%chk=000181058.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181058

0 1
I -0.274227 -1.898033 1.382450
Cl 4.124198 1.756507 -2.381147
Cl 7.462731 -1.942489 -0.391064
O -2.946065 -0.636534 0.036228
O 1.560770 0.641888 0.861335
O 1.508394 1.233123 -1.322488
C -4.831820 0.827353 -0.468156
C -4.392339 -0.524755 0.135020
C -4.162794 1.964006 0.320294
C -6.365915 0.901175 -0.464397
C -4.929449 -1.706545 -0.676124
C -2.638269 1.783335 0.291633
C -2.243164 0.378669 0.791457
C -6.954888 -0.276976 -1.256959
C -6.460901 -1.633943 -0.730630
C -0.775006 0.046276 0.509456
C 0.191720 1.091442 1.036067
C 2.104059 0.711572 -0.412293
C 3.435549 0.066712 -0.393137
C 4.437587 0.477040 -1.287382
C 3.700546 -0.980350 0.507339
C 5.693667 -0.134309 -1.299244
C 4.947655 -1.606376 0.510421
C 5.923443 -1.172612 -0.392970
H -4.470234 0.871706 -1.525958
H -4.668616 -0.605917 1.207818
H -4.530874 1.986250 1.363001
H -4.432783 2.943581 -0.116707
H -6.702464 1.857581 -0.905005
H -6.751218 0.890933 0.572335
H -4.591310 -2.659134 -0.226296
H -4.493967 -1.692302 -1.694405
H -2.271090 1.928199 -0.745163
H -2.155719 2.563291 0.906853
H -2.502527 0.257108 1.867797
H -6.686465 -0.175238 -2.326689
H -8.059475 -0.240460 -1.214791
H -6.879703 -1.818564 0.277639
H -6.847670 -2.447059 -1.373845
H -0.633368 -0.120288 -0.587379
H 0.142839 1.231348 2.133908
H 0.069861 2.061506 0.510867
H 2.911884 -1.297897 1.204351
H 6.468743 0.188864 -1.996999
H 5.157472 -2.420686 1.205357


%chk=000181058-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181058

0 1
I -0.384270 -2.125555 1.377238
Cl 4.301945 1.823693 -2.524917
Cl 7.784095 -1.832038 -0.355808
O -3.012723 -0.739893 -0.127532
O 1.603989 0.488851 0.938458
O 1.615102 1.327796 -1.237890
C -4.902419 0.824150 -0.524269
C -4.473366 -0.559173 0.015603
C -4.122017 1.930128 0.220932
C -6.438919 0.974004 -0.416753
C -5.157820 -1.710830 -0.728440
C -2.593290 1.686225 0.153602
C -2.256263 0.251985 0.649880
C -7.166383 -0.176856 -1.154024
C -6.697604 -1.561857 -0.641782
C -0.776015 -0.116604 0.464354
C 0.191779 0.908458 1.067334
C 2.206228 0.725870 -0.313828
C 3.584788 0.151681 -0.337043
C 4.575628 0.530182 -1.283961
C 3.928800 -0.855186 0.610942
C 5.854306 -0.064685 -1.292614
C 5.194174 -1.468460 0.618926
C 6.141240 -1.059559 -0.340527
H -4.617830 0.853912 -1.598163
H -4.730532 -0.609791 1.102303
H -4.445778 1.951656 1.283233
H -4.360120 2.923353 -0.205600
H -6.749396 1.954495 -0.828963
H -6.734484 0.971240 0.654194
H -4.826601 -2.675303 -0.301870
H -4.832334 -1.690664 -1.787116
H -2.233876 1.799663 -0.887779
H -2.071081 2.438471 0.775970
H -2.537797 0.167438 1.725481
H -6.958227 -0.101223 -2.241012
H -8.261878 -0.076596 -1.029419
H -7.020272 -1.688768 0.412512
H -7.184167 -2.368905 -1.221546
H -0.569000 -0.283450 -0.605213
H 0.041307 1.030036 2.151477
H 0.069865 1.874644 0.543677
H 3.171260 -1.154542 1.339191
H 6.602444 0.246374 -2.025036
H 5.436310 -2.245369 1.348197


