504 Lattice="15.222042048516148 0.0 0.0 0.0 10.763609156012533 0.0 0.0 0.0 71.03619622640869" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1749.3153517214182 stress="0.0011752548254296126 1.6008128387230018e-11 -2.257992451685253e-06 1.6008128387230018e-11 0.0014114848863631844 1.3805417684956812e-07 -2.257992451685253e-06 1.3805417684956812e-07 -1.393580087923352e-09" pbc="T T F" Cu 0.00667149 0.00653094 17.80342477 -0.00000886 0.00000035 0.00000185 Cu 2.54367959 0.00653090 17.80342654 -0.00000919 0.00000038 0.00000075 Cu 1.27516789 1.80046588 19.02872336 -0.00000965 0.00000064 0.00000141 Cu 3.81217488 1.80046590 19.02872715 -0.00000792 0.00000029 0.00000022 Cu 2.54365466 0.00653130 20.30158708 -0.00000835 0.00000030 0.00000124 Cu 5.08066168 0.00653127 20.30159167 -0.00000862 0.00000060 -0.00000137 Cu 3.81213460 1.80046651 21.56672105 -0.00000851 0.00000008 0.00000027 Cu 6.34914154 1.80046650 21.56672511 -0.00000695 0.00000043 -0.00000056 Cu 5.08060692 0.00653212 22.83670432 -0.00000717 0.00000049 0.00000004 Cu 7.61761404 0.00653210 22.83670692 -0.00000749 0.00000071 -0.00000206 Cu 6.34907299 1.80046756 24.10462604 -0.00000690 0.00000066 -0.00000164 Cu 8.88608007 1.80046757 24.10462638 -0.00000582 0.00000052 -0.00000123 Cu 7.61753303 0.00653342 25.37336870 -0.00000524 0.00000034 -0.00000060 Cu 10.15454023 0.00653344 25.37336707 -0.00000587 -0.00000018 -0.00000123 Cu 8.88598819 1.80046909 26.64177378 -0.00000505 0.00000024 -0.00000104 Cu 11.42299528 1.80046904 26.64177057 -0.00000418 0.00000091 0.00000056 Cu 10.15443907 0.00653513 27.91031585 -0.00000339 -0.00000007 -0.00000052 Cu 12.69144619 0.00653513 27.91031227 -0.00000389 -0.00000011 -0.00000008 Cu 11.42288678 1.80047087 29.17880113 -0.00000283 0.00000137 -0.00000087 Cu 13.95989376 1.80047090 29.17879803 -0.00000261 0.00000089 0.00000104 Cu 12.69133204 0.00653719 30.44730950 -0.00000102 -0.00000090 0.00000125 Cu 15.22833902 0.00653718 30.44730790 -0.00000205 -0.00000054 0.00000115 Cu 13.95977596 1.80047303 31.71580919 -0.00000081 0.00000078 0.00000086 Cu 1.27474072 1.80047306 31.71580923 -0.00000020 0.00000059 0.00000141 Cu 15.22821921 0.00653939 32.98431365 0.00000082 -0.00000088 0.00000090 Cu 2.54318405 0.00653939 32.98431531 -0.00000015 -0.00000061 -0.00000079 Cu 1.27462078 1.80047525 34.25281729 0.00000107 0.00000128 0.00000026 Cu 3.81162761 1.80047531 34.25281974 0.00000151 0.00000066 0.00000004 Cu 2.54306539 0.00654165 35.52132230 0.00000239 -0.00000079 0.00000162 Cu 5.08007237 0.00654165 35.52132493 0.00000157 -0.00000078 -0.00000072 Cu 3.81151193 1.80047756 36.78982673 0.00000191 0.00000008 0.00000003 Cu 6.34851883 1.80047754 36.78982853 0.00000369 0.00000022 -0.00000018 Cu 5.07996078 0.00654379 38.05833250 0.00000382 -0.00000057 -0.00000044 Cu 7.61696794 0.00654380 38.05833320 0.00000282 -0.00000093 -0.00000169 Cu 6.34841283 1.80047959 39.32683376 0.00000359 0.00000051 -0.00000114 Cu 8.88541994 1.80047952 39.32683311 0.00000430 0.00000126 -0.00000057 Cu 7.61686841 0.00654576 40.59534367 0.00000428 -0.00000099 0.00000040 Cu 10.15387556 0.00654579 40.59534217 0.00000448 -0.00000159 -0.00000018 Cu 8.88532810 1.80048141 41.86383002 0.00000357 0.00000027 -0.00000019 Cu 11.42233507 1.80048141 41.86382808 0.00000599 0.00000011 0.00000079 Cu 10.15379198 0.00654743 43.13237250 0.00000534 -0.00000120 -0.00000008 Cu 12.69079910 0.00654736 43.13237092 0.00000480 -0.00000042 -0.00000021 Cu 11.42226065 1.80048287 44.40077710 0.00000540 0.00000039 -0.00000010 Cu 13.95926769 1.80048288 44.40077621 0.00000518 0.00000030 0.00000094 Cu 12.69073409 0.00654867 45.66951855 0.00000595 -0.00000057 0.00000075 Cu 15.22774113 0.00654870 45.66951874 0.00000500 -0.00000102 0.00000061 Cu 13.95921266 1.80048397 46.93743853 0.00000540 0.00000021 -0.00000043 Cu 1.27417752 1.80048401 46.93743956 0.00000581 -0.00000019 0.00000027 Cu 15.22769601 0.00654962 48.20741994 0.00000624 -0.00000142 -0.00000012 Cu 2.54266100 0.00654957 48.20742160 0.00000493 -0.00000060 -0.00000037 Cu 1.27414266 1.80048468 49.47255248 0.00000598 -0.00000002 -0.00000004 Cu 3.81114968 1.80048468 49.47255415 0.00000507 -0.00000003 0.00000015 Cu 2.54263591 0.00655000 50.74541550 0.00000593 -0.00000015 -0.00000024 Cu 5.07964302 0.00655003 50.74541677 0.00000490 -0.00000047 -0.00000035 Cu 3.81113471 1.80048499 51.97071476 0.00000543 -0.00000038 -0.00000065 Cu 6.34814214 1.80048498 51.97071518 0.00000541 -0.00000023 -0.00000034 Cu 0.00667150 3.59440066 17.80342478 -0.00000883 0.00000036 0.00000190 Cu 2.54367961 3.59440065 17.80342657 -0.00000928 0.00000050 0.00000063 Cu 1.27516788 5.38833564 19.02872340 -0.00000958 0.00000006 0.00000157 Cu 3.81217487 5.38833566 19.02872721 -0.00000795 -0.00000001 0.00000029 Cu 2.54365470 3.59440095 20.30158708 -0.00000874 0.00000084 0.00000146 Cu 5.08066165 3.59440097 20.30159172 -0.00000843 0.00000067 -0.00000167 Cu 3.81213464 5.38833618 21.56672109 -0.00000917 0.00000091 0.00000003 Cu 6.34914149 5.38833624 21.56672519 -0.00000668 0.00000026 -0.00000138 Cu 5.08060687 3.59440183 22.83670430 -0.00000661 0.00000028 0.00000037 Cu 7.61761405 3.59440187 22.83670695 -0.00000775 0.00000004 -0.00000235 Cu 6.34907298 5.38833731 24.10462597 -0.00000704 0.00000015 -0.00000061 Cu 8.88608004 5.38833727 24.10462637 -0.00000572 0.00000086 -0.00000079 Cu 7.61753307 3.59440312 25.37336869 -0.00000601 0.00000067 -0.00000047 Cu 10.15454017 3.59440315 25.37336712 -0.00000501 0.00000023 -0.00000187 Cu 8.88598824 5.38833875 26.64177381 -0.00000582 0.00000117 -0.00000148 Cu 11.42299522 5.38833880 26.64177068 -0.00000338 0.00000038 -0.00000093 Cu 10.15443904 3.59440490 27.91031581 -0.00000280 -0.00000069 0.00000023 Cu 12.69144622 3.59440488 27.91031226 -0.00000430 -0.00000051 0.00000014 Cu 11.42288680 5.38834066 29.17880103 -0.00000316 0.00000032 0.00000070 Cu 13.95989371 5.38834060 29.17879802 -0.00000191 0.00000132 0.00000133 Cu 12.69133209 3.59440687 30.44730956 -0.00000173 -0.00000036 0.00000052 Cu 15.22833898 3.59440687 30.44730791 -0.00000160 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0.00000026 -0.00000021 Cu 7.61686837 3.59441551 40.59534368 0.00000485 -0.00000133 0.00000011 Cu 10.15387558 3.59441542 40.59534223 0.00000410 -0.00000030 -0.00000105 Cu 8.88532800 5.38835113 41.86383005 0.00000499 0.00000023 -0.00000038 Cu 11.42233515 5.38835111 41.86382816 0.00000473 0.00000036 -0.00000014 Cu 10.15379198 3.59441712 43.13237247 0.00000540 -0.00000094 0.00000040 Cu 12.69079911 3.59441714 43.13237088 0.00000470 -0.00000118 0.00000036 Cu 11.42226060 5.38835260 44.40077707 0.00000601 0.00000019 0.00000033 Cu 13.95926771 5.38835259 44.40077623 0.00000471 0.00000045 0.00000064 Cu 12.69073409 3.59441841 45.66951859 0.00000590 -0.00000092 0.00000025 Cu 15.22774113 3.59441842 45.66951875 0.00000494 -0.00000102 0.00000051 Cu 13.95921262 5.38835372 46.93743846 0.00000581 -0.00000019 0.00000039 Cu 1.27417755 5.38835370 46.93743956 0.00000543 0.00000018 0.00000017 Cu 15.22769606 3.59441927 48.20741993 0.00000554 -0.00000041 0.00000011 Cu 2.54266095 3.59441930 48.20742158 0.00000548 -0.00000080 -0.00000014 Cu 1.27414269 5.38835439 49.47255246 0.00000550 0.00000004 -0.00000018 Cu 3.81114967 5.38835439 49.47255414 0.00000543 -0.00000006 -0.00000029 Cu 2.54263593 3.59441980 50.74541552 0.00000555 -0.00000077 -0.00000036 Cu 5.07964298 3.59441978 50.74541680 0.00000544 -0.00000054 -0.00000050 Cu 3.81113471 5.38835474 51.97071474 0.00000547 -0.00000024 -0.00000045 Cu 6.34814216 5.38835476 51.97071514 0.00000531 -0.00000035 -0.00000022 Cu 0.00667150 7.18227034 17.80342480 -0.00000901 0.00000041 0.00000168 Cu 2.54367958 7.18227035 17.80342663 -0.00000922 0.00000046 0.00000006 Cu 1.27516787 8.97620531 19.02872337 -0.00000959 0.00000091 0.00000155 Cu 3.81217489 8.97620531 19.02872719 -0.00000816 0.00000084 0.00000019 Cu 2.54365467 7.18227075 20.30158703 -0.00000838 0.00000022 0.00000245 Cu 5.08066165 7.18227073 20.30159168 -0.00000844 0.00000048 -0.00000102 Cu 3.81213459 8.97620600 21.56672106 -0.00000844 -0.00000006 0.00000038 Cu 6.34914156 8.97620596 21.56672515 -0.00000742 0.00000029 -0.00000096 Cu 5.08060693 7.18227154 22.83670432 -0.00000765 0.00000090 0.00000019 Cu 7.61761398 7.18227157 22.83670694 -0.00000691 0.00000040 -0.00000221 Cu 6.34907301 8.97620703 24.10462601 -0.00000743 0.00000034 -0.00000126 Cu 8.88608002 8.97620700 24.10462640 -0.00000525 0.00000048 -0.00000136 Cu 7.61753301 7.18227291 25.37336871 -0.00000521 -0.00000033 -0.00000065 Cu 10.15454022 7.18227287 25.37336710 -0.00000580 0.00000008 -0.00000155 Cu 8.88598816 8.97620851 26.64177377 -0.00000472 0.00000051 -0.00000091 Cu 11.42299529 8.97620846 26.64177061 -0.00000435 0.00000100 0.00000008 Cu 10.15443915 7.18227454 27.91031583 -0.00000445 0.00000037 0.00000004 Cu 12.69144612 7.18227457 27.91031227 -0.00000290 -0.00000000 -0.00000001 Cu 11.42288678 8.97621035 29.17880110 -0.00000286 0.00000080 -0.00000030 Cu 13.95989373 8.97621037 29.17879804 -0.00000217 0.00000042 0.00000096 Cu 12.69133206 7.18227660 30.44730953 -0.00000130 -0.00000049 0.00000085 Cu 15.22833900 7.18227666 30.44730800 -0.00000189 -0.00000111 -0.00000025 Cu 13.95977602 8.97621243 31.71580921 -0.00000172 0.00000138 0.00000060 Cu 1.27474066 8.97621244 31.71580923 0.00000061 0.00000130 0.00000141 Cu 15.22821925 7.18227884 32.98431354 0.00000016 -0.00000098 0.00000243 Cu 2.54318400 7.18227880 32.98431531 0.00000055 -0.00000023 -0.00000063 Cu 1.27462085 8.97621473 34.25281730 0.00000001 0.00000069 0.00000019 Cu 3.81162754 8.97621477 34.25281973 0.00000242 0.00000014 0.00000014 Cu 2.54306538 7.18228110 35.52132232 0.00000244 -0.00000095 0.00000131 Cu 5.08007237 7.18228110 35.52132502 0.00000156 -0.00000100 -0.00000196 Cu 3.81151195 8.97621695 36.78982677 0.00000144 0.00000077 -0.00000047 Cu 6.34851881 8.97621693 36.78982854 0.00000387 0.00000094 -0.00000027 Cu 5.07996079 7.18228329 38.05833242 0.00000348 -0.00000130 0.00000067 Cu 7.61696791 7.18228322 38.05833315 0.00000324 -0.00000054 -0.00000101 Cu 6.34841281 8.97621905 39.32683373 0.00000382 0.00000020 -0.00000057 Cu 8.88541994 8.97621902 39.32683310 0.00000428 0.00000035 -0.00000035 Cu 7.61686842 7.18228519 40.59534375 0.00000408 -0.00000087 -0.00000075 Cu 10.15387554 7.18228520 40.59534219 0.00000468 -0.00000125 -0.00000038 Cu 8.88532798 8.97622082 41.86383003 0.00000521 0.00000059 -0.00000016 Cu 11.42233517 8.97622081 41.86382813 0.00000442 0.00000059 0.00000025 Cu 10.15379201 7.18228681 43.13237251 0.00000484 -0.00000050 0.00000003 Cu 12.69079906 7.18228685 43.13237084 0.00000526 -0.00000107 0.00000090 Cu 11.42226066 8.97622235 44.40077708 0.00000511 -0.00000018 0.00000010 Cu 13.95926765 8.97622235 44.40077623 0.00000566 -0.00000016 0.00000063 Cu 12.69073411 7.18228815 45.66951862 0.00000555 -0.00000112 -0.00000029 Cu 15.22774109 7.18228812 45.66951876 0.00000540 -0.00000072 0.00000018 Cu 13.95921260 8.97622340 46.93743848 0.00000616 0.00000049 0.00000016 Cu 1.27417760 8.97622340 46.93743952 0.00000480 0.00000043 0.00000070 Cu 15.22769603 7.18228901 48.20741990 0.00000589 -0.00000076 0.00000027 Cu 2.54266098 7.18228902 48.20742154 0.00000526 -0.00000088 0.00000012 Cu 1.27414271 8.97622411 49.47255249 0.00000532 -0.00000002 -0.00000069 Cu 3.81114965 8.97622413 49.47255413 0.00000577 -0.00000021 -0.00000025 Cu 2.54263592 7.18228949 50.74541546 0.00000577 -0.00000069 -0.00000027 Cu 5.07964301 7.18228948 50.74541671 0.00000508 -0.00000047 -0.00000043 Cu 3.81113471 8.97622438 51.97071474 0.00000553 -0.00000024 -0.00000050 Cu 6.34814216 8.97622438 51.97071511 0.00000526 -0.00000031 0.00000004 Cu 5.08068676 0.00653090 17.80343093 -0.00000934 0.00000050 0.00000000 Cu 7.61769282 0.00653093 17.80343369 -0.00000906 0.00000036 -0.00000175 Cu 6.34918193 1.80046592 19.02873156 -0.00000980 0.00000028 -0.00000140 Cu 8.88618863 1.80046591 19.02873214 -0.00000785 0.00000060 -0.00000144 Cu 7.61766870 0.00653128 20.30159432 -0.00000828 0.00000046 -0.00000089 Cu 10.15467577 0.00653132 20.30159263 -0.00000841 -0.00000013 -0.00000177 Cu 8.88614880 1.80046649 21.56672567 -0.00000919 0.00000065 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0.00000352 0.00000072 -0.00000027 Cu 13.95943410 1.80047954 39.32682962 0.00000415 0.00000095 0.00000026 Cu 12.69088264 0.00654574 40.59534024 0.00000448 -0.00000085 0.00000120 Cu 15.22788961 0.00654580 40.59533999 0.00000407 -0.00000160 0.00000026 Cu 13.95934224 1.80048141 41.86382703 0.00000366 0.00000018 0.00000038 Cu 1.27430693 1.80048140 41.86382778 0.00000590 0.00000042 0.00000085 Cu 15.22780600 0.00654743 43.13237084 0.00000551 -0.00000127 0.00000028 Cu 2.54277088 0.00654740 43.13237247 0.00000479 -0.00000069 -0.00000096 Cu 1.27423253 1.80048288 44.40077725 0.00000548 0.00000038 -0.00000046 Cu 3.81123943 1.80048288 44.40077898 0.00000537 0.00000048 -0.00000002 Cu 2.54270593 0.00654867 45.66952034 0.00000587 -0.00000044 0.00000028 Cu 5.07971291 0.00654873 45.66952178 0.00000526 -0.00000114 -0.00000016 Cu 3.81118448 1.80048400 46.93744134 0.00000524 0.00000002 -0.00000096 Cu 6.34819143 1.80048400 46.93744191 0.00000588 -0.00000003 -0.00000026 Cu 5.07966788 0.00654963 48.20742292 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