023114 2.229611
H 6.527279 -0.342599 -0.774180
H -6.527442 0.344440 -0.772667
H 6.584111 1.449854 0.950210
H -6.584086 -1.452117 0.947450


%chk=000261321-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261321

0 1
Cl 2.175688 1.014973 2.198213
Cl -2.174568 -1.020665 2.194726
O 2.054887 -2.394416 0.534273
O -2.055488 2.393698 0.539443
N 1.166648 -0.726764 -0.818983
N -1.167065 0.729164 -0.817551
C -0.084859 -1.524304 -0.995107
C 0.084408 1.527133 -0.991930
C 1.211394 0.582729 -1.490052
C -1.211752 -0.578860 -1.491430
C 0.121515 -2.702118 -1.970469
C -0.121871 2.706895 -1.964959
C 2.163285 -1.251269 -0.013061
C -2.163626 1.251656 -0.010241
C 3.438172 -0.444267 0.157861
C -3.438293 0.443958 0.158996
C 3.597850 0.550368 1.147529
C -3.597323 -0.553406 1.146017
C 4.574793 -0.785757 -0.620916
C -4.575287 0.787209 -0.618467
C 4.824859 1.205687 1.367560
C -4.824062 -1.209677 1.364704
C 5.813737 -0.139328 -0.424135
C -5.813992 0.139936 -0.422952
C 5.939267 0.857770 0.571060
C -5.938872 -0.859894 0.569583
H -0.346923 -1.922921 0.001257
H 0.346328 1.923772 0.005254
H 1.118753 0.439567 -2.586765
H 2.186491 1.059992 -1.307707
H -1.118991 -0.433379 -2.587826
H -2.186881 -1.056478 -1.310167
H 0.437608 -2.344286 -2.968518
H 0.889586 -3.385756 -1.574814
H -0.818431 -3.272534 -2.089570
H 0.818084 3.277556 -2.082827
H -0.437849 2.351054 -2.963756
H -0.889982 3.389751 -1.568036
H 4.477089 -1.574252 -1.375182
H -4.478088 1.577776 -1.370628
H 4.905944 1.967508 2.148209
H -4.904625 -1.973693 2.143259
H 6.677465 -0.417857 -1.036561
H -6.678027 0.419888 -1.034295
H 6.897999 1.360422 0.736185
H -6.897395 -1.363284 0.733678


