864 Lattice="21.56070692076179 0.0 0.0 0.0 21.56070692076179 0.0 0.0 0.0 21.56070692076179" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2737.950343297064 stress="-1.3081937491855005 2.6187588617757056 0.5507096833010401 2.6187588617757056 -1.8469659448341815 -0.1381795782509414 0.5507096833010401 -0.1381795782509414 -0.9988331150286083" pbc="F F F" Cu 0.00659444 0.01786902 -0.02000998 0.52680323 0.48961157 0.51547145 Cu 1.81531602 1.81901330 -0.00875270 -0.09845760 -0.12223452 0.22380491 Cu 1.82421774 -0.00322336 1.82737379 -0.18452445 0.12253261 -0.15429877 Cu 0.01411807 1.79681107 1.82461612 0.11800069 -0.06947211 -0.18592972 Cu 3.57817725 -0.03316102 0.02381376 -0.00768270 0.35638539 0.27596877 Cu 5.37394259 1.78902273 0.01278135 0.05801356 -0.04882167 0.10795259 Cu 5.36227804 -0.02294645 1.81686464 0.14907044 0.09696463 -0.10623692 Cu 3.58514356 1.78535890 1.80371439 0.06946697 -0.03117296 -0.25220124 Cu 7.13733704 -0.02810743 -0.02614952 0.06216587 0.44764292 0.49971125 Cu 8.96135230 1.81315563 -0.03188442 -0.02352968 -0.12173321 0.34377149 Cu 8.94814414 -0.01049447 1.83033857 0.08457723 0.17571732 -0.33811281 Cu 7.16574892 1.81097617 1.82751953 0.05011706 -0.23219412 -0.46569956 Cu 10.81515809 0.00520448 0.02327953 -0.11683385 0.29417367 0.26411406 Cu 12.60459012 1.81125649 -0.01481307 -0.08311300 0.09274614 0.07664575 Cu 12.59651246 0.02257997 1.76751079 0.01727580 0.02937814 0.22070583 Cu 10.80088295 1.76489693 1.79529579 -0.17948207 0.15474364 -0.21314085 Cu 14.33091673 -0.00358192 0.00086074 0.05753672 0.27554085 0.26035120 Cu 16.14621182 1.76474900 0.00886741 0.10422223 0.08524386 0.06896037 Cu 16.12390547 -0.01781364 1.79548759 0.16690321 0.07089631 -0.12321839 Cu 14.38767819 1.82961096 1.79860046 -0.10890395 -0.28318955 -0.11588730 Cu 17.97910368 0.01165746 -0.02258470 -0.14518698 0.35646794 0.43044653 Cu 19.75815380 1.79153136 -0.01280613 -0.33188452 0.10645589 0.36405550 Cu 19.75619488 0.02653862 1.78313593 -0.30115786 0.30825018 0.10665583 Cu 17.95548871 1.77582058 1.80562265 0.06093055 0.03555906 -0.21902081 Cu -0.01962225 3.60162937 0.00896285 0.38515320 -0.07037225 0.37566564 Cu 1.78747646 5.42393984 0.00559183 0.14062454 -0.22196387 0.14962322 Cu 1.79084549 3.56909482 1.83052504 -0.00956658 0.13579150 -0.42016369 Cu 0.01473861 5.36221960 1.81903506 0.05213082 0.09356672 -0.17200097 Cu 3.62053879 3.57686391 -0.01916454 -0.18793840 0.12974783 0.19303867 Cu 5.34617321 5.41183177 -0.03278080 0.14455221 -0.06405472 0.12809997 Cu 5.38212021 3.61292295 1.80725583 -0.04862410 -0.16151361 -0.09187700 Cu 3.60920941 5.40812059 1.82449588 -0.16513983 -0.18682630 -0.28087385 Cu 7.15341519 3.62586582 0.01766701 0.08651847 -0.08183585 0.05366458 Cu 8.98189971 5.41158336 0.03033273 -0.06494292 -0.13138348 -0.08674999 Cu 9.00492562 3.59406051 1.83239817 -0.21886796 -0.17655365 -0.54655500 Cu 7.15297856 5.41207911 1.81137474 0.15086551 -0.20964080 -0.23998672 Cu 10.75809329 3.61897232 -0.02255627 0.03558432 -0.20198085 0.08225468 Cu 12.55031856 5.39748035 -0.02780543 0.14903696 -0.11712026 0.06759006 Cu 12.57415171 3.61342408 1.77020623 -0.09679821 -0.10318855 -0.04109167 Cu 10.75988718 5.38242970 1.78565127 0.19505917 0.01695073 -0.11156353 Cu 14.40206471 3.61446812 0.00860277 -0.09106924 -0.04778967 -0.01585313 Cu 16.13711562 5.39462505 -0.00409202 0.22295295 0.01911273 0.02849768 Cu 16.17455642 3.61092864 1.80894957 0.24220048 -0.12850804 -0.15820009 Cu 14.38029259 5.39819285 1.81235276 -0.11710616 0.00318755 -0.23334113 Cu 17.96715532 3.56580533 -0.00965095 -0.06743202 0.06937012 0.13929863 Cu 19.79721065 5.39917979 -0.00034889 -0.29005657 -0.01208205 0.24703905 Cu 19.77628178 3.62186648 1.76822229 -0.12411258 -0.26795973 0.06159458 Cu 18.01294116 5.39657353 1.77618796 -0.19528403 -0.12256868 0.03444044 Cu 0.02209219 7.19119374 0.00195356 0.19911886 -0.01821335 0.38847449 Cu 1.79678254 8.94121656 -0.01621654 -0.01066511 0.01670340 0.16484974 Cu 1.80351135 7.17085729 1.82730843 -0.12023352 0.16057002 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0.12585044 Cu 16.15582290 9.00088086 0.03944867 0.15191707 -0.09567714 -0.04590883 Cu 16.18109286 7.18203110 1.78027211 -0.06524514 -0.01251303 -0.11960392 Cu 14.34469953 9.01580842 1.81233248 0.11041736 -0.28974530 -0.21467364 Cu 17.98616729 7.15217803 0.00328366 -0.10153731 0.18210981 0.09346870 Cu 19.76097729 8.95602500 0.03019717 -0.29522731 0.09653955 0.19281541 Cu 19.77738297 7.22154192 1.78111088 -0.06119801 -0.13197405 0.16990756 Cu 17.96920445 9.01461899 1.82681462 0.13320353 -0.22149279 -0.39635301 Cu -0.00039479 10.74811937 -0.00228436 0.36487275 0.01257989 0.30292329 Cu 1.79393764 12.61266764 0.00810271 -0.05504221 -0.13635885 0.11114297 Cu 1.79408588 10.74560762 1.79349922 -0.20185995 0.17495204 -0.08603384 Cu -0.00316851 12.53932201 1.80106335 0.12226586 0.09359803 -0.11615745 Cu 3.58879586 10.76507148 0.02388796 -0.12030376 0.05935942 -0.18895988 Cu 5.36794276 12.60329007 0.02957547 0.09565943 -0.22296079 -0.19754666 Cu 5.35793116 10.78955776 1.74778179 0.40164003 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