864 Lattice="15.336353696210232 0.0 0.0 15.336353696210232 18.783120535280922 0.0 0.0 0.0 70.83558347915431" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2999.867366038306 stress="0.001703627167287535 -4.463103244542692e-07 -1.3812964631583448e-06 -4.463103244542692e-07 0.0015100385818281321 1.8363672969044026e-06 -1.3812964631583448e-06 1.8363672969044026e-06 1.950362407686104e-07" pbc="T T F" Cu 0.00138949 -0.02480293 17.79478767 -0.00000322 0.00000494 0.00000040 Cu 3.83547784 2.08907334 18.43739877 -0.00000344 0.00000514 -0.00000024 Cu 2.55744837 -0.02480236 17.79478731 -0.00000282 0.00000477 0.00000088 Cu 6.39153691 2.08907186 18.43739969 -0.00000351 0.00000588 -0.00000021 Cu 17.89380014 16.70202220 19.16691403 -0.00000316 0.00000533 0.00000214 Cu 6.39153299 0.01303358 19.96677668 -0.00000223 0.00000616 0.00000113 Cu 20.44985948 16.70202130 19.16691487 -0.00000391 0.00000514 0.00000120 Cu 8.94759206 0.01303261 19.96677754 -0.00000406 0.00000594 -0.00000034 Cu 20.44985811 14.61343437 20.65888006 -0.00000458 0.00000493 0.00000054 Cu 24.28394206 16.69630214 21.39251651 -0.00000508 0.00000567 -0.00000010 Cu 23.00591695 14.61343297 20.65888093 -0.00000347 0.00000717 0.00000203 Cu 26.84000073 16.69630224 21.39251622 -0.00000189 0.00000658 0.00000087 Cu 23.00591362 12.52248487 22.15235008 -0.00000467 0.00000648 0.00000433 Cu 26.83999611 14.61165140 22.87319997 -0.00000148 0.00000537 0.00000215 Cu 25.56197261 12.52248456 22.15235065 -0.00000459 0.00000502 0.00000070 Cu 14.05970174 14.61165249 22.87319911 -0.00000657 0.00000457 0.00000180 Cu 10.22561177 10.43524747 23.61237590 -0.00000391 0.00000423 -0.00000105 Cu 14.05969480 12.52330483 24.35813883 -0.00000777 0.00000534 0.00000063 Cu 12.78167090 10.43524796 23.61237510 -0.00000565 0.00000643 0.00000191 Cu 16.61575320 12.52330570 24.35813822 -0.00000096 0.00000489 0.00000045 Cu 12.78165985 8.34971611 25.08929285 -0.00000608 0.00000573 0.00000281 Cu 16.61574248 10.43592260 25.82825202 -0.00000136 0.00000243 0.00000170 Cu 15.33771852 8.34971731 25.08929222 -0.00000242 0.00000352 0.00000063 Cu 19.17180177 10.43592237 25.82825205 -0.00000697 0.00000359 0.00000316 Cu 15.33770463 6.26230389 26.56882961 -0.00000078 0.00000332 -0.00000144 Cu 19.17178779 8.34944899 27.30404300 -0.00000559 0.00000517 0.00000094 Cu 17.89376390 6.26230420 26.56882926 -0.00000600 0.00000399 -0.00000002 Cu 21.72784641 8.34944822 27.30404388 -0.00000141 0.00000365 -0.00000207 Cu 17.89374871 4.17512815 28.04255526 -0.00000547 0.00000333 0.00000053 Cu 6.39147687 6.26232777 28.78132457 -0.00000180 0.00000089 -0.00000069 Cu 5.11345349 4.17512753 28.04255570 0.00000037 0.00000372 0.00000073 Cu 8.94753597 6.26232688 28.78132483 -0.00000350 0.00000366 0.00000260 Cu 5.11343793 2.08833959 29.51817266 0.00000056 0.00000342 0.00000009 Cu 8.94751894 4.17525520 30.25636353 -0.00000129 0.00000462 0.00000017 Cu 7.66949725 2.08833882 29.51817344 -0.00000454 0.00000243 -0.00000178 Cu 11.50357802 4.17525552 30.25636367 -0.00000243 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36.15943131 0.00000152 -0.00000213 -0.00000025 Cu 17.89366519 12.52348815 35.42154428 0.00000242 -0.00000068 0.00000108 Cu 21.72774417 14.61050068 36.15943170 -0.00000070 -0.00000044 0.00000142 Cu 17.89364704 10.43648427 36.89718408 0.00000359 -0.00000141 -0.00000101 Cu 21.72772675 12.52354610 37.63515098 0.00000059 0.00000053 0.00000052 Cu 20.44970644 10.43648378 36.89718439 -0.00000254 -0.00000110 -0.00000068 Cu 24.28378567 12.52354575 37.63515159 0.00000113 -0.00000135 -0.00000276 Cu 20.44968822 8.34949488 38.37315599 -0.00000187 -0.00000178 0.00000158 Cu 8.94741473 10.43652336 39.11064786 0.00000130 -0.00000430 -0.00000070 Cu 7.66939303 8.34949420 38.37315645 0.00000445 -0.00000142 0.00000163 Cu 11.50347365 10.43652339 39.11064748 0.00000156 -0.00000189 0.00000286 Cu 7.66937514 6.26258513 39.84880969 0.00000467 -0.00000217 -0.00000144 Cu 11.50345657 8.34950157 40.58699964 0.00000249 -0.00000069 0.00000001 Cu 10.22543445 6.26258501 39.84880983 -0.00000031 -0.00000242 -0.00000164 Cu 14.05951555 8.34950241 40.58699941 0.00000187 -0.00000314 -0.00000307 Cu 10.22541746 4.17551355 41.32384770 0.00000158 -0.00000290 0.00000089 Cu 14.05949914 6.26271490 42.06261649 0.00000300 -0.00000549 -0.00000009 Cu 12.78147620 4.17551409 41.32384735 0.00000446 -0.00000324 0.00000093 Cu 16.61555810 6.26271524 42.06261598 0.00000309 -0.00000399 0.00000220 Cu 12.78146141 2.08839356 42.80112701 0.00000369 -0.00000376 -0.00000163 Cu 16.61554328 4.17553939 43.53634155 0.00000338 -0.00000357 -0.00000100 Cu 15.33752039 2.08839420 42.80112646 0.00000354 -0.00000360 -0.00000079 Cu 3.83524851 4.17553921 43.53634179 0.00000412 -0.00000405 -0.00000219 Cu 0.00115435 0.00192094 44.27691554 0.00000462 -0.00000424 0.00000063 Cu 3.83523627 2.08812598 45.01587712 0.00000501 -0.00000541 0.00000051 Cu 2.55721346 0.00192114 44.27691546 0.00000306 -0.00000513 -0.00000023 Cu 6.39129533 2.08812528 45.01587770 0.00000331 -0.00000516 -0.00000000 Cu 17.89355761 16.69765822 45.74702849 0.00000199 -0.00000522 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50.13839522 0.00000307 -0.00000595 -0.00000133 Cu 16.61550848 12.51894291 50.93825327 0.00000325 -0.00000638 -0.00000098 Cu 12.78141369 8.34877036 51.66777413 0.00000443 -0.00000592 -0.00000051 Cu 16.61550090 10.46264868 52.31038252 0.00000452 -0.00000632 -0.00000061 Cu 15.33747251 8.34877120 51.66777348 0.00000486 -0.00000617 -0.00000030 Cu 19.17155982 10.46264825 52.31038261 0.00000464 -0.00000610 -0.00000014 Cu 5.11351733 6.23623158 17.79479015 -0.00000565 0.00000666 -0.00000060 Cu 8.94760403 8.35010747 18.43739750 -0.00000629 0.00000727 0.00000018 Cu 7.66957632 6.23622984 17.79479109 -0.00000599 0.00000726 -0.00000027 Cu 11.50366260 8.35010773 18.43739739 -0.00000514 0.00000705 -0.00000003 Cu 7.66956643 4.17993839 19.16692319 -0.00000444 0.00000671 -0.00000110 Cu 11.50365766 6.27407224 19.96677957 -0.00000373 0.00000593 -0.00000082 Cu 10.22562492 4.17993792 19.16692366 -0.00000349 0.00000625 -0.00000138 Cu 14.05971683 6.27407340 19.96677858 -0.00000640 0.00000600 0.00000065 Cu 10.22561985 2.09135184 20.65888866 -0.00000220 0.00000641 -0.00000077 Cu 14.05970732 4.17422273 21.39252132 -0.00000407 0.00000657 -0.00000029 Cu 12.78167891 2.09135266 20.65888798 -0.00000446 0.00000565 -0.00000070 Cu 16.61576626 4.17422375 21.39252053 -0.00000362 0.00000504 -0.00000136 Cu 12.78167301 0.00040427 22.15235516 -0.00000480 0.00000558 -0.00000094 Cu 16.61575783 2.08957253 22.87320515 -0.00000375 0.00000413 -0.00000113 Cu 0.00137802 0.00040536 22.15235406 -0.00000157 0.00000592 0.00000120 Cu 3.83546294 2.08957227 22.87320516 -0.00000267 0.00000567 0.00000081 Cu 15.33772496 16.69628853 23.61237568 -0.00000229 0.00000590 0.00000296 Cu 3.83545393 0.00122436 24.35814305 -0.00000098 0.00000539 0.00000164 Cu 17.89378401 16.69628911 23.61237554 -0.00000455 0.00000367 0.00000052 Cu 6.39151315 0.00122347 24.35814404 -0.00000506 0.00000440 -0.00000088 Cu 17.89377597 14.61075744 25.08929000 -0.00000431 0.00000318 -0.00000088 Cu 21.72785724 16.69696075 25.82825491 -0.00000602 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