%chk=000186513.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186513

0 1
Cl -1.550366 -1.438909 2.278800
Cl -3.184527 0.405243 3.677719
Cl -0.405088 0.927873 3.388794
O 2.511079 0.345424 -0.515738
O 2.203041 2.777741 -2.012427
O -6.174305 -1.641487 -1.617251
C -2.124681 1.068326 1.269342
C -0.911993 1.432578 0.434582
C -3.162427 0.316345 0.466751
C -1.819224 0.281605 2.554383
C 0.258431 0.662817 0.395878
C -0.998635 2.597671 -0.344029
C 1.338330 1.069757 -0.392593
C -2.791404 -0.666784 -0.458565
C -4.526923 0.604152 0.669092
C 1.253288 2.253552 -1.171115
C 0.068475 3.005775 -1.143042
C -3.757794 -1.361366 -1.191989
C -5.505838 -0.071247 -0.046548
C -5.106885 -1.054486 -0.978153
C 2.896998 -0.479045 0.632749
C 4.316031 -0.876775 0.335955
C 4.658593 -1.347155 -0.940272
C 5.292647 -0.793489 1.338423
C 3.524860 2.178520 -2.008108
C 5.973637 -1.733619 -1.210597
C 6.604861 -1.189197 1.063654
C 6.947080 -1.658054 -0.208881
C -5.895870 -2.672007 -2.596181
H -2.574261 2.051420 1.610464
H 0.343609 -0.260137 0.963757
H -1.909567 3.196466 -0.335701
H -1.735275 -0.897485 -0.615621
H -4.821671 1.358464 1.400598
H 0.005322 3.910388 -1.747984
H -3.452270 -2.118295 -1.905909
H -6.564452 0.134376 0.094682
H 2.791184 0.116601 1.556414
H 2.222948 -1.355725 0.664541
H 3.894301 -1.400122 -1.716389
H 5.035560 -0.423114 2.329224
H 4.059794 2.814591 -2.721672
H 3.962259 2.230478 -1.006699
H 3.465508 1.139343 -2.352218
H 6.239752 -2.096543 -2.202188
H 7.362836 -1.129213 1.843345
H 7.970443 -1.963516 -0.419600
H -5.310620 -2.261633 -3.423979
H -6.906803 -2.945221 -2.926478
H -5.395786 -3.521284 -2.122018


%chk=000186513-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186513

0 1
Cl -1.180242 -0.768628 2.909699
Cl -3.504968 0.969538 3.692595
Cl -0.745772 2.166576 3.546284
O 2.600235 0.710020 -0.413792
O 2.257799 2.937481 -2.145826
O -5.783760 -2.183018 -1.549652
C -2.173617 1.369628 1.236464
C -0.928475 1.748500 0.418637
C -3.092840 0.383328 0.496585
C -1.902655 0.952987 2.713234
C 0.290616 1.028034 0.447659
C -1.045079 2.850280 -0.461062
C 1.377001 1.401760 -0.375769
C -2.583284 -0.724550 -0.219930
C -4.497233 0.598963 0.489894
C 1.260028 2.529161 -1.245687
C 0.038609 3.233005 -1.278182
C -3.438912 -1.608796 -0.911218
C -5.364944 -0.267562 -0.195788
C -4.837778 -1.380614 -0.897227
C 2.718378 -0.522303 0.389976
C 4.053302 -1.166313 0.075745
C 4.565638 -1.170001 -1.245869
C 4.781018 -1.814927 1.102990
C 3.614704 3.185435 -1.609369
C 5.787962 -1.816553 -1.532623
C 5.998995 -2.471592 0.813811
C 6.506200 -2.473540 -0.505618
C -5.289170 -3.342417 -2.297448
H -2.749486 2.308648 1.362956
H 0.397574 0.183010 1.130535
H -1.982487 3.416246 -0.506101
H -1.503508 -0.896166 -0.260533
H -4.916619 1.454328 1.031442
H -0.035821 4.087475 -1.957705
H -3.009446 -2.454019 -1.456952
H -6.446594 -0.104433 -0.205229
H 2.639153 -0.281513 1.469053
H 1.878683 -1.199078 0.121335
H 4.010501 -0.652283 -2.035146
H 4.399486 -1.805895 2.131725
H 4.193806 3.550136 -2.471390
H 3.579478 3.965205 -0.824202
H 4.057745 2.261941 -1.203837
H 6.179589 -1.810005 -2.556045
H 6.553089 -2.970872 1.616412
H 7.453080 -2.976939 -0.730548
H -4.611869 -3.032731 -3.116898
H -6.187709 -3.816810 -2.718043
H -4.766200 -4.056526 -1.632141


