256 Lattice="16.42000970573926 0.0 0.0 0.0 16.42000970573926 0.0 0.0 0.0 16.42000970573926" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1093.973205345725 stress="-9.625292851843865 4.667452998445963 4.734057955645227 4.667452998445963 8.137904945466964 -7.872003510045722 4.734057955645227 -7.872003510045722 4.06257691791529" pbc="F F F" Zr -0.00684923 -0.00146296 0.01980506 0.41017132 0.80102329 0.59686633 Cu 2.02834783 2.04553622 -0.00047533 -0.07631801 0.12928699 0.68043429 Zr 2.01506162 0.06411796 2.05327860 0.61606250 -0.17303909 -1.20062131 Cu 0.01190545 2.03816763 2.05484866 0.29786123 0.09039963 -0.50543163 Cu 4.09448727 -0.03752634 0.01931992 -0.18604438 0.88091292 0.82116235 Zr 6.20582403 2.01544914 0.03696931 -0.21561144 -1.57243986 -0.01357276 Cu 6.14418675 -0.00068173 2.02743890 -0.03650513 0.55961941 -0.14069976 Cu 4.15455967 2.08808622 2.05319047 -0.19430044 -0.73115979 -0.20352557 Cu 8.20724962 -0.01226237 -0.02213519 0.10096513 0.58952428 0.71614818 Zr 10.29383639 2.06890055 0.01254389 -0.53352851 -0.06294728 -1.54443297 Zr 10.23641886 0.03405712 2.05390757 -0.47710859 -1.44591196 -0.12584119 Cu 8.19742040 2.06018235 2.02931229 0.01458833 -0.57924640 0.27025717 Zr 12.33978586 -0.02882327 -0.01002155 0.72609944 -0.15307443 -0.13104649 Cu 14.32730627 2.06528898 0.01193810 -0.77908393 0.00692652 0.65624069 Cu 14.33103155 -0.03374124 2.00490880 -0.74740935 0.70733817 0.22323119 Zr 12.29034855 2.03930280 2.06347426 2.57065389 0.54566912 0.33512490 Cu 0.01990529 4.03033074 -0.01748295 0.90403771 -0.23229153 0.90586495 Zr 2.05952026 6.11552424 0.02352527 -0.61126422 0.13925368 0.17986529 Cu 2.04402740 4.07463905 2.04667314 -0.34901811 -0.10630516 -0.44673768 Cu 0.00739432 6.15546585 2.08900778 0.28762953 0.14347426 -0.27066010 Zr 4.07545166 4.06855992 0.00851468 -0.74447819 -0.48938270 -0.09956579 Zr 6.13463175 6.16539384 -0.00190235 -0.67983053 1.69298631 -0.68977129 Zr 6.18166771 4.12230262 2.08406207 -0.96188089 -1.33009942 0.01506117 Cu 4.08447077 6.16857652 2.04978627 0.12703841 0.33859048 -0.31186661 Zr 8.17176797 4.08945811 0.01454023 0.28173556 -0.26522962 -1.65887969 Zr 10.27793877 6.17956634 0.02624201 1.11879517 0.34167402 -1.37849517 Zr 10.23201723 4.10820829 2.04603177 1.33297652 0.37622047 0.72730580 Zr 8.18731463 6.18362117 2.06183523 0.04948980 1.85263498 0.27676178 Cu 12.34590068 4.13469477 0.02194724 0.33964459 -0.14211313 0.46926241 Cu 14.32895142 6.15968736 -0.01052794 -0.85718465 0.01479151 0.95601866 Cu 14.40056508 4.13475941 2.02410003 -0.88882288 0.19903143 -0.13935880 Cu 12.31143768 6.17113998 2.05305073 0.41725214 -0.29662457 0.10816387 Cu -0.02295388 8.18795967 -0.00590273 0.74008202 -0.03215671 0.74110732 Cu 2.03382742 10.25535973 0.00116758 -0.02012715 -0.13469755 0.55460641 Zr 2.09088353 8.20452808 2.07933507 -1.50924056 0.51168570 -0.98462006 Cu -0.03318215 10.29595432 2.01749784 0.85342407 0.00339478 -0.19541863 Cu 4.12093187 8.23184665 -0.00852333 -0.31690710 -0.25521097 0.52616158 Zr 6.15417979 10.28687672 -0.01045978 -0.42876417 -1.24047045 -1.30469720 Cu 6.20362918 8.21272196 2.08873122 -0.18132612 -0.03093986 -0.35460390 Zr 4.13060719 10.22938323 2.07307542 -0.69450073 0.22859330 -0.97472475 Cu 8.20877897 8.16934944 0.00287529 -0.08809263 0.26361903 0.10641322 Zr 10.28663865 10.19675234 0.00800168 0.42644868 -0.11900661 -0.66659197 Zr 10.26714484 8.18932053 2.05000885 0.97843716 0.24702473 1.20528167 Zr 8.17846729 10.26211106 2.07847375 0.97249133 -0.68621828 0.75353199 Cu 12.29323356 8.27740344 0.03016215 0.61990905 0.13675060 0.47742091 Cu 14.39818758 10.24376161 -0.02134549 -0.93451744 0.02952484 0.77368662 Zr 14.36769322 8.18507456 2.04030420 -0.77132361 0.43176671 -0.43927235 Cu 12.34808252 10.24853286 2.06336832 0.07320925 0.21582232 0.02460004 Cu -0.00176223 12.36726281 0.00001953 0.80895403 0.06047107 1.03123437 Cu 2.07675180 14.33102021 0.02745366 -0.11747662 -0.72920005 0.71561457 Zr 2.06421372 12.33288089 2.06080022 -0.03294368 0.46100801 -0.65878494 Cu 0.02826930 14.40120297 2.05327305 0.72973345 -0.77018897 -0.11652969 Cu 4.10975386 12.30077551 0.00326483 -0.14859923 0.37671166 0.36820182 Cu 6.17969311 14.39346616 -0.01399161 -0.11555881 -0.69551012 0.73304219 Zr 6.16986314 12.29775233 2.02669931 -1.12266834 1.49898448 0.22963420 Cu 4.11441799 14.38424972 2.10921189 -0.02013616 -0.70286983 -0.12643590 Zr 8.23952315 12.34714196 0.01862923 0.61288422 0.72081667 -1.29567452 Cu 10.26181111 14.40501362 0.02871697 0.29875961 -0.81389929 0.57466235 Cu 10.26560040 12.31273557 2.03504200 0.38750573 0.01128039 0.26647730 Zr 8.24414082 14.39678046 2.03933778 0.74253824 0.45850193 0.31771557 Zr 12.33623822 12.27915943 -0.01785322 0.33737785 0.52226820 1.06438005 Cu 14.34365135 14.34134637 -0.01463302 -0.69038353 -0.72505076 0.83180562 Cu 14.37739634 12.25527777 2.05446770 -0.85861706 -0.14099090 0.09417356 Cu 12.29553447 14.39982922 2.08172009 -0.06779409 -0.92639425 0.02335184 Zr -0.03446206 0.00849712 4.11258240 -0.82407696 0.20145475 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0.15191356 Zr 12.29491921 2.06245815 6.09423138 1.15725228 0.09888975 0.34337601 Zr -0.03344212 4.13013297 4.10215131 -1.13111140 -0.84211094 -1.16118480 Zr 2.03899913 6.15578347 4.07612802 -0.42993478 0.51660198 -1.07667171 Zr 2.05150835 4.12669817 6.15939498 -0.35208016 -1.05205898 1.19143354 Zr 0.03005365 6.12520541 6.18522869 -1.59749222 0.75889485 -0.19747552 Zr 4.13903031 4.08949312 4.09054170 -0.46124315 -0.47458617 -1.64343392 Zr 6.16560699 6.11691943 4.11903354 -0.27078244 1.75999202 -1.20401703 Zr 6.13932331 4.07479281 6.14498910 -0.48445512 -1.22727055 0.81117025 Zr 4.09897268 6.18131657 6.17029474 -0.93410761 0.35806702 0.88044593 Zr 8.18594545 4.13514510 4.07549848 1.19123869 -1.07945008 0.32864014 Cu 10.23577570 6.14652042 4.09238277 0.69403564 0.05174641 -0.12859808 Cu 10.22265673 4.08086384 6.22805656 0.55654346 0.69458712 -0.24665734 Zr 8.19234917 6.18462430 6.13890334 1.93219865 -0.25421198 -0.49423139 Cu 12.32993634 4.07490790 4.09006723 0.27431325 0.18685192 -0.05171102 Zr 14.36987104 6.12277389 4.14520737 0.10641827 -0.79755303 -0.95789030 Cu 14.33636877 4.14115154 6.15645413 -0.38087944 -0.24861485 0.18360483 Zr 12.35417113 6.12939342 6.13836762 -1.05005485 -0.86401396 0.65659953 Cu 0.00556979 8.19199269 4.10619814 0.49637335 0.24267701 0.06456676 Cu 2.07583135 10.27061320 4.13242675 -0.51306966 -0.04838362 -0.11650449 Cu 2.05448414 8.24188609 6.11050673 -0.40768677 0.51535448 0.02365397 Cu 0.03451669 10.27601689 6.10517923 0.57845621 -0.28562376 0.16328170 Zr 4.10786349 8.25703797 4.10968145 -0.42208220 -0.42238233 -0.55237180 Zr 6.18074342 10.23352743 4.12282630 1.08662029 0.80268879 0.54291706 Zr 6.13297482 8.18740015 6.20610081 0.66519941 1.02715200 -0.16524677 Zr 4.13333892 10.24699689 6.14279685 -1.40933874 0.81549594 0.77927935 Cu 8.19588257 8.27255838 4.09504882 0.21703517 -0.13473540 0.21548781 Cu 10.27172999 10.25576897 4.05272535 0.12903147 0.33761482 0.11960160 Zr 10.22406380 8.22602137 6.14621671 0.78821358 0.40865247 -1.20549935 Cu 8.17449065 10.25657283 6.14052922 0.24163762 0.43446948 -0.30715958 Cu 12.29188782 8.20643929 4.06219504 0.29443576 0.29287828 0.00518976 Cu 14.35136142 10.19345217 4.11124680 -0.74825507 0.22443813 -0.12401047 Zr 14.37605543 8.20139382 6.15820253 -0.05193350 1.15738193 0.58323811 Cu 12.28741521 10.22208833 6.18052016 0.28927512 0.25562212 -0.00529167 Zr -0.03288750 12.33588487 4.08024293 -0.08799265 -0.03162706 0.01621817 Cu 2.08346841 14.34560450 4.10230853 -0.03393888 -0.43570403 -0.10357399 Zr 1.98979714 12.28930149 6.21928322 0.41104565 0.33250165 -0.21729687 Cu -0.02047027 14.40120793 6.16772085 0.82393165 -0.65925582 -0.01200480 Cu 4.13909978 12.28627784 4.11216719 -0.72817557 0.26082375 0.00306102 Zr 6.11731517 14.32638453 4.14273046 -0.22665109 0.17862225 -0.36284258 Cu 6.14547803 12.31613719 6.14186961 -0.18687602 -0.12302588 -0.16186489 Zr 4.11390815 14.40294643 6.15582481 -0.87063464 -0.14731757 0.21611167 Cu 8.20635884 12.28697009 4.11504239 0.61737596 0.31281968 0.14440914 Cu 10.22561940 14.40318546 4.13432219 0.24855379 -0.76047047 -0.05049407 Cu 10.25748823 12.37416135 6.17749109 0.56576519 -0.24593901 -0.41466962 Zr 8.16992957 14.36060862 6.18541403 1.22894080 0.14444381 -0.59590123 Cu 12.32745670 12.28032216 4.10763831 0.04070794 0.09669748 -0.38316086 Zr 14.38015582 14.33192187 4.10325938 -0.41250807 -0.36943247 -0.87292734 Zr 14.34710699 12.33571332 6.20733849 0.02799580 -1.80174824 -0.19507470 Zr 12.35022973 14.36974622 6.19168193 -1.73188217 0.11007601 -0.35950701 Cu -0.02656312 -0.00440339 8.21283066 0.49813427 0.55340889 0.10401569 Zr 2.04578910 1.99544580 8.21907379 -1.04362729 0.09955739 1.16378010 Cu 2.00844028 -0.04103568 10.28643542 0.01871521 0.53737410 -0.29078509 Cu -0.02043636 2.09487657 10.25411878 0.70752650 -0.20742590 0.18287204 Cu 4.14338980 0.00087130 8.21939680 0.12276999 0.26404557 0.11929220 Cu 6.17466583 2.06186056 8.21263894 -0.27799821 -0.83388313 0.15286130 Cu 6.15164857 0.02953255 10.25413481 0.09523918 0.56697804 0.00675752 Zr 4.13238921 2.08737333 10.27613693 0.15500444 -0.39178820 -0.45530126 Cu 8.15470005 -0.02781079 8.16412706 0.03126448 0.63261644 -0.06807749 Zr 10.30310714 2.08858493 8.17524763 0.99279137 -1.49578721 0.27937861 Cu 10.25958301 -0.03707617 10.23631415 0.22971971 0.68304260 0.00070920 Zr 8.23188474 2.06972155 10.27128922 -1.03343727 -2.66438229 -0.03104939 Cu 12.29237752 -0.00313043 8.23514833 0.30772608 0.56515429 0.15835328 Cu 14.40816692 2.08260976 8.19238796 -0.93466618 -0.12640070 0.02816736 Zr 14.38951109 -0.02210756 10.28821206 -0.54744339 0.88626725 -0.42216657 Cu 12.31433111 2.02090404 10.29911980 0.34149434 0.01561267 -0.36968972 Cu 0.06083986 4.07672483 8.17643453 0.07253028 -0.00100648 0.39707731 Zr 2.02073763 6.18628932 8.17589399 0.30116968 -0.53722994 0.80981516 Cu 1.98899609 4.14224936 10.21780120 -0.13496880 0.05377629 -0.02332497 Cu 0.03989125 6.18270869 10.24303255 0.51327003 -0.28368652 -0.03646064 Cu 4.14561302 4.09497918 8.27221384 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8.22148888 0.05149198 0.56487962 0.05447524 Cu 2.09400684 14.36994287 8.25019634 -0.20009863 -0.44897181 -0.07082524 Cu 2.10911316 12.34107608 10.23551625 -0.41322463 0.19809557 -0.19956512 Cu -0.00853175 14.36539869 10.27838043 0.82288496 -0.72656653 -0.04534736 Cu 4.11680519 12.28473442 8.23404814 -0.72277738 0.38276421 -0.13034490 Zr 6.14839069 14.35045058 8.24468621 -0.50904915 1.03985077 -0.79633018 Zr 6.15031261 12.34962388 10.25443467 0.17604516 -0.91779203 0.57885866 Zr 4.09345211 14.32718095 10.26080612 -1.77227589 1.08401346 -0.45826021 Zr 8.22780572 12.29670411 8.20693128 1.19435947 0.41623181 -1.25100138 Cu 10.29172457 14.40251138 8.13916982 0.04612664 -0.80610506 0.25067207 Cu 10.26860696 12.33966306 10.31780672 0.14342678 -0.23910294 0.05478856 Zr 8.22407736 14.33424632 10.29613708 1.14464050 1.14259585 -0.25045706 Cu 12.31594131 12.30244964 8.20452508 -0.14448487 -0.04483819 -0.04153224 Zr 14.32693786 14.37742837 8.21543476 0.48211318 0.05122825 0.65919970 Cu 14.40047260 12.33585099 10.19613522 -0.50488975 -0.12861624 -0.08229687 Zr 12.27731475 14.36397219 10.27633951 -0.24538619 -0.36889985 -0.51659665 Zr 0.03416673 -0.00488136 12.30838015 0.34279122 0.11887017 -0.46796801 Zr 2.04990828 2.08575343 12.33332274 -0.05636028 0.30580894 -0.54366683 Cu 2.09295002 -0.03714958 14.35683880 -0.19106870 0.51198767 -0.37524406 Zr -0.03595587 2.07433605 14.40836867 0.41527818 -0.02799873 0.44497661 Zr 4.11959131 -0.00013091 12.36836684 0.29217548 -0.87860158 -0.38917888 Cu 6.15797952 2.03745616 12.30709707 0.09179630 -0.53577354 0.40000491 Cu 6.12232598 0.02825196 14.35673129 0.19473038 0.74025359 -0.53550680 Zr 4.09773158 2.05213013 14.40643381 -0.08025159 0.10292707 0.48999597 Cu 8.18713402 0.03717069 12.32396264 -0.11434124 0.57787079 0.15778545 Zr 10.25974879 2.05700186 12.34044755 -0.13927225 -1.20559212 -0.07686779 Cu 10.31937457 0.02003451 14.34528278 -0.03302380 0.52461897 -0.37417980 Cu 8.25637789 2.06916735 14.38861785 -0.29049277 -0.32627192 -0.62238300 Zr 12.29118259 0.02988235 12.31947908 -0.08801059 -0.55244208 -0.69105917 Cu 14.34158301 2.06513271 12.26430036 -0.68167382 0.16471581 -0.00413000 Zr 14.32933712 -0.00855157 14.39103948 0.17537550 0.43719858 -0.50563105 Zr 12.30697381 2.06962565 14.39713348 0.41870990 0.01253633 0.61988020 Zr 0.01764666 4.09474617 12.34055486 0.08793377 1.10465019 -0.66427525 Cu 2.06750262 6.15064161 12.27919716 -0.34555673 -0.47759274 0.36074665 Cu 2.10727581 4.08807296 14.35322930 0.01315618 0.50344759 -0.39127319 Cu -0.03267510 6.13224338 14.37394236 0.63867291 -0.25158036 -0.52541820 Cu 4.12813426 4.09473574 12.29818102 -0.24060740 0.23428314 0.54996234 Cu 6.12421084 6.14653405 12.32064127 0.11705127 0.12662948 -0.00852219 Zr 6.16981450 4.06103743 14.39270690 -0.50545211 -0.02010208 -0.02574561 Cu 4.12378457 6.19323312 14.34006872 0.11827222 -0.53489385 -0.62845971 Zr 8.18036362 4.11625144 12.27954555 -1.07511641 0.06235549 0.38819658 Zr 10.28053580 6.15310110 12.31064876 -0.04715714 0.56225295 -1.72441177 Zr 10.27800212 4.09530061 14.37262228 -0.03338938 -0.44905271 1.36514904 Zr 8.21841220 6.15565460 14.39583296 -0.64589237 0.59498756 0.69773448 Cu 12.34907894 4.04751933 12.27840538 0.40577308 0.00699236 -0.29931210 Zr 14.36520618 6.13277436 12.34668287 0.37676193 0.09977878 -1.20355186 Zr 14.39427629 4.13556619 14.36807967 0.25335424 -0.82785534 -0.04749893 Zr 12.32623973 6.16133757 14.39599116 0.58323678 -0.23835721 1.42337470 Zr -0.01491634 8.19338543 12.29969970 -1.20863568 -1.27849041 0.61533615 Zr 2.05885287 10.22684619 12.33496721 -0.10170186 0.85612951 0.43504378 Zr 2.07161723 8.21912113 14.37477898 -0.11187858 -0.84682674 1.03858565 Cu -0.00237199 10.21696403 14.38468596 0.28073437 0.14501400 -0.48149043 Zr 4.11120796 8.21754378 12.31517701 1.39996845 -0.64693990 0.71373639 Cu 6.13961890 10.31187273 12.28789190 0.11559640 -0.16044709 0.14732769 Zr 6.16032891 8.24018205 14.40232792 -0.52112102 -0.03236199 -0.11376200 Cu 4.07663852 10.26282242 14.39540675 0.46653280 0.01961300 -0.36137833 Cu 8.23107526 8.23660596 12.28891250 -0.20512819 -0.26808819 -0.27168058 Cu 10.30899624 10.23322307 12.32370239 -0.23406652 0.35421279 -0.54495172 Zr 10.29319289 8.20709623 14.33258240 -0.93837258 0.72644493 1.12141963 Zr 8.16574503 10.30524107 14.35443937 0.08023257 -0.37767843 -0.33217323 Zr 12.30295560 8.23103125 12.34810172 0.92538818 0.30838259 -1.56461885 Cu 14.32668644 10.29296327 12.35931182 -0.28099006 0.12773797 -0.04608708 Cu 14.36382054 8.23932349 14.38781121 -0.47073600 -0.17653568 -0.50815192 Zr 12.29889910 10.22927348 14.36012713 1.21825440 0.90091907 0.43863057 Zr 0.01234124 12.31148595 12.31606673 -0.33927125 1.21400294 0.01422982 Cu 2.11001244 14.35306180 12.26715967 -0.32053384 -0.47600110 0.28479974 Zr 2.07427631 12.28183194 14.34347666 -0.17495793 0.73220348 1.09826597 Cu 0.01128835 14.40006293 14.37667106 0.57844489 -0.63771380 -0.60732959 Zr 4.09063913 12.33051969 12.31647002 -0.47800236 -0.17456555 0.71902762 Zr 6.13848490 14.32685811 12.34668244 -0.03251705 1.73002060 0.47848673 Zr 6.17950988 12.32955460 14.37175356 -0.89059959 -0.61496581 0.89119104 Cu 4.08267965 14.36299993 14.36094250 0.02477137 -0.29700874 -0.54002382 Cu 8.14938215 12.35086270 12.37345948 0.23137736 -0.46718015 -0.45182753 Zr 10.22196335 14.36465116 12.29691806 0.28903653 0.18556283 -0.23340412 Zr 10.23798545 12.29878194 14.38627440 0.33384738 -0.51766144 0.08720514 Zr 8.22178728 14.36339690 14.36044396 -0.02106187 0.76005500 0.76787265 Cu 12.27610823 12.27438815 12.29597251 0.54371783 -0.12765213 0.09058180 Zr 14.38644869 14.33542074 12.33481608 -0.10076319 -0.78243512 -0.44769766 Cu 14.38383924 12.35664894 14.34344151 -0.72479941 -0.12766856 -0.53971900 Zr 12.32420523 14.35445456 14.33402303 0.27146521 -0.15039602 0.27189334