108 Lattice="10.604297000191046 0.0 0.0 0.0 10.604297000191046 0.0 0.0 0.0 10.604297000191046" Properties=species:S:1:pos:R:3:forces:R:3 energy=-310.45367634072926 stress="-0.0076851600530037124 -3.333723970050079e-05 2.023488393756249e-05 -3.333723970050079e-05 -0.0075603956977256526 -0.001571493060229803 2.023488393756249e-05 -0.001571493060229803 -0.007213721362664298" free_energy=-310.45367634072926 pbc="F F F" Cu 0.02582342 0.01678235 0.03192386 0.43882105 0.48073609 0.34662347 Cu 1.77795697 1.83061267 0.02922369 0.05822722 -0.20077366 -0.43492159 Cu 1.74329635 0.02217043 1.76910102 0.27001139 -0.58261587 -0.03717811 Cu 0.02175862 1.75725569 1.77736731 -0.56646692 0.26572065 -0.15344709 Cu 3.56048720 0.03189018 0.00388835 -0.19405321 0.16013223 0.24185439 Cu 5.28320331 1.79082786 0.01516736 0.36284164 -0.06087568 -0.36212716 Cu 5.33015793 0.02701883 1.78027221 -0.08068312 -0.43478024 -0.21040773 Cu 3.51908877 1.75566190 1.79389100 0.28954561 0.27705771 -0.18920587 Cu 7.09009587 0.00387335 0.00067257 -0.12280846 0.46455287 0.39902059 Cu 8.86247753 1.76567511 0.00544225 -0.41225216 0.03532710 0.41184527 Cu 8.80560810 0.01297373 1.82728108 -0.12677074 0.16948562 -0.18794726 Cu 7.09204520 1.77592414 1.79631760 -0.28276180 0.13207300 -0.40728243 Cu 0.02241512 3.55838021 0.00027888 0.13304334 -0.12028107 0.29343546 Cu 1.79739822 5.26693829 0.01557932 -0.06182493 0.34981483 -0.45398775 Cu 1.81782450 3.56799371 1.81302430 -0.37479720 -0.20047586 -0.30644933 Cu 0.02810730 5.32926304 1.73728949 -0.41637379 -0.15170886 0.33780779 Cu 3.55678746 3.56884882 0.00101344 -0.12619949 -0.32259825 -0.44889507 Cu 5.28817717 5.30839604 0.03528455 0.19058265 0.09755369 -0.91136774 Cu 5.32446457 3.56098167 1.73607525 -0.22723671 -0.54140038 0.67533628 Cu 3.55364537 5.29601080 1.79446354 -0.09787683 0.16412597 0.14278538 Cu 7.11016315 3.56549886 0.00870712 -0.17553378 -0.50613332 -0.59974736 Cu 8.82744342 5.28875523 0.04567574 0.00503841 0.21014911 -0.06097343 Cu 8.84538573 3.52338581 1.78358981 0.57986579 -0.01092440 -0.11130836 Cu 7.05153079 5.26833345 1.73870379 0.26272315 0.56019464 0.47424990 Cu 0.02017889 7.03628011 0.00047618 0.45361148 0.14856481 0.27045846 Cu 1.79543142 8.86735944 0.02812128 -0.14351650 -0.44539781 0.20664021 Cu 1.78966688 7.08270894 1.79831598 -0.03153539 -0.32684645 -0.40577492 Cu 0.00274082 8.81623873 1.78195395 0.19141350 -0.21103072 -0.20976017 Cu 3.53688917 7.05053868 0.00270736 -0.14417232 0.16874731 -0.39632323 Cu 5.30475796 8.85698508 0.00299428 -0.11950516 -0.13241998 0.16492498 Cu 5.32499482 7.07255659 1.73515430 -0.21198954 0.09554133 0.40836855 Cu 3.50543241 8.83818072 1.74681870 0.29599949 0.45117577 0.10840908 Cu 7.03419567 7.10537485 0.02881800 0.35373486 -0.17145274 -0.64736494 Cu 8.87110189 8.83628027 0.02890127 -0.58298780 -0.50061733 0.49794242 Cu 8.82934615 7.06038403 1.73715585 0.21134238 0.01736680 0.39608441 Cu 7.05706667 8.84726855 1.76407570 0.25915086 0.37826420 0.15993558 Cu 0.00189489 0.00712912 3.55384417 0.14501863 0.07103661 -0.11349827 Cu 1.75486559 1.78147029 3.49518409 0.14551285 -0.19248923 0.34697658 Cu 1.80061058 0.01293742 5.27970220 -0.23180149 -0.47897687 0.13775664 Cu 0.00621181 1.75374600 5.27701301 -0.39906058 -0.03361432 0.24187699 Cu 3.54737141 0.01776502 3.53389941 -0.18327887 -0.60738156 -0.20358186 Cu 5.30133561 1.77135673 3.56572705 0.10818428 0.36687422 -0.57257401 Cu 5.27841170 0.03087800 5.28002120 0.26613927 -0.67848267 0.29691774 Cu 3.51353096 1.76950614 5.29500229 -0.17300567 0.11811948 0.17660092 Cu 7.03857363 0.02592208 3.52527946 0.27082036 -0.50793729 0.34136850 Cu 8.83656258 1.78378027 3.52952304 0.42102616 -0.19972968 0.18777655 Cu 8.85979941 0.01155124 5.30518676 -0.42186003 0.35875873 0.00624882 Cu 7.03616117 1.79782203 5.33098908 0.39617758 -0.36859862 -0.32097018 Cu 0.00905737 3.50550060 3.53701110 -0.60878813 0.24400428 -0.23805835 Cu 1.77653182 5.28645155 3.56304284 0.07450501 0.39862891 -0.15994659 Cu 1.76366174 3.52569351 5.28247872 0.13346909 -0.08722764 0.45261184 Cu 0.00356570 5.29381946 5.27456237 -0.38575838 0.25073536 0.25937081 Cu 3.52145383 3.50730404 3.56624198 0.41208127 0.34440666 -0.24477969 Cu 5.31677464 5.32879972 3.55376336 -0.19697264 -0.52083116 -0.29509589 Cu 5.29696607 3.50442168 5.28170411 0.09775399 0.63902749 0.13460799 Cu 3.53295354 5.33080982 5.32314647 0.12235666 -0.26252073 -0.33763173 Cu 7.09166125 3.56007813 3.51764900 -0.49012535 -0.30711559 0.08711090 Cu 8.83181702 5.27407062 3.56093312 0.56607587 0.36401134 -0.40663212 Cu 8.82948541 3.50114196 5.27832572 0.61281558 0.06900910 0.32229892 Cu 7.07793125 5.30479377 5.28015371 -0.26573704 -0.03042908 0.56599747 Cu 0.03442186 7.09103590 3.51929022 -0.58222688 -0.28057205 0.18240375 Cu 1.73939698 8.83155942 3.50418843 0.42160565 0.60544124 0.18711061 Cu 1.80229624 7.10212214 5.31904729 -0.21258469 -0.29033339 -0.25056436 Cu 0.04609510 8.85597888 5.28830250 -0.04976157 -0.14961890 0.02691606 Cu 3.56935545 7.06754043 3.50350331 -0.28207736 0.08343817 0.15927848 Cu 5.30208376 8.86577945 3.50531863 0.02460143 0.31861229 0.09795748 Cu 5.30706986 7.05290486 5.26924291 0.16043187 0.27395896 0.50059386 Cu 3.53584645 8.81048455 5.31282166 -0.01590588 0.59796688 -0.18946531 Cu 7.03986802 7.04927515 3.53727986 0.37780004 0.25160299 -0.47160578 Cu 8.86179820 8.82479485 3.54529028 -0.33600670 -0.27730747 -0.22975524 Cu 8.81393202 7.06377217 5.27752755 0.59278294 0.05867374 0.25119137 Cu 7.09443540 8.81268612 5.29959356 -0.16283183 0.53120586 0.03222452 Cu 0.02424587 0.01083809 7.08752296 0.11611014 0.13168027 -0.25936768 Cu 1.73720319 1.73400456 7.08999861 0.40093459 0.41559987 -0.34381347 Cu 1.75958038 0.01186753 8.82386933 0.25924087 0.06947488 -0.12185968 Cu 0.03040869 1.74163454 8.85528469 0.09270408 0.24104355 -0.21700104 Cu 3.55602431 0.02444406 7.05199464 -0.23268408 -0.56394243 0.09817439 Cu 5.27931104 1.79512029 7.05363752 0.25793486 -0.14809412 0.19647086 Cu 5.27788751 0.00011610 8.81920910 0.13598679 0.18272003 -0.14522102 Cu 3.53676669 1.76081008 8.82842541 0.00189315 0.06393717 0.41128432 Cu 7.06565915 0.03338831 7.07760947 -0.16240095 -0.58128259 -0.23159872 Cu 8.80290111 1.76348814 7.10467747 0.66420183 0.15981201 -0.27732297 Cu 8.82981700 0.03346787 8.81158808 -0.35743274 0.27900868 -0.32289256 Cu 7.07162976 1.74246094 8.83261660 -0.19898456 0.18325365 0.47114264 Cu 0.01946177 3.51577119 7.04611738 -0.30155945 0.09594925 0.20492965 Cu 1.79741141 5.33554665 7.04149649 -0.38553137 -0.34561490 0.22167865 Cu 1.79560539 3.49044237 8.84880069 -0.20455846 0.21744521 0.14058354 Cu 0.01790831 5.29565395 8.83286662 0.31750938 -0.03470197 -0.34627486 Cu 3.56773134 3.54312406 7.03987844 -0.46841499 -0.13322686 0.16707534 Cu 5.28769272 5.33417411 7.09433491 0.54658983 -0.29692906 -0.30238765 Cu 5.34523585 3.51108279 8.84511941 -0.15419186 0.09814455 0.33917598 Cu 3.50655962 5.27181222 8.83335633 0.15763629 0.10259694 0.52043360 Cu 7.09104100 3.53089739 7.03529978 -0.32918127 0.18746403 0.26934285 Cu 8.82336243 5.31053580 7.07220049 0.48590902 -0.04220023 -0.11505021 Cu 8.80197822 3.54503519 8.87069237 -0.09175259 -0.14674894 -0.24661111 Cu 7.08801073 5.27757467 8.82804198 -0.11266711 0.26855114 0.39560887 Cu 0.01788250 7.09801915 7.07263357 -0.39733580 -0.31201256 -0.14365125 Cu 1.74171009 8.85267971 7.04670156 0.38613282 0.30770374 0.30947732 Cu 1.76998077 7.05864879 8.85210131 0.12971083 0.08052247 0.19208200 Cu 0.02299903 8.80334519 8.82035631 0.42429119 -0.35557041 -0.34895303 Cu 3.56963543 7.05185224 7.07514012 -0.26369371 0.43617634 0.26928528 Cu 5.28243326 8.85665790 7.04331383 0.20748471 0.19180193 0.20112260 Cu 5.32643506 7.05798842 8.85634727 -0.09071024 0.17191918 0.32946540 Cu 3.51734790 8.85101823 8.84857733 0.01172856 -0.37516410 -0.38844059 Cu 7.10279500 7.11022612 7.09525762 -0.44096653 -0.24850707 -0.28315108 Cu 8.86281092 8.85716920 7.08845771 -0.35724500 -0.30108224 -0.20093345 Cu 8.82758850 7.09756999 8.80444887 -0.19040817 -0.12055924 -0.06178286 Cu 7.05021792 8.85709415 8.83760578 -0.06426239 -0.25776536 -0.34331015