108 Lattice="10.650045527218591 0.0 0.0 0.0 10.650045527218591 0.0 0.0 0.0 10.650045527218591" Properties=species:S:1:pos:R:3:forces:R:3 energy=-331.8403349220951 stress="-0.007879962485787385 -0.0003799291208840078 0.0006815024125813688 -0.0003799291208840078 -0.0077854939504818305 0.0007742561580285506 0.0006815024125813688 0.0007742561580285506 -0.008205009735808717" pbc="F F F" Cu 0.00731272 0.00427299 0.01197578 0.37534549 0.30617516 0.31299287 Cu 1.75103845 1.79626113 0.02689086 0.14611951 -0.34016265 -0.41828852 Cu 1.75063937 0.00791155 1.80578858 0.14486256 -0.20822418 -0.31959334 Cu 0.00443579 1.75410519 1.72566810 -0.39071566 0.15450048 0.14247474 Cu 3.55707030 0.00844581 0.03253385 -0.21031421 0.10183825 0.04665745 Cu 5.33827695 1.74525244 0.02422110 -0.12913957 0.03284127 -0.54306986 Cu 5.29193866 0.02121918 1.77377238 0.27962449 -0.43034168 0.07255011 Cu 3.57057252 1.80803902 1.76504230 -0.30425462 -0.37329167 0.07036161 Cu 7.11120227 0.02455568 0.00771921 0.10827347 0.06843428 0.14027124 Cu 8.90617052 1.78755091 0.01178542 -0.26343314 -0.05922379 0.25127273 Cu 8.86749242 0.01782059 1.80804449 -0.14902026 0.09087044 -0.19261511 Cu 7.07137639 1.76176709 1.75612536 0.35555395 0.02761147 0.31253723 Cu 0.03208184 3.57730319 0.00963641 -0.09066180 -0.02464039 0.02117792 Cu 1.76846633 5.32362806 0.00517573 0.12594805 0.00873157 -0.33421174 Cu 1.80785216 3.54539711 1.75317059 -0.25740810 0.12595418 0.18876276 Cu 0.01786186 5.34282421 1.77654002 -0.41923554 -0.22729352 -0.10588122 Cu 3.57686405 3.52087585 0.00762116 -0.10974355 0.15567817 -0.46709013 Cu 5.33452933 5.29992828 0.02342951 -0.07115857 0.15334093 -0.41656530 Cu 5.32432479 3.54383271 1.76183716 0.11851011 0.11950611 0.24413672 Cu 3.54079073 5.31290587 1.76326126 0.22244850 0.06947221 0.18810025 Cu 7.07601140 3.51032755 0.00807904 0.29027538 0.12513422 -0.30103680 Cu 8.86881460 5.29422069 0.00647775 -0.19385086 0.06575746 0.18266061 Cu 8.86618954 3.54377535 1.78760353 0.14664103 -0.01965052 -0.09222846 Cu 7.07895806 5.33330921 1.75070199 0.24035407 -0.17525679 0.18865844 Cu 0.01150938 7.08356336 0.01300589 0.14477900 0.13975619 0.16652013 Cu 1.77800240 8.84761534 0.01770865 -0.05382295 -0.22747213 0.20320937 Cu 1.77008265 7.05486665 1.80666271 0.12174785 0.43806306 -0.40935199 Cu 0.02366735 8.86807190 1.80633161 0.18128993 -0.19843097 -0.12142563 Cu 3.56228686 7.07722725 0.02777032 -0.09340874 0.07655869 -0.30080103 Cu 5.32258103 8.83967100 0.02686266 -0.10714702 0.07489975 -0.07077771 Cu 5.34084509 7.11069283 1.78180285 -0.25013766 -0.13243378 0.06366243 Cu 3.52355839 8.84141865 1.79004469 0.19936379 0.32136196 -0.17069161 Cu 7.09468278 7.10183955 0.03266222 0.25935667 0.09034761 -0.43330698 Cu 8.90782007 8.85198531 0.03094963 -0.46954015 -0.38216291 0.39654055 Cu 8.85751815 7.12507774 1.78061798 0.22396691 0.07462058 -0.09878765 Cu 7.06872533 8.88968357 1.76127209 0.39743710 0.23956931 0.08816359 Cu 0.03076702 0.05578292 3.56099254 -0.25890004 -0.15249082 -0.09171402 Cu 1.74419257 1.80977719 3.53242650 0.46826664 0.00251861 0.01388366 Cu 1.74985441 0.03298612 5.30324911 0.28303213 -0.30160576 0.19031629 Cu 0.02782191 1.79224209 5.31188228 -0.40898444 -0.00928362 0.17100065 Cu 3.55495115 0.00968410 3.51764074 -0.18278273 -0.10091551 0.25410448 Cu 5.29634495 1.78688884 3.55647892 0.33798349 -0.10357741 0.13644240 Cu 5.29331202 0.01065342 5.34881932 0.08284896 -0.20138327 -0.22771738 Cu 3.51691930 1.80415211 5.35108778 0.07003157 -0.13443312 -0.37333714 Cu 7.10213570 0.02409964 3.57284127 -0.22496169 -0.26198757 -0.13405845 Cu 8.89311262 1.74312645 3.54147968 0.07918730 0.32957682 0.01802007 Cu 8.85883085 0.02191181 5.29585773 0.07296011 -0.04638169 0.19161537 Cu 7.11195086 1.76645803 5.34646181 -0.19979851 0.35147573 -0.15799624 Cu 0.02481540 3.56779520 3.53806815 -0.37261202 -0.09901443 -0.17124183 Cu 1.77111042 5.33575390 3.52561794 0.36243025 -0.24609940 0.28443397 Cu 1.75365905 3.58498750 5.34381828 0.33773842 -0.16094102 -0.27001230 Cu 0.01498074 5.31521311 5.29642064 -0.34765527 0.09658760 0.20405136 Cu 3.58528305 3.53258601 3.52438111 -0.44236380 0.25117686 0.23572972 Cu 5.31204001 5.34748838 3.56652324 0.03153839 -0.26400905 -0.43321558 Cu 5.31784928 3.58086396 5.30265106 0.05061053 -0.41152939 0.21676099 Cu 3.54918447 5.31465861 5.30352139 -0.22604420 0.06936065 0.16538438 Cu 7.09174456 3.57218566 3.53539733 0.09351502 -0.25128503 0.06270826 Cu 8.88034600 5.35103884 3.53025597 0.13410055 -0.18140404 0.08402264 Cu 8.88488128 3.53243471 5.34186015 0.06330610 0.16000933 -0.18810199 Cu 7.07372073 5.29995723 5.32497820 0.22995067 0.12977480 -0.04203688 Cu 0.02796665 7.07990725 3.53632124 -0.39640305 0.22569392 0.18115804 Cu 1.81483996 8.85583193 3.53460103 -0.25446795 0.25231191 0.22365537 Cu 1.77244526 7.09391610 5.35723168 0.15056309 -0.02414652 -0.28067545 Cu 0.01217439 8.86046441 5.28762569 0.10584333 -0.09834129 0.01998674 Cu 3.57506130 7.10981431 3.55957661 -0.23757123 -0.21244883 -0.13271680 Cu 5.33801824 8.88381768 3.56736400 -0.12744372 0.24054185 -0.15948049 Cu 5.29837437 7.07131635 5.30627025 0.21231864 0.21530274 0.31468247 Cu 3.56029042 8.84024116 5.33491913 -0.03324396 0.40043844 -0.04502158 Cu 7.07659486 7.07272118 3.53810242 0.24606379 0.25919047 0.09084207 Cu 8.86528144 8.89323106 3.57445853 -0.27290083 -0.28793691 -0.04877399 Cu 8.84539543 7.06463543 5.33618911 0.21213692 0.36049120 -0.15434851 Cu 7.06693449 8.85503088 5.30708212 0.16517759 0.20487596 0.13021033 Cu 0.01632899 0.01229580 7.12130962 0.09553470 0.13202800 -0.14356244 Cu 1.77913467 1.78825108 7.11652540 -0.03440920 -0.23535962 -0.15789127 Cu 1.76199089 0.01618871 8.85574282 0.10861055 0.11368357 -0.06262358 Cu 0.01827612 1.78498719 8.84041965 -0.06012314 -0.08770888 0.08448004 Cu 3.57301066 0.02908574 7.11365253 -0.27884269 -0.40219388 0.01426727 Cu 5.30667362 1.77038325 7.09976631 0.28421972 0.16863695 -0.15910705 Cu 5.36197313 0.02194660 8.86930769 -0.02321917 0.07789972 -0.04069150 Cu 3.57106536 1.79115966 8.84910501 -0.13949647 -0.13184020 0.47991315 Cu 7.09375052 0.02173113 7.08508025 0.30303785 -0.25046851 0.27693720 Cu 8.90300882 1.79744593 7.09008792 0.09001844 -0.27137285 0.27322563 Cu 8.89891778 0.00317060 8.87077128 -0.56113797 0.55948846 -0.55339851 Cu 7.12071601 1.79925916 8.86247400 0.23294519 -0.29749481 0.18732031 Cu 0.01829418 3.52006169 7.08756687 -0.39493200 0.38074443 0.13933380 Cu 1.79257622 5.33206474 7.11014330 -0.06409209 -0.08512288 0.06635406 Cu 1.75801681 3.53787483 8.86036249 0.11414775 0.23581006 0.33287667 Cu 0.01445580 5.35855930 8.89994951 0.14256578 -0.11890123 -0.25130658 Cu 3.54166473 3.53069392 7.08954705 0.07265545 0.37145191 0.07599164 Cu 5.30875848 5.32593953 7.08374428 -0.03115678 0.04761874 0.17115686 Cu 5.34019667 3.53421638 8.84183083 -0.11546861 0.20958783 0.45818581 Cu 3.57365421 5.33434182 8.88705633 -0.07386768 -0.11227541 0.17009570 Cu 7.06568045 3.57491428 7.12875496 0.38211051 -0.16201502 -0.27954608 Cu 8.85330387 5.34974976 7.07770808 0.24855620 -0.21627025 0.22362548 Cu 8.90324197 3.54598791 8.86351725 -0.19291989 0.11015612 -0.18918730 Cu 7.12286818 5.35582712 8.88126256 -0.16837726 -0.20579836 0.18564829 Cu 0.01336509 7.08958735 7.08312973 -0.29331329 0.18176713 0.18430368 Cu 1.77730140 8.89965772 7.06548003 -0.14867796 0.15130889 0.30458048 Cu 1.77349750 7.10441849 8.85162911 -0.05986470 0.22285667 0.27347638 Cu 0.02401067 8.85972132 8.86265965 0.41271690 -0.41252917 -0.44102090 Cu 3.56349284 7.11925571 7.13346637 -0.12713422 -0.14513148 -0.18978225 Cu 5.29228660 8.88869495 7.11751453 0.20667801 0.27400319 -0.09875243 Cu 5.34252478 7.13229812 8.85343647 -0.14558727 -0.17437362 0.40892315 Cu 3.54308654 8.89864774 8.88457007 -0.08213160 -0.14116209 -0.11722406 Cu 7.06980636 7.10602564 7.08715286 0.15186653 0.11826112 0.05867842 Cu 8.83977725 8.89618753 7.07614424 -0.30172562 -0.36122855 0.12019297 Cu 8.84137272 7.07225354 8.89167222 -0.09379946 0.27940598 -0.29228930 Cu 7.06829911 8.85059801 8.90484909 0.22223803 -0.08601252 -0.27673208