%chk=000182739.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182739

0 1
Cl 2.677827 -3.046884 1.806823
O -0.181288 0.175979 0.590879
O -1.993952 1.244827 -0.923962
O -1.641196 0.122992 2.354587
O 1.853984 -0.227759 1.583574
O -0.317954 0.556962 -2.607101
O 0.185868 2.737963 0.317374
O 2.681463 2.713924 -1.183864
O 3.639966 -0.000455 -1.659619
O 1.673790 -1.495759 -0.359942
O 4.376875 -2.160862 -0.005832
C -2.173711 -1.023537 0.157412
C -2.158555 -0.153484 -1.138687
C -3.651613 -0.969277 0.639172
C -3.580472 -0.263850 -1.736370
C -4.478831 -0.899745 -0.665224
C -1.172857 -0.655687 1.252841
C -1.028950 -0.583789 -2.116343
C -3.886732 0.207881 1.538890
C 0.840756 0.756376 1.405306
C 1.359813 1.968530 0.598998
C 2.051704 1.521500 -0.702910
C -2.903232 0.702431 2.294308
C 2.541348 -0.721332 0.418671
C 3.133562 0.450952 -0.414177
C 3.577434 -1.689416 1.047344
H -1.952442 -2.078126 -0.149700
H -3.901678 -1.898163 1.206518
H -3.594585 -0.841296 -2.673694
H -3.934003 0.756781 -1.994486
H -5.405295 -0.316454 -0.525258
H -4.798322 -1.911301 -0.971189
H -0.647461 -1.506436 1.740226
H -1.409151 -1.134233 -2.994549
H -0.244308 -1.197589 -1.621607
H -4.881780 0.643243 1.534150
H 0.492437 0.974404 2.437545
H 2.046777 2.594133 1.218765
H -1.236758 1.456300 -0.282394
H 1.312076 1.166137 -1.472016
H 4.018107 0.912081 0.087053
H -2.915862 1.527313 2.996584
H -0.888568 1.377030 -2.498870
H 4.190847 -1.201541 1.838224
H 0.410476 3.441786 -0.345136
H 3.208099 2.499281 -1.994693
H 3.196142 -0.849055 -1.933853
H 0.837232 -0.977451 -0.617476
H 4.948770 -2.914330 0.279708


%chk=000182739-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182739

0 1
Cl 1.762043 -3.335847 1.429844
O -0.218996 1.098101 0.511174
O -2.413805 1.408664 -1.363586
O -2.333974 1.425815 1.456793
O 1.582379 -0.127445 1.530749
O -0.185582 0.248081 -2.256185
O 1.302110 3.479451 0.604642
O 3.532708 2.644168 -0.959938
O 3.681954 -0.114828 -1.645257
O 1.209157 -1.221316 -0.641050
O 3.827638 -2.433277 -0.151692
C -1.918184 -0.643266 0.111667
C -2.419798 -0.072037 -1.277903
C -3.146118 -1.361874 0.757680
C -3.847832 -0.660440 -1.475012
C -3.954489 -1.843129 -0.483443
C -1.319195 0.377293 1.084815
C -1.470732 -0.455137 -2.436714
C -3.952699 -0.405204 1.619012
C 0.958018 1.184804 1.376170
C 1.951905 2.190011 0.773868
C 2.528443 1.657090 -0.542159
C -3.564386 0.867026 1.889423
C 2.160903 -0.749703 0.266505
C 3.180653 0.282372 -0.336311
C 2.934412 -1.950086 0.858196
H -1.117161 -1.380631 -0.076911
H -2.820173 -2.228393 1.365450
H -4.037316 -0.955031 -2.523116
H -4.575872 0.129184 -1.217442
H -5.000431 -2.096729 -0.235554
H -3.478922 -2.751089 -0.901949
H -1.018131 -0.128431 2.024384
H -1.915801 -0.138781 -3.398357
H -1.250869 -1.534590 -2.461328
H -4.917693 -0.746025 2.011634
H 0.660352 1.473510 2.400040
H 2.795626 2.270847 1.494790
H -2.494868 1.809639 -0.453666
H 1.741369 1.580551 -1.316097
H 4.017414 0.394215 0.388158
H -4.150413 1.598478 2.452001
H -0.455840 1.147783 -1.905940
H 3.449499 -1.662697 1.789170
H 1.932261 4.049416 0.090433
H 3.979399 2.286524 -1.769961
H 3.936320 -1.075934 -1.587435
H 0.788222 -0.527183 -1.286726
H 4.342292 -3.212924 0.173131


