108 Lattice="10.633392053517186 0.0 0.0 0.0 10.633392053517186 0.0 0.0 0.0 10.633392053517186" Properties=species:S:1:pos:R:3:forces:R:3 energy=-314.2848819941414 stress="-0.005086049057404031 -7.669856353768452e-06 -8.571334628953547e-05 -7.669856353768452e-06 -0.004745493455321865 -0.0006801627010402453 -8.571334628953547e-05 -0.0006801627010402453 -0.00493605791548503" free_energy=-314.2848819941414 pbc="F F F" Cu 0.02066269 0.02317932 0.01514693 0.45675480 0.48266083 0.43151851 Cu 1.78202237 1.79683370 0.02485188 -0.02594221 -0.19681919 -0.35593232 Cu 1.74986468 0.00019295 1.75234880 0.12570975 -0.17630104 0.06542414 Cu 0.00097998 1.78378677 1.75121431 -0.28798749 -0.11733333 0.05087115 Cu 3.57695295 0.01001692 0.01432250 -0.17868352 0.17578794 0.17500866 Cu 5.28710023 1.79557260 0.00214816 0.31197506 -0.22451226 -0.46542898 Cu 5.30294481 0.02448510 1.78916943 0.09776635 -0.48931539 -0.13569513 Cu 3.57926928 1.79477171 1.77438107 -0.30538571 -0.16391960 0.23231391 Cu 7.12373927 0.02203600 0.03236810 -0.20859449 0.24046419 0.13936583 Cu 8.85294099 1.79438041 0.01834252 -0.30358446 0.12300185 0.29556790 Cu 8.83174858 0.01743350 1.75264019 -0.11424178 0.21771609 0.11074227 Cu 7.06957582 1.75245172 1.76698751 0.20104801 0.21759983 -0.18930888 Cu 0.03019488 3.55587887 0.02126521 0.06747037 -0.11859999 0.06866988 Cu 1.74548475 5.31641176 0.02009488 0.12254614 0.02258445 -0.52223624 Cu 1.80218870 3.54776959 1.80189366 -0.06062699 -0.14882897 -0.20858945 Cu 0.01909995 5.29595963 1.75910088 -0.47436910 0.23708496 0.02685248 Cu 3.55221591 3.52090548 0.01645441 -0.13682504 0.23780607 -0.44115523 Cu 5.33601001 5.30821685 0.00194690 -0.18286103 0.19680084 -0.45655157 Cu 5.34823381 3.54614511 1.74424069 -0.23646174 0.07819292 0.42613862 Cu 3.51317607 5.34890080 1.75636796 0.34678556 -0.22065835 0.06970074 Cu 7.05668142 3.58277644 0.00363649 0.39652346 -0.25372519 -0.32304803 Cu 8.87219648 5.31115459 0.02113226 -0.23393571 0.08452236 0.22719854 Cu 8.89062629 3.56453082 1.80125917 0.16253493 -0.11725431 -0.29029159 Cu 7.05885711 5.34660267 1.77442236 0.35360736 -0.09351060 0.01077419 Cu 0.02323404 7.11365612 0.02152655 0.22574800 -0.02347991 0.24535037 Cu 1.80124243 8.85663025 0.02117457 -0.04248432 -0.23330885 0.22285921 Cu 1.77539115 7.06380265 1.77233370 -0.10382160 0.28362272 0.01055233 Cu 0.02817148 8.87871392 1.75675609 0.32652151 -0.29206975 0.07877214 Cu 3.53498378 7.09159480 0.00273357 0.09469973 0.12517473 -0.32577866 Cu 5.34826864 8.89596208 0.02771708 -0.06303592 -0.26292924 0.21592927 Cu 5.35844292 7.08864921 1.74258599 -0.19496584 0.22157635 0.15393706 Cu 3.51679530 8.87971375 1.79359518 0.19334617 0.20729590 -0.14580398 Cu 7.10358448 7.09810991 0.01025255 0.15956002 0.12673323 -0.34114772 Cu 8.88630760 8.82933249 0.00651283 -0.55429897 -0.51598005 0.57873723 Cu 8.86861206 7.08656556 1.80677084 0.25679829 0.04922308 -0.20335681 Cu 7.09453800 8.89520396 1.78788071 0.11424132 0.15716375 -0.05665817 Cu 0.02888910 0.03283176 3.56815636 0.14504872 0.14347803 -0.09410714 Cu 1.76691602 1.79014559 3.56610740 0.15057532 -0.22353882 -0.23853252 Cu 1.76268178 0.01152186 5.37117145 0.02374025 -0.39941099 -0.22299177 Cu 0.03264774 1.80009431 5.32570092 -0.52846839 -0.03213664 0.04507667 Cu 3.53732900 0.00111753 3.56053801 -0.18730798 -0.24120582 -0.08907957 Cu 5.34545572 1.76455071 3.54560073 -0.26342551 0.26886604 -0.02232519 Cu 5.29671853 0.02148803 5.31928643 0.11647321 -0.43923722 0.04832668 Cu 3.56097700 1.80017594 5.33566882 -0.19943654 -0.06783400 -0.18032884 Cu 7.08856716 0.03469609 3.53802055 0.10343318 -0.51074810 0.07065841 Cu 8.84825921 1.78361587 3.52914961 0.41742116 -0.15247734 -0.01444097 Cu 8.86972850 0.00064116 5.30165842 -0.30258805 0.29100241 0.09389835 Cu 7.07588676 1.80277379 5.31834806 0.22645614 -0.22401783 0.10522839 Cu 0.01238736 3.55944521 3.49530702 -0.50227614 -0.16057010 0.15694611 Cu 1.77277603 5.29251294 3.54697328 -0.00129752 0.33339526 -0.13987148 Cu 1.79045669 3.55116462 5.29079400 -0.19037437 -0.09591387 0.29787404 Cu 0.03158588 5.32548236 5.29834177 -0.42973603 0.03219837 0.14569453 Cu 3.51712572 3.56497429 3.54739222 0.50699347 -0.14904776 -0.14957269 Cu 5.34784952 5.34053261 3.54553487 -0.13763381 -0.26548767 -0.09345151 Cu 5.33730756 3.53357846 5.32316045 -0.13503920 0.22615534 -0.28814435 Cu 3.51570686 5.31456434 5.29417157 0.22836709 0.16329450 0.14516427 Cu 7.09777079 3.52491895 3.51099973 -0.17987021 0.08545240 0.06712364 Cu 8.83309882 5.28570911 3.55604026 0.53574586 0.11800803 -0.16097393 Cu 8.86835024 3.52832363 5.30887921 0.34677336 -0.08589821 0.21069466 Cu 7.11782652 5.32845668 5.30231585 -0.22325092 -0.18023251 0.06005522 Cu 0.03196914 7.10978176 3.53073188 -0.41595623 -0.01979431 -0.11158128 Cu 1.80158006 8.85641787 3.54336214 -0.18219099 0.36611742 -0.17876522 Cu 1.79196322 7.09110719 5.29003903 -0.02658605 -0.01138039 0.28568471 Cu 0.03513475 8.86678056 5.29131044 0.13788440 -0.17831572 0.10310541 Cu 3.57082942 7.05653087 3.50944645 -0.14725190 0.10366165 0.03108779 Cu 5.30850725 8.83688210 3.57668785 0.09288393 0.40625872 -0.28890947 Cu 5.32443904 7.08292727 5.28551524 -0.10649794 0.05014731 0.36544384 Cu 3.50684546 8.86835680 5.28828103 0.14124402 0.23186850 0.34696243 Cu 7.12482994 7.08216815 3.57339743 -0.15619119 0.24589798 -0.30597853 Cu 8.87747212 8.86274811 3.51427723 -0.23831890 -0.17564238 0.10369849 Cu 8.85052462 7.05974347 5.30400788 0.49388883 0.36048522 0.18579771 Cu 7.06417033 8.86286311 5.32981498 0.30440448 0.28301441 0.08535437 Cu 0.02868281 0.00804937 7.12179165 0.07325844 0.19949762 -0.08292139 Cu 1.75037602 1.75799187 7.07850985 0.12886944 0.26990981 0.22106866 Cu 1.76310122 0.00951199 8.84029963 0.10854865 0.25681978 -0.14180416 Cu 0.00154532 1.75317320 8.87185562 0.24898584 0.06605673 -0.27557864 Cu 3.51863644 0.02436669 7.08859702 0.14869233 -0.36989694 0.19589201 Cu 5.29633821 1.79850621 7.06676925 0.08560702 -0.22141699 0.24597713 Cu 5.30825375 0.00198281 8.89360774 0.00881707 0.31587252 -0.34278822 Cu 3.54719119 1.79948186 8.87492322 -0.14266794 -0.13432243 0.20771748 Cu 7.05498395 0.02346118 7.08417611 0.14643582 -0.37108030 0.07374513 Cu 8.84815485 1.73374040 7.12251767 0.28994674 0.14216905 -0.11370150 Cu 8.88481764 0.01402584 8.85823044 -0.59135474 0.48713413 -0.51009053 Cu 7.08755498 1.77371313 8.83280363 0.08813605 -0.04886594 0.36969763 Cu 0.00671313 3.55858394 7.11098403 -0.36091099 -0.12404275 -0.11867375 Cu 1.78036130 5.30844300 7.09807182 -0.09159822 0.21298296 -0.15636146 Cu 1.73762428 3.52986974 8.86101505 0.16173521 -0.18553554 0.35328949 Cu 0.06403364 5.29823069 8.85365256 0.02818334 0.23404065 -0.04055828 Cu 3.52675678 3.56786937 7.05584543 0.01103554 -0.16056398 0.15418502 Cu 5.33455982 5.34041246 7.02956308 -0.10097630 -0.06659827 0.20424320 Cu 5.32144055 3.51138717 8.83870848 -0.01817049 0.15337922 0.35268412 Cu 3.52983716 5.28345923 8.83477044 0.05734679 0.03060160 0.47152617 Cu 7.05363250 3.56897820 7.06113243 0.37044006 -0.16863850 0.21826786 Cu 8.83187051 5.31773627 7.10049294 0.45906525 -0.02859971 0.13240354 Cu 8.88524520 3.55700020 8.86664157 -0.32163291 -0.11644913 -0.30595442 Cu 7.07245241 5.28146874 8.89146003 0.07809524 0.18134256 0.24065190 Cu 0.00206272 7.09491972 7.09864569 -0.21147914 0.00450886 -0.01997038 Cu 1.73557486 8.87206447 7.10351803 0.10754086 0.25565734 -0.14397122 Cu 1.80165202 7.12661913 8.86542639 -0.28653101 -0.19347787 0.34321362 Cu 0.03038433 8.86711586 8.83658324 0.41697916 -0.46008725 -0.39985899 Cu 3.54122371 7.07095008 7.12240658 -0.07901859 0.14527894 -0.49180082 Cu 5.33687310 8.85754751 7.11134929 -0.01796258 0.22261415 -0.03655271 Cu 5.28759950 7.07851830 8.82732154 0.28845976 0.04352607 0.45766431 Cu 3.50150161 8.82599145 8.84551244 0.11374902 0.07665957 -0.09372760 Cu 7.11421678 7.05451120 7.09640054 -0.04141202 0.39504179 0.12286655 Cu 8.87574196 8.89494200 7.09389000 -0.45835110 -0.47865747 -0.06113169 Cu 8.85494248 7.12392374 8.86835596 -0.30328351 -0.11985280 -0.33964134 Cu 7.13000099 8.85633038 8.89241775 -0.11774459 -0.37788542 -0.44012964