64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=83.42078059551238 stress="-0.0016177891458572006 0.0006816939765612729 -0.0001880215758744556 0.0006816939765612729 -0.0024042258289046635 -0.00020617529822972684 -0.0001880215758744556 -0.00020617529822972684 -0.0017629779816182858" pbc="F F F" O 35.15797350 34.89796232 34.99426193 0.71241045 0.57745962 0.30377578 Zn 36.89543447 36.23018542 35.87167184 -1.91648144 -4.57260836 -2.52389262 Zn 37.93698606 37.96892610 35.17992250 0.90786287 -6.21495228 -6.82682277 O 39.25066079 39.12801312 36.80290044 -46.52520437 18.47644013 -47.14800803 Zn 37.90777444 34.86805914 37.36552624 -12.98650889 -1.76889122 -19.54766366 O 38.63869929 35.92713189 38.81637839 -7.27914335 15.06305205 -7.08735956 Zn 35.42295019 38.20583244 37.35278758 0.08712308 1.55170533 4.35192251 O 36.47689996 39.24431733 38.93099584 -1.99325037 0.64186947 -0.21862031 Zn 40.28364945 35.66488118 34.97738308 -1.28369077 -17.09666976 -32.69882080 O 40.85696437 35.98807910 36.74569653 38.81158440 -23.15096123 36.22485134 O 42.45381834 37.95767140 34.68717708 1.72925436 0.17728000 1.71610706 O 43.95313122 38.12939051 36.15426806 -1.71379728 -0.13988946 -1.74213789 O 42.52521663 34.61992394 37.58281451 23.78183194 -43.45172115 -24.95706296 O 44.14786233 36.58129035 38.16025336 0.00369140 -0.01432885 0.03281211 Zn 40.43399638 37.06341300 37.62876493 -82.41173329 38.52327789 -3.50600860 O 41.06129485 38.45452046 38.36250509 67.88448146 13.57922816 71.23651682 Zn 35.30189202 39.52365898 34.87375122 0.20515193 2.40308937 -1.45096147 O 35.87584287 41.58636917 35.64753316 2.82743181 -1.23525954 -0.86446956 Zn 37.26051449 42.53616583 34.58089311 -1.62822478 -1.12705111 1.24528605 O 38.35215850 43.55965693 37.04385026 2.76463816 35.46438628 -26.17402037 Zn 37.73165455 40.35640122 36.91220703 -17.96624098 4.03224197 -5.94382444 O 38.57230587 41.38196207 38.28286236 -17.95265515 -52.32335882 33.16305870 Zn 34.95335647 43.12557972 38.24653475 -10.13582106 -1.67160257 -3.62746506 Zn 36.64221708 43.96320516 38.70115711 -0.70888047 7.61751782 4.57068144 Zn 40.29264029 40.51578446 34.69288959 1.02209457 -2.10296049 -1.62951622 O 40.93716554 42.12738380 36.53542382 24.19986053 -31.82770951 -39.32895676 O 42.60602308 43.26340612 34.66408089 2.47600487 0.69852087 3.66280955 O 43.61653838 43.54848877 36.15895884 -2.47600487 -0.69852087 -3.66280955 Zn 42.51697460 40.30236655 37.66048434 9.69635065 -13.02280224 -16.25151939 O 42.95200845 41.15851866 39.48178660 15.63291593 -18.30266613 -8.82548184 O 40.16819221 42.68090577 36.91566559 -4.13261470 51.76456940 -2.53363429 O 41.18972545 43.50555586 38.73763196 -10.65384556 25.07554544 -0.14985881 O 34.75612371 34.70933670 40.91462045 -12.61127256 -7.13054789 -2.31092281 Zn 36.24293488 35.55811243 40.96471619 -1.37109473 7.69984268 -16.27524751 Zn 37.85535711 37.03756613 40.64305957 -7.60021230 2.27121296 1.04443172 O 38.97740562 39.20718749 41.50915256 -23.97123039 63.49800668 -26.75697977 Zn 37.19772719 35.12193521 42.26645001 15.34003592 -5.98201602 16.93591174 Zn 38.65587666 35.77768298 43.96710901 0.25285177 -0.02265778 0.71545553 Zn 34.99378359 36.88407228 41.94513355 -3.47313057 4.29871641 1.71491140 O 35.89856811 39.03595027 43.65768328 2.10160080 1.08096677 -0.25606781 Zn 39.52719125 34.77006853 39.66375227 27.53403034 -19.27824363 23.35324536 Zn 41.07024044 36.38627495 40.87560970 -1.92162495 -32.51919683 -1.60909476 O 42.05778694 37.28308263 39.72517215 19.69910912 17.57654156 -20.05460242 Zn 43.57422608 38.63205662 41.14681452 9.94108766 -4.29977966 -1.44504876 Zn 42.21098860 34.87357945 42.67097318 0.30063526 0.32039499 0.03924128 O 43.94513366 36.54941826 43.98238218 -0.81878695 -0.79581565 -0.61756381 O 40.17369928 37.04508350 42.05723056 18.56391970 -47.53441211 37.57818145 Zn 41.04499372 37.99549480 43.83551480 -0.85361271 -1.21833331 2.53615911 Zn 34.97353837 39.97214569 40.40189209 -11.58330100 -10.26347617 -10.24601412 O 36.36575364 41.04037774 41.22299524 13.58360610 0.99064259 12.48382793 Zn 37.42504602 42.34513145 39.66085383 3.96426397 10.64977811 8.28756483 O 38.73533313 43.76083543 41.34387120 -0.12093445 -2.20265337 -1.43040797 O 37.09244517 39.99312290 42.88098042 -8.52101591 -0.02230770 1.00135283 O 38.25948424 40.47509977 43.57223153 -2.14790956 4.35340305 8.67111275 Zn 35.23482200 42.87484817 42.14658776 0.07500129 4.37609864 3.34687395 O 37.08404687 43.36312602 43.37507265 -2.91012225 -0.75534390 -0.93028708 O 39.64160428 40.14387892 40.30013020 1.79677806 -15.85431528 13.15181858 Zn 41.07555011 41.58913217 41.61145360 10.00831212 -0.40998682 -3.66707340 Zn 42.02490913 42.33859636 39.77499806 -5.73507536 17.74355295 43.27736728 O 43.42822333 43.23201510 41.07065087 0.47524256 0.40088471 -0.00588046 Zn 42.41907040 39.79707065 41.99393695 -3.86880146 7.96612281 3.85573663 Zn 44.14072211 41.08722863 43.56665123 -0.37006788 -0.24384541 -0.28533119 Zn 40.07793409 42.36711365 42.87829954 -11.14735183 -9.21119265 -0.52835622 Zn 40.45793569 43.85428231 43.58340540 4.41047910 17.59372909 8.61677933