108 Lattice="10.650906876854723 0.0 0.0 0.0 10.650906876854723 0.0 0.0 0.0 10.650906876854723" Properties=species:S:1:pos:R:3:forces:R:3 energy=-329.41288035162324 stress="-0.008483111416435431 0.001060744081899157 0.0011017813881354212 0.001060744081899157 -0.00838446196579197 -0.0007287403581379765 0.0011017813881354212 -0.0007287403581379765 -0.00798956642865529" free_energy=-329.41288035162324 pbc="F F F" Cu 0.00233607 0.03518849 0.02657034 0.37212263 0.38019025 0.29216040 Cu 1.78273033 1.79947634 0.01792602 -0.19607187 -0.11681575 -0.40130961 Cu 1.75010829 0.02103231 1.74439022 0.07862600 -0.31294449 0.20369258 Cu 0.02706723 1.76094021 1.78700140 -0.40591570 0.10481740 -0.08677308 Cu 3.51102130 0.01934961 0.00340986 0.13075957 0.09627510 0.12183885 Cu 5.32072222 1.77950865 0.01819881 0.05836129 -0.11189434 -0.51769534 Cu 5.31511282 0.02805605 1.79394492 0.01894526 -0.46668509 -0.21935847 Cu 3.57549542 1.77343542 1.76071002 -0.40037447 -0.09129833 0.07222208 Cu 7.11157646 0.01610218 0.00101963 -0.08298863 0.31724122 0.27284614 Cu 8.89935807 1.81064289 0.01324789 -0.41097672 -0.02259480 0.29073389 Cu 8.85502392 0.00837736 1.75211649 -0.25059631 0.32034112 0.12370744 Cu 7.07022243 1.77840879 1.78765800 0.36422079 -0.04646929 -0.32875726 Cu 0.00512588 3.56784811 0.02670833 0.11049247 -0.06828997 0.16339021 Cu 1.74422961 5.34977670 0.02084657 0.22358403 -0.22831868 -0.53251577 Cu 1.80060212 3.56826334 1.75586667 -0.25326312 -0.09939282 0.16826693 Cu 0.03079661 5.35741312 1.78771332 -0.56591800 -0.21913057 -0.07548456 Cu 3.53252178 3.54448781 0.02097810 0.08679256 0.16680270 -0.59739506 Cu 5.30196369 5.35979766 0.02767826 0.21401307 -0.16097999 -0.50373986 Cu 5.29461888 3.54522912 1.74869300 0.24066202 0.12823680 0.14127946 Cu 3.56715670 5.34155656 1.78250965 -0.22460274 -0.16532511 -0.05932093 Cu 7.08339723 3.57789631 0.01608977 0.15471112 -0.14228354 -0.29950554 Cu 8.87118404 5.33087157 0.03024143 -0.04987546 -0.11425775 0.08719179 Cu 8.88753562 3.52722655 1.79745416 0.21282555 0.16275964 -0.11516706 Cu 7.12305554 5.31168836 1.78893316 -0.19933030 0.08423740 -0.04917715 Cu 0.01731279 7.07264520 0.00136296 0.09543504 0.17365393 0.24022403 Cu 1.75309485 8.85572868 0.00741338 0.06360098 -0.19171246 0.21713440 Cu 1.81017660 7.06691972 1.75686741 -0.38971421 0.62941952 0.21477099 Cu 0.00302914 8.90892631 1.76621353 0.37778228 -0.48450555 0.10033892 Cu 3.52740891 7.09108969 0.02665562 0.16685180 0.29570942 -0.57697969 Cu 5.37030615 8.90157534 0.02579780 -0.10098792 -0.29580192 0.16909389 Cu 5.29917777 7.11450856 1.75801717 0.33959215 0.07436289 0.08559509 Cu 3.52480621 8.89938603 1.77141284 0.16362781 0.19565174 -0.13335261 Cu 7.12693547 7.07723282 0.01116853 -0.07630926 0.28133408 -0.17658736 Cu 8.85951558 8.90520920 0.01234148 -0.57940383 -0.58597479 0.61405379 Cu 8.84299476 7.06789771 1.79445765 0.39978018 0.40975711 -0.19983002 Cu 7.07963599 8.89461989 1.81032087 0.17757904 0.05654459 -0.26474604 Cu 0.00927770 0.01632287 3.58596341 0.20664497 0.14045263 -0.05638491 Cu 1.75757229 1.78438745 3.57368240 0.14637034 -0.18429046 -0.24893282 Cu 1.80708750 0.02936449 5.35414244 -0.26205365 -0.44563079 -0.13134784 Cu 0.00470660 1.80160751 5.33797445 -0.35143744 -0.09295221 -0.14799918 Cu 3.52018691 0.03465729 3.53127628 0.07876197 -0.50297963 0.09081352 Cu 5.30440047 1.79712258 3.56794550 0.14750175 -0.17738432 -0.14650301 Cu 5.34337424 0.00303605 5.32060286 -0.10549374 -0.44678279 -0.11028447 Cu 3.57353777 1.74516559 5.35184190 -0.28369539 0.27445996 -0.24081642 Cu 7.07022013 0.03002971 3.53283367 0.32972636 -0.34847430 0.17911258 Cu 8.86161863 1.78631706 3.53815398 0.24401807 -0.14707369 0.17654879 Cu 8.88299293 0.03081731 5.35631934 -0.26749271 0.20002366 -0.13358916 Cu 7.07320617 1.79028664 5.35445922 0.43977588 -0.13621120 -0.40311131 Cu 0.03155010 3.54353819 3.51641315 -0.49029833 0.03721922 0.11057427 Cu 1.74995744 5.34593119 3.56146343 0.34518935 -0.15817883 -0.18220049 Cu 1.81054388 3.56275852 5.30145944 -0.37717875 -0.13754156 0.27486134 Cu 0.01957951 5.29398785 5.30888494 -0.46769706 0.22744923 0.08376408 Cu 3.54448751 3.55058720 3.55629356 -0.08396272 -0.08859239 -0.14401684 Cu 5.29549180 5.29053448 3.54031292 0.39219859 0.34989502 0.08660501 Cu 5.30834224 3.54976601 5.31854744 0.20744682 0.23789586 0.20957799 Cu 3.53752307 5.29609674 5.33980982 0.12711125 0.43114972 0.04340146 Cu 7.08583143 3.55167136 3.53287832 0.23447326 0.04046831 0.25412024 Cu 8.90786012 5.35356307 3.56945366 0.24660965 -0.30207046 -0.09152485 Cu 8.87123740 3.57197703 5.35705994 0.37370065 -0.14481443 -0.25773942 Cu 7.12315169 5.34484743 5.32221274 -0.24188402 -0.23544576 0.18220350 Cu 0.02093952 7.08381923 3.54103577 -0.35974277 0.42062540 0.09204154 Cu 1.80466311 8.87076160 3.51879965 -0.29169920 0.21613257 0.20984407 Cu 1.79745486 7.08399049 5.30394350 -0.31048547 0.38779950 0.30001661 Cu 0.00447543 8.88715204 5.35633341 0.38559566 -0.34617669 -0.05874695 Cu 3.58465471 7.10606993 3.58122036 -0.36266390 0.03139490 -0.25056270 Cu 5.30765200 8.84409930 3.53532112 0.08729188 0.53763835 0.17853223 Cu 5.30858936 7.08170269 5.31703221 0.12133994 0.24714696 0.27558545 Cu 3.52785950 8.88498144 5.35976426 0.13416757 0.32953017 -0.15343531 Cu 7.11414890 7.09333917 3.58151133 -0.19726047 0.07247944 -0.30828149 Cu 8.84704568 8.87841170 3.50701485 -0.01454754 -0.17690893 0.13893528 Cu 8.86286387 7.07168247 5.33659589 0.40368954 0.36510143 0.15247223 Cu 7.12297575 8.86041260 5.30638989 -0.07974573 0.30822011 0.21393113 Cu 0.01852447 0.02741749 7.07990375 0.14608297 0.14072200 0.06550784 Cu 1.74314325 1.79375853 7.09997400 0.26816035 -0.32782760 0.19993484 Cu 1.74652991 0.02634088 8.90683173 0.29357536 0.29799118 -0.43202921 Cu 0.02594628 1.76545099 8.90416562 0.06188921 0.08719322 -0.31013833 Cu 3.58246573 0.01264968 7.07058427 -0.22133585 -0.36371341 0.49565559 Cu 5.31195694 1.78859798 7.07351924 0.20489309 -0.09424886 0.60463739 Cu 5.29332465 0.01256665 8.90948620 0.17260393 0.25159167 -0.32315634 Cu 3.58454331 1.79803491 8.87497815 -0.25172898 -0.12583147 0.18899494 Cu 7.07991265 0.03060775 7.08077894 0.13247163 -0.34229651 0.32773285 Cu 8.87229177 1.78842098 7.12577077 0.31835461 -0.22329375 -0.10771223 Cu 8.84543989 0.02437683 8.87951786 -0.35357100 0.32960503 -0.44016133 Cu 7.13234274 1.76163343 8.88947839 -0.32881236 0.07787150 0.14904271 Cu 0.01793643 3.55379689 7.07286069 -0.42568297 0.01628014 0.23939715 Cu 1.74784666 5.35359094 7.12759151 0.21804188 -0.39129498 -0.17092139 Cu 1.74739191 3.51171282 8.85559891 0.25234124 0.20901686 0.42967602 Cu 0.03401977 5.29160312 8.90035738 -0.01070559 0.05430706 -0.11710734 Cu 3.53307169 3.55704291 7.08866127 0.09382323 -0.02948114 0.31010448 Cu 5.32120693 5.35553558 7.12440579 0.11151773 -0.21449994 -0.16832110 Cu 5.32503518 3.58553799 8.87238056 0.08183240 -0.29710620 0.26212918 Cu 3.56924695 5.33207139 8.85919767 -0.23227279 -0.08311715 0.45925029 Cu 7.13402005 3.52308011 7.08940498 -0.28185547 0.35796532 0.34119060 Cu 8.87368711 5.32723647 7.12161281 0.20011347 0.08325974 0.10608103 Cu 8.90610566 3.51544846 8.86834266 -0.23754513 0.15877819 -0.11864591 Cu 7.08606269 5.30528286 8.87187572 0.21168081 0.17211204 0.26289354 Cu 0.03279261 7.07704112 7.12543997 -0.45391474 0.20463540 -0.23282154 Cu 1.80629894 8.87997287 7.14066160 -0.37274131 0.25550954 -0.22555171 Cu 1.75894589 7.08245026 8.84568293 0.07578389 0.18708516 0.67384520 Cu 0.02220852 8.84952650 8.84815254 0.31701124 -0.30138632 -0.33192427 Cu 3.53154620 7.13667961 7.14155059 0.24185352 -0.17893917 -0.27803324 Cu 5.32341102 8.89571165 7.12972289 0.04191731 0.23462798 -0.14498337 Cu 5.31308426 7.13005072 8.88394297 0.11396289 -0.03267710 0.36599376 Cu 3.53626626 8.89514861 8.87468654 0.01086862 -0.11956299 -0.00168366 Cu 7.06561724 7.13570682 7.12335883 0.48074869 -0.02230897 0.01925258 Cu 8.90403222 8.88328774 7.13184479 -0.40580148 -0.42367905 -0.12723649 Cu 8.89229416 7.09356212 8.89359340 -0.39765414 -0.04290811 -0.36452254 Cu 7.12484310 8.87582940 8.88443069 -0.04421795 -0.24061297 -0.23467959