612 Lattice="15.416322561807025 0.0 0.0 7.7081612809035125 13.35092697146008 0.0 0.0 0.0 71.32845641910158" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2477.0049773796272 stress="0.0008944001841538097 -4.5157279854179266e-07 -5.784690786176138e-07 -4.5157279854179266e-07 0.0008976627844685355 -2.0883539276808002e-06 -5.784690786176138e-07 -2.0883539276808002e-06 1.9332461969140054e-08" free_energy=-2477.0049773796272 pbc="T T F" Cu 0.00397651 0.00404137 17.89490143 -0.00000201 -0.00000704 0.00000002 Cu 3.85805715 2.22919589 17.89490143 -0.00000192 -0.00000710 0.00000013 Cu 10.28152486 13.35496836 17.89490143 -0.00000188 -0.00000709 0.00000009 Cu 16.70499263 2.22919588 17.89490143 -0.00000199 -0.00000703 -0.00000001 Cu 10.28152015 11.87151484 19.92428338 -0.00000206 -0.00000658 -0.00000006 Cu 6.42743947 0.74574237 19.92428336 -0.00000168 -0.00000676 0.00000027 Cu 12.85090720 11.87151485 19.92428337 -0.00000157 -0.00000672 0.00000015 Cu 3.85805240 0.74574235 19.92428340 -0.00000194 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8.16280072 28.32559748 -0.00000032 -0.00000371 0.00000092 Cu 7.71209903 5.93764629 28.32559753 -0.00000029 -0.00000439 0.00000039 Cu 6.42740559 8.16280066 28.32559759 -0.00000179 -0.00000283 -0.00000034 Cu 7.71208615 4.45416305 30.42349951 -0.00000148 -0.00000247 -0.00000107 Cu 11.56616664 6.67931753 30.42349933 0.00000016 -0.00000239 0.00000098 Cu 10.28147310 4.45416311 30.42349938 0.00000000 -0.00000350 0.00000039 Cu 8.99677973 6.67931746 30.42349943 -0.00000165 -0.00000154 -0.00000020 Cu 10.28145916 2.97067639 32.52139446 -0.00000097 -0.00000133 -0.00000133 Cu 14.13553966 5.19583089 32.52139426 0.00000070 -0.00000094 0.00000101 Cu 12.85084611 2.97067651 32.52139432 0.00000032 -0.00000255 0.00000037 Cu 11.56615278 5.19583082 32.52139435 -0.00000141 -0.00000021 -0.00000001 Cu 12.85083170 1.48718802 34.61929045 -0.00000042 -0.00000017 -0.00000156 Cu 16.70491221 3.71234246 34.61929022 0.00000123 0.00000058 0.00000100 Cu 15.42021870 1.48718816 34.61929028 0.00000055 -0.00000154 0.00000035 Cu 14.13552531 3.71234242 34.61929029 -0.00000111 0.00000114 0.00000021 Cu 0.00388180 0.00369965 36.71718643 0.00000007 0.00000099 -0.00000173 Cu 3.85796230 2.22885402 36.71718619 0.00000164 0.00000209 0.00000095 Cu 2.57326886 0.00369978 36.71718625 0.00000069 -0.00000046 0.00000031 Cu 1.28857539 2.22885400 36.71718624 -0.00000085 0.00000245 0.00000043 Cu 10.28141627 11.87113998 38.81508137 0.00000051 0.00000216 -0.00000181 Cu 6.42733551 0.74536738 38.81508113 0.00000195 0.00000346 0.00000086 Cu 12.85080337 11.87114011 38.81508118 0.00000081 0.00000069 0.00000027 Cu 3.85794862 0.74536734 38.81508115 -0.00000059 0.00000367 0.00000059 Cu 12.85079037 10.38765680 40.91298321 0.00000095 0.00000327 -0.00000178 Cu 16.70487091 12.61281120 40.91298299 0.00000220 0.00000466 0.00000074 Cu 15.42017747 10.38765693 40.91298304 0.00000101 0.00000185 0.00000021 Cu 14.13548404 12.61281116 40.91298299 -0.00000026 0.00000472 0.00000068 Cu 15.42016583 8.90417868 43.01083968 0.00000135 0.00000429 -0.00000163 Cu 19.27424639 11.12933308 43.01083949 0.00000239 0.00000564 0.00000060 Cu 17.98955292 8.90417881 43.01083953 0.00000125 0.00000301 0.00000016 Cu 16.70485950 11.12933308 43.01083948 0.00000018 0.00000558 0.00000068 Cu 17.98954313 7.42070703 45.10899334 0.00000165 0.00000520 -0.00000136 Cu 6.42730113 9.64586141 45.10899319 0.00000245 0.00000638 0.00000044 Cu 5.14260767 7.42070711 45.10899321 0.00000146 0.00000416 0.00000010 Cu 19.27423676 9.64586143 45.10899318 0.00000065 0.00000625 0.00000059 Cu 5.14260002 5.93724295 47.20520329 0.00000182 0.00000596 -0.00000097 Cu 8.99668061 8.16239737 47.20520318 0.00000237 0.00000683 0.00000028 Cu 7.71198713 5.93724301 47.20520320 0.00000163 0.00000523 0.00000005 Cu 6.42729363 8.16239738 47.20520318 0.00000109 0.00000672 0.00000042 Cu 7.71198204 4.45378817 49.31429730 0.00000190 0.00000652 -0.00000056 Cu 11.56606267 6.67894263 49.31429723 0.00000217 0.00000696 0.00000012 Cu 10.28136915 4.45378821 49.31429725 0.00000179 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10.28148604 10.38795529 28.32559754 -0.00000024 -0.00000440 0.00000039 Cu 8.99679263 12.61310967 28.32559761 -0.00000176 -0.00000284 -0.00000034 Cu 10.28147322 8.90447206 30.42349951 -0.00000146 -0.00000249 -0.00000107 Cu 14.13555364 11.12962655 30.42349933 0.00000022 -0.00000241 0.00000098 Cu 12.85086015 8.90447215 30.42349938 0.00000003 -0.00000353 0.00000039 Cu 11.56616672 11.12962650 30.42349944 -0.00000159 -0.00000157 -0.00000020 Cu 12.85084631 7.42098544 32.52139446 -0.00000100 -0.00000137 -0.00000133 Cu 16.70492679 9.64613984 32.52139426 0.00000068 -0.00000091 0.00000101 Cu 15.42023328 7.42098552 32.52139431 0.00000027 -0.00000256 0.00000038 Cu 14.13553988 9.64613983 32.52139435 -0.00000141 -0.00000022 -0.00000001 Cu 15.42021886 5.93749702 34.61929045 -0.00000046 -0.00000018 -0.00000156 Cu 19.27429943 8.16265139 34.61929022 0.00000115 0.00000062 0.00000100 Cu 17.98960589 5.93749711 34.61929028 0.00000049 -0.00000151 0.00000035 Cu 16.70491253 8.16265136 34.61929029 -0.00000119 0.00000117 0.00000021 Cu 2.57326887 4.45400859 36.71718643 0.00000008 0.00000103 -0.00000172 Cu 6.42734943 6.67916302 36.71718620 0.00000162 0.00000208 0.00000094 Cu 5.14265593 4.45400872 36.71718625 0.00000070 -0.00000043 0.00000031 Cu 3.85796256 6.67916294 36.71718624 -0.00000089 0.00000248 0.00000042 Cu 5.14264202 2.97052196 38.81508136 0.00000055 0.00000218 -0.00000180 Cu 8.99672251 5.19567642 38.81508113 0.00000201 0.00000343 0.00000086 Cu 7.71202909 2.97052214 38.81508118 0.00000088 0.00000068 0.00000027 Cu 6.42733564 5.19567635 38.81508116 -0.00000054 0.00000365 0.00000059 Cu 7.71201617 1.48703884 40.91298321 0.00000096 0.00000326 -0.00000177 Cu 11.56609665 3.71219324 40.91298298 0.00000225 0.00000465 0.00000075 Cu 10.28140325 1.48703899 40.91298303 0.00000103 0.00000182 0.00000021 Cu 8.99670977 3.71219323 40.91298299 -0.00000020 0.00000469 0.00000068 Cu 10.28139168 0.00356073 43.01083968 0.00000133 0.00000427 -0.00000163 Cu 14.13547223 2.22871508 43.01083947 0.00000238 0.00000566 0.00000061 Cu 20.55894006 13.35448781 43.01083952 0.00000122 0.00000301 0.00000016 Cu 11.56608532 2.22871510 43.01083947 0.00000018 0.00000558 0.00000069 Cu 20.55893024 11.87101602 45.10899335 0.00000163 0.00000520 -0.00000136 Cu 1.28852699 0.74524341 45.10899317 0.00000242 0.00000639 0.00000045 Cu 7.71199479 11.87101609 45.10899321 0.00000144 0.00000417 0.00000010 Cu 14.13546262 0.74524343 45.10899316 0.00000062 0.00000627 0.00000060 Cu 7.71198711 10.38755194 47.20520330 0.00000182 0.00000596 -0.00000097 Cu 11.56606771 12.61270636 47.20520319 0.00000236 0.00000683 0.00000027 Cu 10.28137423 10.38755201 47.20520321 0.00000163 0.00000523 0.00000004 Cu 8.99668073 12.61270637 47.20520317 0.00000108 0.00000672 0.00000042 Cu 10.28136915 8.90409717 49.31429730 0.00000189 0.00000651 -0.00000056 Cu 14.13544977 11.12925162 49.31429727 0.00000216 0.00000697 0.00000011 Cu 12.85075626 8.90409720 49.31429726 0.00000178 0.00000614 -0.00000001 Cu 11.56606273 11.12925163 49.31429725 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8.16290558 22.03337738 -0.00000143 -0.00000640 0.00000046 Cu 12.85090211 5.93775108 22.03337738 -0.00000123 -0.00000638 0.00000025 Cu 11.56620862 8.16290553 22.03337743 -0.00000197 -0.00000586 -0.00000027 Cu 12.85089461 4.45428700 24.12958744 -0.00000218 -0.00000537 -0.00000037 Cu 16.70497513 6.67944155 24.12958735 -0.00000111 -0.00000577 0.00000065 Cu 15.42028159 4.45428705 24.12958738 -0.00000090 -0.00000586 0.00000031 Cu 14.13558811 6.67944147 24.12958744 -0.00000194 -0.00000502 -0.00000038 Cu 15.42027199 2.97081536 26.22774115 -0.00000208 -0.00000453 -0.00000058 Cu 3.85802994 5.19596992 26.22774102 -0.00000075 -0.00000489 0.00000080 Cu 2.57333638 2.97081544 26.22774107 -0.00000058 -0.00000521 0.00000035 Cu 16.70496551 5.19596983 26.22774113 -0.00000190 -0.00000402 -0.00000041 Cu 2.57332491 1.48733728 28.32559765 -0.00000181 -0.00000358 -0.00000083 Cu 6.42740546 3.71249176 28.32559749 -0.00000032 -0.00000374 0.00000091 Cu 5.14271186 1.48733735 28.32559755 -0.00000024 -0.00000443 0.00000038 Cu 3.85801849 3.71249172 28.32559761 -0.00000179 -0.00000286 -0.00000035 Cu 5.14269895 0.00385411 30.42349952 -0.00000141 -0.00000251 -0.00000108 Cu 8.99677949 2.22900852 30.42349933 0.00000020 -0.00000237 0.00000098 Cu 15.42024719 13.35478112 30.42349938 0.00000006 -0.00000351 0.00000039 Cu 6.42739255 2.22900849 30.42349944 -0.00000160 -0.00000156 -0.00000021 Cu 15.42023335 11.87129439 32.52139446 -0.00000097 -0.00000134 -0.00000133 Cu 11.56615253 0.74552184 32.52139426 0.00000073 -0.00000090 0.00000101 Cu 17.98962034 11.87129445 32.52139431 0.00000029 -0.00000252 0.00000038 Cu 8.99676564 0.74552179 32.52139435 -0.00000138 -0.00000018 -0.00000001 Cu 17.98960602 10.38780595 34.61929045 -0.00000051 -0.00000014 -0.00000155 Cu 21.84368643 12.61296043 34.61929022 0.00000121 0.00000059 0.00000100 Cu 20.55899302 10.38780609 34.61929028 0.00000047 -0.00000151 0.00000035 Cu 19.27429956 12.61296035 34.61929029 -0.00000115 0.00000117 0.00000021 Cu 5.14265606 8.90431759 36.71718643 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