%chk=000252868.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252868

0 1
Cl -8.003879 2.475002 -1.790906
Cl -6.862196 -2.844967 2.777221
N -5.568558 -0.219119 0.017620
N 2.088047 1.097749 0.750342
N 0.808883 0.676749 0.669845
C 5.419990 -0.084555 0.043277
C 4.634104 -1.141863 -0.618155
C 4.510099 0.844875 0.644645
C 3.241759 -0.860187 -0.421829
C 3.111213 0.403772 0.361793
C 6.786752 0.102010 0.153019
C 5.034166 -2.262709 -1.323685
C 4.973922 1.941153 1.348071
C 2.272983 -1.710229 -0.921579
C -4.210074 0.182919 0.008526
C -6.522214 0.400227 -0.933094
C -6.178966 -0.716840 1.279264
C 7.254708 1.222720 0.869637
C 4.039687 -3.120104 -1.838010
C 6.368263 2.122599 1.455706
C 2.688416 -2.851656 -1.639282
C -3.672747 0.863095 -1.111957
C -3.346783 -0.164723 1.074025
C -6.867997 1.847241 -0.562828
C -6.121619 -2.248411 1.260458
C -1.458993 0.824668 -0.101272
C -2.318487 1.172897 -1.159102
C -1.993844 0.152407 1.012399
C -0.033120 1.178054 -0.190810
H 7.488921 -0.594531 -0.297984
H 6.086688 -2.485345 -1.479547
H 4.280503 2.644879 1.808674
H 1.212009 -1.519649 -0.763463
H -6.087634 0.358240 -1.962230
H -7.445903 -0.223351 -0.973578
H -5.653109 -0.319909 2.180251
H -7.234733 -0.375193 1.374414
H 8.328699 1.380047 0.963440
H 4.341331 -4.006268 -2.395729
H 6.749487 2.980861 2.007543
H 1.934477 -3.529011 -2.038123
H -4.307791 1.135986 -1.952328
H -3.724682 -0.685001 1.951869
H -5.973799 2.501066 -0.554834
H -7.355911 1.926771 0.425753
H -5.082986 -2.628241 1.209292
H -6.683267 -2.677289 0.409870
H -1.922858 1.694048 -2.032519
H -1.334758 -0.122104 1.842503
H 0.235498 1.861021 -1.012809


%chk=000252868-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000252868

0 1
Cl -8.385276 3.074148 0.691997
Cl -6.654252 -3.960093 -0.658453
N -5.669210 0.023452 -0.041072
N 2.146379 1.203351 -0.178342
N 0.879277 0.563236 -0.077583
C 5.504188 -0.135151 0.025992
C 4.734043 -1.384005 0.221070
C 4.573363 0.937200 -0.138885
C 3.332548 -1.072858 0.174609
C 3.192291 0.395265 -0.053194
C 6.888804 0.113917 -0.015394
C 5.167157 -2.706487 0.425195
C 5.012474 2.257379 -0.345344
C 2.369805 -2.091089 0.333249
C -4.304436 0.366803 -0.080890
C -6.723252 1.030337 -0.264901
C -6.109569 -1.359072 0.225726
C 7.333830 1.444595 -0.223456
C 4.195128 -3.726637 0.584227
C 6.406929 2.505418 -0.386724
C 2.812745 -3.421941 0.538890
C -3.882276 1.716870 -0.298012
C -3.283854 -0.626608 0.094090
C -7.046747 1.786910 1.037749
C -6.099640 -2.200914 -1.064716
C -1.506052 1.059502 -0.168853
C -2.518800 2.044428 -0.342606
C -1.927762 -0.284514 0.053436
C -0.102688 1.443151 -0.224926
H 7.615508 -0.696554 0.109325
H 6.234368 -2.951604 0.461880
H 4.284917 3.064976 -0.470007
H 1.308924 -1.838167 0.294749
H -6.427155 1.743648 -1.053644
H -7.635949 0.524123 -0.624801
H -5.474047 -1.835171 0.992514
H -7.134716 -1.338278 0.635142
H 8.408384 1.656999 -0.258738
H 4.516756 -4.762073 0.743946
H 6.775385 3.524783 -0.546278
H 2.078145 -4.225331 0.663989
H -4.613997 2.518537 -0.430774
H -3.549395 -1.674549 0.260471
H -6.183175 2.344389 1.427382
H -7.458616 1.124551 1.813575
H -5.094762 -2.292729 -1.500757
H -6.811715 -1.825019 -1.814275
H -2.227558 3.088399 -0.512393
H -1.162392 -1.055330 0.188252
H 0.139639 2.507607 -0.398632


