612 Lattice="15.439330505335704 0.0 0.0 7.719665252667851 13.370852435044755 0.0 0.0 0.0 71.43490989337855" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1986.0074618006308 stress="0.002824088898015746 -3.8930497607637264e-07 -6.169464127286154e-07 -3.8930497607637264e-07 0.002826922523105936 -2.2399462494706258e-06 -6.169464127286154e-07 -2.2399462494706258e-06 -3.1776005149081046e-08" pbc="T T F" Cu 0.00397418 0.00403488 17.91957065 -0.00000192 -0.00000705 0.00000035 Cu 3.86380683 2.23251029 17.91957071 -0.00000231 -0.00000725 -0.00000041 Cu 2.57719595 0.00403486 17.91957069 -0.00000214 -0.00000674 -0.00000019 Cu 1.29058504 2.23251031 17.91957069 -0.00000175 -0.00000738 -0.00000017 Cu 10.29685885 11.88922893 19.96406844 -0.00000155 -0.00000677 0.00000105 Cu 6.43702632 0.74685195 19.96406857 -0.00000288 -0.00000743 -0.00000087 Cu 12.87008066 11.88922887 19.96406853 -0.00000240 -0.00000576 -0.00000027 Cu 3.86380444 0.74685197 19.96406853 -0.00000107 -0.00000792 -0.00000032 Cu 12.87007567 10.40356133 22.06454592 -0.00000127 -0.00000626 0.00000179 Cu 16.72990843 12.63203682 22.06454614 -0.00000321 -0.00000751 -0.00000147 Cu 15.44329750 10.40356123 22.06454606 -0.00000242 -0.00000473 -0.00000026 Cu 14.15668650 12.63203686 22.06454607 -0.00000048 -0.00000818 -0.00000041 Cu 15.44328977 8.91788393 24.16582199 -0.00000075 -0.00000541 0.00000238 Cu 19.30312256 11.14635946 24.16582227 -0.00000326 -0.00000731 -0.00000186 Cu 18.01651164 8.91788381 24.16582217 -0.00000252 -0.00000356 -0.00000030 Cu 16.72990060 11.14635952 24.16582218 -0.00000006 -0.00000831 -0.00000057 Cu 18.01650172 7.43219847 26.26684570 -0.00000046 -0.00000454 0.00000291 Cu 6.43700403 9.66067404 26.26684603 -0.00000343 -0.00000693 -0.00000223 Cu 5.15039309 7.43219832 26.26684591 -0.00000230 -0.00000213 -0.00000027 Cu 19.30311253 9.66067410 26.26684593 0.00000060 -0.00000792 -0.00000067 Cu 5.15038134 5.94650607 28.36787133 0.00000001 -0.00000334 0.00000340 Cu 9.01021418 8.17498165 28.36787172 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Cu 19.30300630 11.14593330 43.07505735 -0.00000048 0.00000417 -0.00000195 Cu 18.01639539 8.91745762 43.07505723 0.00000017 0.00000834 -0.00000009 Cu 16.72978431 11.14593340 43.07505727 0.00000326 0.00000271 -0.00000064 Cu 18.01638546 7.43177233 45.17608081 0.00000220 0.00000686 0.00000243 Cu 6.43688774 9.66024788 45.17608109 -0.00000014 0.00000464 -0.00000176 Cu 5.15027677 7.43177219 45.17608098 0.00000113 0.00000896 -0.00000017 Cu 19.30299626 9.66024791 45.17608099 0.00000347 0.00000407 -0.00000031 Cu 5.15026906 5.94609497 47.27735694 0.00000270 0.00000701 0.00000210 Cu 9.01010182 8.17457042 47.27735715 0.00000068 0.00000610 -0.00000117 Cu 7.72349093 5.94609487 47.27735708 0.00000098 0.00000840 -0.00000006 Cu 6.43687991 8.17457049 47.27735710 0.00000304 0.00000516 -0.00000036 Cu 7.72348594 4.46042738 49.37783454 0.00000225 0.00000720 0.00000114 Cu 11.58331865 6.68890283 49.37783466 0.00000102 0.00000636 -0.00000074 Cu 10.29670773 4.46042730 49.37783461 0.00000168 0.00000830 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0.00000745 0.00000003 Cu 6.43687276 5.20324444 51.42233244 0.00000227 0.00000683 0.00000002 Cu 12.87008293 4.46098571 17.91957066 -0.00000191 -0.00000706 0.00000035 Cu 16.72991558 6.68946111 17.91957071 -0.00000229 -0.00000725 -0.00000042 Cu 15.44330469 4.46098568 17.91957069 -0.00000214 -0.00000674 -0.00000019 Cu 14.15669379 6.68946113 17.91957069 -0.00000176 -0.00000739 -0.00000017 Cu 15.44330236 2.97532732 19.96406844 -0.00000155 -0.00000679 0.00000106 Cu 3.86380456 5.20380276 19.96406856 -0.00000287 -0.00000743 -0.00000085 Cu 2.57719366 2.97532724 19.96406853 -0.00000240 -0.00000574 -0.00000031 Cu 16.72991320 5.20380279 19.96406853 -0.00000108 -0.00000792 -0.00000030 Cu 2.57718868 1.48965971 22.06454592 -0.00000132 -0.00000632 0.00000185 Cu 6.43702143 3.71813519 22.06454613 -0.00000326 -0.00000753 -0.00000143 Cu 5.15041050 1.48965960 22.06454607 -0.00000239 -0.00000469 -0.00000034 Cu 3.86379950 3.71813523 22.06454607 -0.00000043 -0.00000814 -0.00000043 Cu 12.87006802 13.37483474 24.16582199 -0.00000080 -0.00000545 0.00000245 Cu 9.01023556 2.23245783 24.16582227 -0.00000332 -0.00000731 -0.00000187 Cu 15.44328988 13.37483462 24.16582217 -0.00000251 -0.00000355 -0.00000033 Cu 6.43701359 2.23245790 24.16582219 0.00000004 -0.00000828 -0.00000062 Cu 15.44327996 11.88914928 26.26684570 -0.00000043 -0.00000448 0.00000291 Cu 11.58344753 0.74677241 26.26684604 -0.00000347 -0.00000690 -0.00000228 Cu 18.01650184 11.88914913 26.26684590 -0.00000234 -0.00000215 -0.00000023 Cu 9.01022551 0.74677248 26.26684593 0.00000066 -0.00000797 -0.00000066 Cu 18.01649009 10.40345687 28.36787134 0.00000006 -0.00000327 0.00000335 Cu 21.87632294 12.63193246 28.36787172 -0.00000334 -0.00000607 -0.00000254 Cu 20.58971199 10.40345671 28.36787158 -0.00000221 -0.00000072 -0.00000034 Cu 19.30310090 12.63193254 28.36787161 0.00000111 -0.00000732 -0.00000079 Cu 5.15036828 8.91775883 30.46889801 0.00000046 -0.00000211 0.00000371 Cu 9.01020116 11.14623442 30.46889843 -0.00000336 -0.00000487 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0.00000311 -0.00000175 -0.00000066 Cu 15.44319812 2.97494658 38.87300459 0.00000216 0.00000399 0.00000402 Cu 3.86370050 5.20342215 38.87300502 -0.00000176 0.00000148 -0.00000251 Cu 2.57708955 2.97494639 38.87300488 -0.00000065 0.00000695 -0.00000032 Cu 16.72980893 5.20342226 38.87300491 0.00000326 -0.00000018 -0.00000080 Cu 2.57707636 1.48924852 40.97403133 0.00000190 0.00000537 0.00000348 Cu 6.43690919 3.71772413 40.97403173 -0.00000129 0.00000235 -0.00000256 Cu 5.15029821 1.48924834 40.97403158 0.00000027 0.00000821 -0.00000032 Cu 3.86368713 3.71772419 40.97403159 0.00000354 0.00000140 -0.00000057 Cu 12.86995172 13.37440858 43.07505701 0.00000269 0.00000618 0.00000330 Cu 9.01011930 2.23203167 43.07505736 -0.00000045 0.00000421 -0.00000203 Cu 15.44317364 13.37440844 43.07505723 0.00000011 0.00000834 -0.00000010 Cu 6.43689730 2.23203177 43.07505727 0.00000329 0.00000271 -0.00000063 Cu 15.44316371 11.88872314 45.17608081 0.00000225 0.00000688 0.00000245 Cu 11.58333125 0.74634625 45.17608109 -0.00000018 0.00000467 -0.00000180 Cu 18.01638554 11.88872300 45.17608098 0.00000111 0.00000896 -0.00000019 Cu 9.01010926 0.74634630 45.17608099 0.00000347 0.00000401 -0.00000025 Cu 18.01637781 10.40304578 47.27735694 0.00000270 0.00000701 0.00000212 Cu 21.87621058 12.63152124 47.27735715 0.00000060 0.00000609 -0.00000113 Cu 20.58959967 10.40304569 47.27735709 0.00000102 0.00000842 -0.00000012 Cu 19.30298867 12.63152131 47.27735710 0.00000308 0.00000514 -0.00000034 Cu 5.15026419 8.91737819 49.37783454 0.00000222 0.00000717 0.00000116 Cu 9.01009690 11.14585365 49.37783466 0.00000098 0.00000634 -0.00000072 Cu 7.72348597 8.91737811 49.37783462 0.00000171 0.00000832 -0.00000007 Cu 6.43687501 11.14585367 49.37783461 0.00000297 0.00000607 -0.00000005 Cu 7.72348364 7.43171983 51.42233240 0.00000217 0.00000716 0.00000058 Cu 11.58331629 9.66019525 51.42233245 0.00000178 0.00000699 -0.00000019 Cu 10.29670541 7.43171981 51.42233243 0.00000187 0.00000745 0.00000004 Cu 9.01009451 9.66019526 51.42233244 0.00000227 0.00000683 0.00000001 Cu 15.44330468 8.91793651 17.91957066 -0.00000191 -0.00000705 0.00000034 Cu 19.30313734 11.14641193 17.91957071 -0.00000229 -0.00000726 -0.00000042 Cu 18.01652645 8.91793648 17.91957069 -0.00000214 -0.00000674 -0.00000018 Cu 16.72991556 11.14641194 17.91957069 -0.00000177 -0.00000739 -0.00000017 Cu 18.01652410 7.43227813 19.96406844 -0.00000153 -0.00000679 0.00000103 Cu 6.43702630 9.66075358 19.96406856 -0.00000282 -0.00000746 -0.00000086 Cu 5.15041539 7.43227806 19.96406852 -0.00000238 -0.00000575 -0.00000027 Cu 19.30313494 9.66075361 19.96406853 -0.00000112 -0.00000793 -0.00000031 Cu 5.15041042 5.94661052 22.06454592 -0.00000131 -0.00000632 0.00000182 Cu 9.01024316 8.17508601 22.06454613 -0.00000318 -0.00000756 -0.00000144 Cu 7.72363224 5.94661041 22.06454606 -0.00000237 -0.00000468 -0.00000029 Cu 6.43702124 8.17508605 22.06454607 -0.00000049 -0.00000815 -0.00000046 Cu 7.72362453 4.46093311 24.16582199 -0.00000083 -0.00000543 0.00000245 Cu 11.58345731 6.68940864 24.16582227 -0.00000325 -0.00000732 -0.00000190 Cu 10.29684639 4.46093299 24.16582216 -0.00000251 -0.00000352 -0.00000030 Cu 9.01023535 6.68940871 24.16582219 -0.00000004 -0.00000830 -0.00000065 Cu 10.29683646 2.97524765 26.26684570 -0.00000047 -0.00000445 0.00000296 Cu 14.15666928 5.20372322 26.26684604 -0.00000344 -0.00000688 -0.00000231 Cu 12.87005834 2.97524750 26.26684590 -0.00000234 -0.00000210 -0.00000024 Cu 11.58344727 5.20372329 26.26684593 0.00000062 -0.00000800 -0.00000068 Cu 12.87004659 1.48955525 28.36787133 0.00000002 -0.00000324 0.00000345 Cu 16.72987944 3.71803083 28.36787173 -0.00000338 -0.00000601 -0.00000255 Cu 15.44326849 1.48955508 28.36787158 -0.00000221 -0.00000065 -0.00000041 Cu 14.15665739 3.71803092 28.36787161 0.00000114 -0.00000735 -0.00000079 Cu 7.72359004 13.37470964 30.46889800 0.00000043 -0.00000209 0.00000383 Cu 3.86375767 2.23233279 30.46889843 -0.00000348 -0.00000480 -0.00000268 Cu 10.29681195 13.37470944 30.46889828 -0.00000199 0.00000100 -0.00000039 Cu 1.29053556 2.23233288 30.46889831 0.00000196 -0.00000623 -0.00000080 Cu 10.29679775 11.88900760 32.56992465 0.00000083 -0.00000059 0.00000399 Cu 6.43696539 0.74663076 32.56992510 -0.00000318 -0.00000338 -0.00000291 Cu 12.87001967 11.88900739 32.56992494 -0.00000167 0.00000257 -0.00000049 Cu 3.86374327 0.74663085 32.56992496 0.00000244 -0.00000484 -0.00000077 Cu 12.87000494 10.40330351 34.67095129 0.00000150 0.00000093 0.00000408 Cu 16.72983785 12.63177909 34.67095174 -0.00000285 -0.00000163 -0.00000280 Cu 15.44322689 10.40330331 34.67095158 -0.00000149 0.00000412 -0.00000036 Cu 14.15661573 12.63177920 34.67095161 0.00000287 -0.00000339 -0.00000073 Cu 15.44321217 8.91759942 36.77197795 0.00000155 0.00000262 0.00000386 Cu 19.30304506 11.14607502 36.77197839 -0.00000242 -0.00000042 -0.00000285 Cu 18.01643407 8.91759921 36.77197824 -0.00000071 0.00000579 -0.00000046 Cu 16.72982294 11.14607511 36.77197825 0.00000317 -0.00000170 -0.00000065 Cu 18.01641987 7.43189739 38.87300460 0.00000219 0.00000397 0.00000392 Cu 6.43692225 9.66037296 38.87300502 -0.00000172 0.00000144 -0.00000248 Cu 5.15031131 7.43189721 38.87300488 -0.00000064 0.00000686 -0.00000024 Cu 19.30303068 9.66037306 38.87300492 0.00000323 -0.00000011 -0.00000081 Cu 5.15029811 5.94619933 40.97403134 0.00000190 0.00000539 0.00000336 Cu 9.01013094 8.17467495 40.97403173 -0.00000120 0.00000230 -0.00000255 Cu 7.72351997 5.94619915 40.97403157 0.00000028 0.00000814 -0.00000020 Cu 6.43690889 8.17467500 40.97403160 0.00000344 0.00000145 -0.00000060 Cu 7.72350821 4.46050695 43.07505702 0.00000269 0.00000622 0.00000320 Cu 11.58334104 6.68898249 43.07505736 -0.00000035 0.00000418 -0.00000205 Cu 10.29673014 4.46050682 43.07505723 0.00000012 0.00000829 -0.00000001 Cu 9.01011906 6.68898259 43.07505727 0.00000318 0.00000273 -0.00000067 Cu 10.29672021 2.97482151 45.17608081 0.00000223 0.00000693 0.00000240 Cu 14.15655299 5.20329706 45.17608109 -0.00000011 0.00000467 -0.00000183 Cu 12.86994204 2.97482137 45.17608098 0.00000110 0.00000896 -0.00000015 Cu 11.58333101 5.20329711 45.17608099 0.00000339 0.00000400 -0.00000028 Cu 12.86993432 1.48914415 47.27735694 0.00000269 0.00000703 0.00000213 Cu 16.72976708 3.71761962 47.27735715 0.00000061 0.00000611 -0.00000117 Cu 15.44315618 1.48914406 47.27735708 0.00000100 0.00000844 -0.00000013 Cu 14.15654517 3.71761968 47.27735709 0.00000305 0.00000512 -0.00000034 Cu 7.72348594 13.37432901 49.37783453 0.00000222 0.00000717 0.00000118 Cu 3.86365340 2.23195203 49.37783466 0.00000097 0.00000635 -0.00000074 Cu 10.29670772 13.37432893 49.37783462 0.00000170 0.00000834 -0.00000010 Cu 1.29043151 2.23195205 49.37783461 0.00000298 0.00000605 -0.00000003 Cu 10.29670538 11.88867065 51.42233240 0.00000217 0.00000715 0.00000059 Cu 6.43687278 0.74629363 51.42233245 0.00000177 0.00000700 -0.00000019 Cu 12.86992715 11.88867063 51.42233244 0.00000188 0.00000745 0.00000002 Cu 3.86365100 0.74629364 51.42233243 0.00000229 0.00000682 0.00000002