%chk=000239376.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239376

0 1
Cl 8.211459 0.604036 -2.848770
Cl 6.621097 0.663260 4.077667
O -2.928896 -1.823041 -0.467933
O -4.794374 -1.220355 1.038118
O -3.841671 4.137552 0.149805
O -2.074720 -3.808421 -1.125357
N 5.567164 0.344498 0.171570
C 4.372529 -0.398044 -0.009478
C 6.759447 0.024322 -0.658801
C 5.876409 0.913253 1.505406
C 1.912627 -1.714776 -0.467743
C 4.186716 -1.195607 -1.164260
C 3.309204 -0.281604 0.917093
C 2.975931 -1.844631 -1.379707
C 2.099710 -0.926977 0.681182
C -0.573641 -1.909354 -0.534788
C -3.364192 0.446607 0.252606
C -2.384445 -0.574587 -0.081327
C 0.654430 -2.419272 -0.719339
C 6.787565 1.001727 -1.839121
C 6.285258 -0.155429 2.525707
C -1.026126 -0.586110 -0.108313
C -4.618522 0.116137 0.814753
C -3.057003 1.800551 0.011573
C -1.831270 -2.692601 -0.770038
C -3.998036 2.779251 0.325822
C -5.562029 1.119294 1.128427
C -5.255757 2.447351 0.884166
C -6.111430 -1.696743 1.476404
C -2.605530 4.608597 -0.475587
C -5.918894 -3.199632 1.489483
C -2.803712 6.110625 -0.534103
H 7.697381 0.116601 -0.065245
H 6.740905 -1.029035 -1.026648
H 6.684513 1.673527 1.392080
H 4.984715 1.477710 1.874007
H 4.983115 -1.309738 -1.896929
H 3.418306 0.323427 1.815200
H 2.848976 -2.456098 -2.274985
H 1.288447 -0.832369 1.407076
H 0.762128 -3.447856 -1.093012
H 6.881199 2.052890 -1.508524
H 5.882024 0.922822 -2.470891
H 7.196996 -0.702745 2.224313
H 5.482221 -0.899339 2.695785
H -0.357306 0.219889 0.125253
H -2.093906 2.054571 -0.424413
H -6.524695 0.858544 1.560737
H -5.960329 3.247417 1.111647
H -6.864649 -1.368239 0.740493
H -6.320170 -1.274403 2.472652
H -2.520629 4.149100 -1.475304
H -1.756653 4.313929 0.164617
H -5.339056 -3.518456 0.604022
H -5.345993 -3.533479 2.363523
H -6.874536 -3.733084 1.475355
H -1.938494 6.611485 -0.982194
H -2.961171 6.530873 0.469322
H -3.693638 6.371977 -1.124155


%chk=000239376-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239376

0 1
Cl 9.104185 -1.435274 -2.110243
Cl 6.343673 2.819982 3.198564
O -2.961749 -1.656848 -0.950365
O -5.013012 -1.440773 0.916592
O -4.146752 4.127723 0.691223
O -1.787417 -3.374473 -2.041950
N 5.946676 0.040390 0.142524
C 4.653924 -0.430470 -0.156503
C 7.150481 -0.724821 -0.232712
C 6.159942 1.323165 0.837866
C 1.985929 -1.394110 -0.770110
C 4.452512 -1.641273 -0.892538
C 3.484704 0.282880 0.262857
C 3.160942 -2.098350 -1.181276
C 2.198557 -0.184544 -0.037971
C -0.597642 -1.513372 -0.862083
C -3.603349 0.403538 0.282984
C -2.565175 -0.500041 -0.217412
C 0.692948 -1.951631 -1.122570
C 7.567873 -0.422953 -1.685146
C 6.077134 1.145184 2.366220
C -1.186544 -0.389855 -0.155144
C -4.845976 -0.058765 0.818052
C -3.348247 1.804190 0.241812
C -1.744172 -2.326437 -1.373990
C -4.307156 2.730759 0.704357
C -5.810416 0.883833 1.261904
C -5.545420 2.262924 1.206723
C -6.317077 -1.961510 1.375060
C -2.882358 4.665181 0.155872
C -6.222366 -3.483150 1.306013
C -2.967199 6.185440 0.261781
H 7.977947 -0.450580 0.445045
H 6.983942 -1.808522 -0.104161
H 7.157973 1.714764 0.573811
H 5.426898 2.078558 0.505271
H 5.303939 -2.228079 -1.248519
H 3.575900 1.211028 0.834685
H 3.044931 -3.029830 -1.748755
H 1.345107 0.402161 0.308576
H 0.730657 -2.888431 -1.699980
H 7.851392 0.630471 -1.827611
H 6.799370 -0.716013 -2.414453
H 6.868478 0.486248 2.753370
H 5.089244 0.795342 2.698170
H -0.672280 0.395391 0.392288
H -2.407333 2.140611 -0.201819
H -6.768377 0.545846 1.665433
H -6.285886 2.994095 1.544744
H -7.119673 -1.575720 0.713336
H -6.511609 -1.614403 2.411514
H -2.759698 4.342086 -0.899035
H -2.031393 4.267257 0.747954
H -6.001872 -3.808590 0.275777
H -5.417441 -3.853099 1.963398
H -7.177358 -3.937886 1.627097
H -2.041775 6.646532 -0.128707
H -3.097487 6.496014 1.312452
H -3.822049 6.568009 -0.321376


