XYZ coordinates of the optimized structure at the HSE06/6-31+G* level
Zn	-2.408829 -2.211450 -2.377303
Zn	0.128180 -0.159785 -1.794631
Zn	0.259403 -3.291319 -0.857503
Zn	-1.894754 -1.116371 0.601624
O	-0.943663 -1.680143 -1.081860
O	0.468637 0.856542 -10.775837
O	-1.536756 -1.837860 -4.231721
O	-2.133325 -4.248017 -2.686193
O	-2.054792 0.916434 0.672345
O	12.214466 3.575273 -7.487380
O	-0.029452 -0.835962 1.675293
O	-1.210099 1.466608 -1.360160
O	13.797463 4.210765 -6.004360
O	0.441813 -3.003907 1.250259
O	2.031368 -1.211914 -2.168519
O	-3.552576 10.433919 8.674692
O	2.293420 -3.059648 -0.879064
O	-5.374595 11.725149 8.174441
O	-1.633072 0.079276 -11.065458
O	-0.161726 -0.066037 -3.810536
O	-0.786120 -4.989485 -1.001023
O	-3.932512 -1.074519 0.089113
O	-16.506786 -3.280495 -4.290319
O	-14.259012 -1.809485 9.011112
O	-4.108490 -2.855600 -1.290909
O	-17.645946 -4.701991 -2.905653
O	-12.329087 -2.868703 9.635178
C	-0.535918 0.357180 -10.271065
C	-0.831508 -0.829500 -4.609769
C	-1.634325 -5.182859 -1.950340
C	-0.653195 0.026516 -8.816764
C	-0.759855 -0.532686 -6.070850
C	-2.068689 -6.588160 -2.214933
C	-1.569513 -0.922835 -8.323578
C	0.168947 0.399473 -6.563112
C	-3.378346 -8.170669 -3.507657
H	-2.216942 -1.482206 -8.995528
H	0.849895 0.881608 -5.868879
H	-4.036996 -8.364402 -4.351350
C	0.227089 0.672801 -7.930736
C	-1.619994 -1.202253 -6.955326
C	-2.964788 -6.857341 -3.263887
H	0.948180 1.375644 -8.335924
H	-2.308107 -1.937082 -6.551209
H	-3.310694 -6.031150 -3.876589
C	-1.804641 1.774346 -0.248806
C	12.805185 3.520852 -6.235571
C	0.813740 -1.823459 1.635511
C	-2.217171 3.185915 -0.012769
C	12.176887 2.607218 -5.235826
C	2.235531 -1.595391 1.986464
C	-3.055226 3.483432 1.076445
C	11.379025 1.507192 -5.605086
C	2.768200 -0.298594 2.091129
H	-3.412836 2.666187 1.695542
H	11.219120 1.254633 -6.651259
H	2.132590 0.567851 1.953163
C	-3.440979 4.800531 1.332140
C	10.825157 0.678519 -4.625063
C	-5.407350 11.328054 -1.086169
C	11.223481 -2.806579 1.693478
H	-4.117943 5.010264 2.155307
H	10.232974 -0.183111 -4.920286
H	-6.031806 11.361089 -0.198311
H	10.503946 -3.501468 1.272047
C	-2.996882 5.855533 0.507669
C	11.064962 0.923284 -3.258769
C	-4.368924 10.378997 -1.172702
C	11.417238 -1.548963 1.086517
C	-2.158468 5.544943 -0.583342
C	11.876338 2.017726 -2.899886
C	-3.617940 10.317652 -2.365283
C	12.377670 -0.677457 1.641202
H	-1.786387 6.343942 -1.218339
H	12.041703 2.249884 -1.853294
H	-2.799359 9.608907 -2.448300
H	12.527356 0.304519 1.203793
C	-1.773692 4.227875 -0.845868
C	12.427366 2.850031 -3.874365
C	-3.891590 11.174838 -3.431228
C	13.103072 -1.040743 2.776499
H	-1.124956 4.012753 -1.688366
H	13.036794 3.702139 -3.592005
H	-3.319750 11.123281 -4.352630
H	13.848773 -0.342752 3.153753
C	-3.405066 7.255542 0.776245
C	10.456253 0.071113 -2.210118
C	-4.082746 9.461542 -0.043749
C	10.621790 -1.133955 -0.090986
C	-3.678109 8.136761 -0.284764
C	11.205728 -0.349342 -1.100248
H	-3.631241 7.770310 -1.306344
H	12.260627 -0.095279 -1.046766
C	-3.544543 7.720164 2.095653
C	9.104627 -0.298275 -2.295524
C	-4.213120 9.900118 1.285723
C	9.261589 -1.477865 -0.189727
H	-3.338395 7.046772 2.922786
H	8.526684 0.023339 -3.157114
H	-4.468894 10.937412 1.482961
H	8.787956 -2.009981 0.630326
C	-3.948024 9.039476 2.365610
C	8.484185 -1.052617 -1.282491
C	-4.076599 9.519240 3.762827
C	7.027528 -1.325410 -1.341678
C	-4.325948 10.432242 6.422068
C	4.243667 -1.804785 -1.455524
C	-3.298226 9.536954 6.078015
C	4.785159 -0.643248 -2.030467
C	-5.228425 10.871116 5.436812
C	5.096518 -2.729466 -0.830908
H	-2.601282 9.210407 6.841871
H	4.120552 0.050646 -2.537354
H	-6.021096 11.556038 5.722218
H	4.661108 -3.625011 -0.401393
C	-3.178079 9.088162 4.760980
C	6.157326 -0.401439 -1.960879
C	-5.103173 10.417811 4.123349
C	6.472042 -2.493703 -0.780446
H	-2.362588 8.420851 4.497682
H	6.555173 0.518731 -2.379002
H	7.122993 -3.232060 -0.321173
C	2.778118 -2.043937 -1.501428
C	-4.494737 10.935732 7.800267
C	-4.619354 -2.041697 -0.409775
C	-16.671286 -3.960467 -3.099916
C	-13.055953 -2.426535 8.733004
C	-6.029874 -2.212381 0.014546
C	-15.585202 -3.700958 -2.134040
C	-12.761365 -2.487815 7.287469
C	-6.520056 -1.453301 1.092119
C	-14.514019 -2.840870 -2.433118
C	-13.639243 -1.956497 6.326463
H	-5.849324 -0.751241 1.577176
H	-14.485186 -2.344706 -3.396902
H	-14.557276 -1.480043 6.652141
C	-7.842697 -1.600863 1.511631
C	-13.509426 -2.625470 -1.487380
C	-13.317642 -2.036868 4.969882
H	-8.217662 -0.989257 2.327336
H	-12.701691 -1.935869 -1.714870
H	-13.987174 -1.597219 4.236322
C	-8.710248 -2.505600 0.862186
C	-13.549727 -3.260495 -0.228344
C	-12.119661 -2.647225 4.543051
C	-8.207838 -3.257142 -0.220651
C	-11.249030 -3.177423 5.519047
C	-14.630887 -4.121221 0.057706
H	-8.849948 -3.979491 -0.716205
H	-10.336829 -3.679259 5.209768
H	-14.665457 -4.642751 1.009750
C	-6.884222 -3.113850 -0.642007
C	-11.563533 -3.099373 6.876047
C	-15.638322 -4.340254 -0.882384
H	-6.503456 -3.704567 -1.467455
H	-10.901754 -3.513047 7.630924
H	-16.468163 -5.007767 -0.670988
C	-10.117222 -2.659663 1.304994
C	-12.480147 -3.028137 0.772295
C	-11.782206 -2.729284 3.101267
C	-10.452234 -2.586030 2.668456
C	-11.141865 -2.880532 0.367962
C	-12.786098 -2.950826 2.142291
H	-9.669434 -2.414050 3.401657
H	-10.895160 -2.938200 -0.688242
H	-13.816835 -3.063885 2.465723
C	-1.571714 -7.637593 -1.422563
C	-2.896692 -9.221415 -2.702741
C	3.078557 -2.705499 2.164595
C	4.125740 -0.118715 2.367346
C	-5.678073 12.196253 -2.147212
C	11.949356 -3.177182 2.824560
C	-4.914214 12.133872 -3.327257
C	12.884123 -2.290287 3.388597
C	-1.980477 -8.949745 -1.670302
H	-0.871723 -7.400279 -0.628748
C	-3.290130 -10.648153 -2.923645
H	2.658796 -3.698164 2.045314
C	4.428950 -2.519693 2.453182
H	4.515645 0.889811 2.468900
C	4.979277 -1.224266 2.556686
H	-6.520245 12.879280 -2.057849
H	11.791237 -4.141513 3.296640
C	-5.164417 13.017208 -4.504339
C	13.574888 -2.714748 4.629811
H	-1.600854 -9.778342 -1.080875
O	-4.483481 -10.869427 -3.587402
O	-2.616789 -11.605744 -2.547503
H	5.071728 -3.388179 2.562870
C	6.417232 -1.039477 2.864858
O	-5.834904 14.204056 -4.262702
O	-4.808286 12.744904 -5.650474
O	13.607893 -3.886535 5.026774
O	14.163101 -1.747495 5.406761
C	7.084578 -1.963206 3.690637
C	7.138578 0.056242 2.354393
C	8.443351 -1.809263 4.010397
H	6.528075 -2.785017 4.131521
C	8.493907 0.245546 2.676633
H	6.641723 0.762360 1.695097
C	9.164648 -2.823039 4.814240
C	9.132461 -0.693980 3.505438
C	9.282517 1.364476 2.108332
C	10.184628 -2.445358 5.710086
C	8.886656 -4.195834 4.656050
H	10.196838 -0.598324 3.698506
C	10.306338 1.974422 2.864425
C	9.070701 1.806590 0.786021
C	10.948872 -3.408127 6.374103
H	10.372084 -1.391092 5.894421
C	9.632492 -5.161699 5.337350
H	8.105461 -4.510396 3.969530
H	10.452778 1.679532 3.899307
C	11.120447 2.962437 2.309396
H	8.298369 1.342152 0.181862
C	9.889698 2.782931 0.218624
C	10.695523 -4.775106 6.168922
H	11.732818 -3.098547 7.059611
H	9.418622 -6.219918 5.220688
H	11.902784 3.433401 2.894559
C	10.931671 3.354959 0.971680
H	9.748434 3.099256 -0.810565
C	11.519715 -5.836094 6.831620
C	11.814351 4.342491 0.321782
O	12.846333 -5.554543 6.987860
O	11.038347 -6.905216 7.221122
O	12.709018 4.924866 1.193701
O	11.801025 4.633060 -0.885409
H	11.336328 3.150219 -7.529330
H	14.023931 -0.832919 5.094721
H	-5.911688 14.431435 -3.316173
H	-3.694041 10.788760 9.576973
H	-2.439672 -0.152263 -10.566296
H	-17.245797 -3.475695 -4.903323
H	-5.038017 -10.072041 -3.688471
H	13.212962 -4.872957 6.363293
H	13.276615 5.574454 0.728304
H	-14.420599 -1.788081 9.977248
H	-5.823277 10.738330 3.376065
H	-1.048918 1.784496 2.691817
H	-0.015186 0.599147 2.348531
O	-0.103851 1.570178 2.612261
H	-3.829496 1.468222 -5.190638
H	-2.471313 1.877251 -4.276843
O	-3.254982 1.240021 -4.448390
H	-3.786510 -0.075906 -1.833273
H	-3.412114 0.190776 -3.440974
O	-3.439217 -0.470208 -2.651760
H	-3.021947 -3.396816 1.773725
H	-1.339116 -3.231882 1.787603
O	-2.205176 -2.783124 1.675706
H	-1.224192 2.234847 -2.767657
H	-0.454719 2.047661 -4.152316
O	-1.204654 2.513285 -3.735017
H	-4.144812 -6.085947 -0.982326
H	-4.337744 -4.443441 -1.052133
O	-4.495957 -5.295541 -0.544933
H	1.075061 3.738134 0.714790
H	0.604040 2.384335 1.610713
O	1.100305 2.774259 0.789485
H	1.118135 -2.589939 -3.239558
H	-0.236998 -3.390553 -3.616279
O	0.545538 -3.359188 -3.031888
H	-4.918673 -4.309015 2.366912
H	-4.330243 -4.861410 0.913049
O	-4.158044 -4.342257 1.770387
H	2.397448 0.788375 -1.037474
H	1.321017 1.852416 -0.286433
O	1.476906 1.084108 -0.968932
 
