%chk=000251879.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251879

0 1
Cl -7.277971 0.359763 -3.335575
Cl -6.371598 -1.480305 3.615145
O -4.782803 1.513548 0.527703
O 4.029578 3.012281 -0.617537
O 6.156497 2.689682 -0.449646
O 6.754548 -3.291597 0.881616
O 8.036197 -1.574557 0.570324
N -5.162659 -1.192845 -0.278275
N 2.342167 1.084560 -0.290199
N 1.097864 0.492071 -0.226558
N 5.010011 2.288969 -0.416245
N 6.943641 -2.112136 0.634713
C -3.878725 -0.519133 -0.249845
C -6.237728 -0.423019 -0.979342
C -5.573192 -1.721799 1.053948
C -3.652538 0.844388 0.108625
C -2.775437 -1.285844 -0.638508
C -5.980683 -0.539464 -2.482871
C -6.009938 -0.660245 2.066110
C -2.379617 1.410713 0.044213
C -1.292062 0.609913 -0.354599
C -1.489831 -0.732475 -0.689069
C 0.045432 1.239619 -0.418698
C 3.461430 0.300068 -0.060086
C 4.770145 0.882551 -0.123045
C -4.678334 2.934359 0.797972
C 3.350973 -1.095549 0.243036
C 5.906833 0.075534 0.107670
C 5.759672 -1.273184 0.395693
C 4.464803 -1.863469 0.464971
H -7.227409 -0.868412 -0.730310
H -6.287350 0.649592 -0.674326
H -4.721494 -2.315083 1.463927
H -6.398066 -2.452522 0.880906
H -2.926514 -2.334271 -0.912131
H -5.011076 -0.099478 -2.780616
H -6.007998 -1.590312 -2.828395
H -5.218540 0.093558 2.251221
H -6.920626 -0.120882 1.749000
H -2.217934 2.450734 0.312962
H -0.645992 -1.354164 -0.991643
H 0.044798 2.323513 -0.624145
H -5.714288 3.185107 1.064495
H -4.366183 3.471944 -0.102032
H -4.003395 3.111415 1.640242
H 2.461012 2.107739 -0.504053
H 2.350479 -1.541764 0.297084
H 6.913922 0.530380 0.056357
H 4.385878 -2.934692 0.698015


%chk=000251879-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251879

0 1
Cl -7.920465 0.205842 -3.132125
Cl -5.809091 -3.647606 2.832779
O -4.782188 2.190171 -0.178261
O 3.945380 3.039522 -0.401683
O 6.205379 2.748392 -0.334976
O 6.901290 -3.406869 0.692455
O 8.209624 -1.555475 0.394477
N -5.393440 -0.587429 0.067915
N 2.353848 1.005705 -0.082323
N 1.105405 0.410872 0.002922
N 5.010660 2.273142 -0.266599
N 7.058746 -2.138427 0.482177
C -4.059830 -0.121965 0.012748
C -6.491454 0.014738 -0.731139
C -5.677482 -1.927951 0.632887
C -3.714984 1.273720 -0.140251
C -2.964805 -1.031757 0.164149
C -6.491472 -0.560962 -2.160050
C -5.506303 -1.909468 2.161206
C -2.370270 1.679724 -0.200767
C -1.300866 0.748159 -0.071742
C -1.627142 -0.620609 0.125570
C 0.071141 1.228890 -0.133446
C 3.496954 0.252161 0.052583
C 4.813764 0.845928 -0.033043
C -4.470305 3.619710 -0.279714
C 3.418539 -1.161537 0.285920
C 5.977295 0.058026 0.108192
C 5.846451 -1.316234 0.334763
C 4.565807 -1.935174 0.425349
H -7.454528 -0.208149 -0.239124
H -6.369683 1.104578 -0.768525
H -5.049843 -2.726190 0.192237
H -6.722100 -2.187507 0.393365
H -3.170576 -2.097004 0.297519
H -5.577284 -0.297767 -2.712786
H -6.665018 -1.647652 -2.190436
H -4.486130 -1.642105 2.470658
H -6.243350 -1.257201 2.650439
H -2.130871 2.741107 -0.323914
H -0.820165 -1.350902 0.232656
H 0.214192 2.314732 -0.300781
H -5.447720 4.123498 -0.273265
H -3.938647 3.850403 -1.222561
H -3.869582 3.957750 0.586013
H 2.510053 2.024890 -0.247466
H 2.422839 -1.603646 0.350445
H 6.963189 0.524824 0.039781
H 4.510935 -3.012098 0.603972


