360 Lattice="12.210331441462046 0.0 0.0 0.0 12.210331441462046 0.0 0.0 0.0 81.40220960974695" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1388.5883814316196 stress="0.0034035980816886635 2.859917135256014e-10 1.4068553939974854e-06 2.859917135256014e-10 0.00340359807905766 1.5023734268920074e-06 1.4068553939974854e-06 1.5023734268920074e-06 -1.6643448861802776e-08" pbc="T T F" Au -0.00104646 0.00615197 20.56943957 0.00000388 0.00000393 -0.00000222 Au 2.03401130 0.00615438 22.43974661 0.00000456 0.00000367 0.00000355 Au -0.00104388 2.04120963 22.43974653 0.00000352 0.00000412 0.00000294 Au 2.03400874 2.04120722 20.56943959 0.00000412 0.00000377 -0.00000259 Au -0.00103797 0.00615990 24.40715719 0.00000447 0.00000425 -0.00000239 Au 2.03402913 0.00617104 26.45772273 0.00000538 0.00000589 0.00000100 Au -0.00102612 2.04122632 26.45772281 0.00000530 0.00000569 0.00000107 Au 2.03401724 2.04121516 24.40715719 0.00000523 0.00000444 -0.00000181 Au -0.00101077 0.00618620 28.49711716 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Au -0.00076178 4.07657133 44.77629070 -0.00000412 -0.00000533 0.00000015 Au 2.03432310 4.07660369 46.81142479 -0.00000510 -0.00000645 -0.00000023 Au -0.00073216 6.11165890 46.81142481 -0.00000508 -0.00000644 -0.00000025 Au 2.03429347 6.11162654 44.77629069 -0.00000413 -0.00000531 0.00000016 Au -0.00070686 4.07663057 48.84617701 -0.00000553 -0.00000680 0.00000052 Au 2.03436883 4.07665148 50.88016098 -0.00000557 -0.00000639 -0.00000085 Au -0.00068641 6.11170672 50.88016121 -0.00000556 -0.00000650 -0.00000097 Au 2.03434840 6.11168578 48.84617700 -0.00000554 -0.00000682 0.00000053 Au -0.00067101 4.07666654 52.91955517 -0.00000529 -0.00000549 0.00000183 Au 2.03439613 4.07667771 54.97012144 -0.00000435 -0.00000476 -0.00000393 Au -0.00065905 6.11173302 54.97012139 -0.00000514 -0.00000474 -0.00000393 Au 2.03438424 6.11172183 52.91955518 -0.00000532 -0.00000571 0.00000178 Au -0.00065306 4.07668325 56.93753083 -0.00000511 -0.00000379 0.00000708 Au 2.03440464 4.07668572 58.80783918 -0.00000426 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0.00000461 0.00000369 -0.00000196 Au 8.13918311 0.00615986 24.40715712 0.00000438 0.00000503 -0.00000207 Au 10.17425011 0.00617108 26.45772276 0.00000528 0.00000567 0.00000101 Au 8.13919492 2.04122634 26.45772282 0.00000518 0.00000564 0.00000090 Au 10.17423825 2.04121518 24.40715717 0.00000467 0.00000450 -0.00000241 Au 8.13921024 0.00618622 28.49711718 0.00000551 0.00000645 -0.00000061 Au 10.17428584 0.00620717 30.53110112 0.00000563 0.00000679 0.00000022 Au 8.13923060 2.04126240 30.53110116 0.00000556 0.00000680 0.00000019 Au 10.17426545 2.04124146 28.49711726 0.00000563 0.00000646 -0.00000065 Au 8.13925590 0.00623408 32.56585342 0.00000512 0.00000643 -0.00000021 Au 10.17434080 0.00626644 34.60098746 0.00000415 0.00000531 0.00000003 Au 8.13928554 2.04132169 34.60098744 0.00000415 0.00000530 0.00000004 Au 10.17431115 2.04128932 32.56585342 0.00000514 0.00000642 -0.00000021 Au 8.13931873 0.00630333 36.63606317 0.00000270 0.00000350 -0.00000006 Au 10.17440948 0.00634322 38.67111292 0.00000093 0.00000121 0.00000000 Au 8.13935421 2.04139845 38.67111289 0.00000095 0.00000121 0.00000003 Au 10.17437398 2.04135858 36.63606312 0.00000270 0.00000349 -0.00000002 Au 8.13939053 0.00638414 40.70616521 -0.00000095 -0.00000125 0.00000004 Au 10.17448128 0.00642400 42.74121498 -0.00000271 -0.00000354 -0.00000004 Au 8.13942604 2.04147923 42.74121500 -0.00000272 -0.00000353 -0.00000005 Au 10.17444577 2.04143937 40.70616517 -0.00000094 -0.00000125 0.00000007 Au 8.13945925 0.00646081 44.77629069 -0.00000418 -0.00000530 0.00000016 Au 10.17454411 0.00649310 46.81142478 -0.00000513 -0.00000636 -0.00000023 Au 8.13948891 2.04154840 46.81142479 -0.00000515 -0.00000642 -0.00000024 Au 10.17451445 2.04151609 44.77629070 -0.00000415 -0.00000534 0.00000016 Au 8.13951421 0.00651996 48.84617694 -0.00000563 -0.00000670 0.00000057 Au 10.17458980 0.00654097 50.88016104 -0.00000557 -0.00000635 -0.00000083 Au 8.13953455 2.04159621 50.88016098 -0.00000556 -0.00000647 -0.00000076 Au 10.17456939 2.04157528 48.84617698 -0.00000555 -0.00000678 0.00000054 Au 8.13954982 0.00655618 52.91955510 -0.00000512 -0.00000552 0.00000184 Au 10.17461698 0.00656753 54.97012144 -0.00000443 -0.00000513 -0.00000407 Au 8.13956166 2.04162256 54.97012143 -0.00000506 -0.00000485 -0.00000386 Au 10.17460513 2.04161137 52.91955514 -0.00000525 -0.00000582 0.00000171 Au 8.13956767 0.00657294 56.93753095 -0.00000460 -0.00000353 0.00000713 Au 10.17462559 0.00657520 58.80783912 -0.00000416 -0.00000318 -0.00000394 Au 8.13957035 2.04163052 58.80783927 -0.00000396 -0.00000389 -0.00000469 Au 10.17462299 2.04162808 56.93753084 -0.00000436 -0.00000385 0.00000791 Au 8.13917442 4.07626248 20.56943939 0.00000413 0.00000374 -0.00000293 Au 10.17423219 4.07626487 22.43974635 0.00000534 0.00000383 0.00000357 Au 8.13917708 6.11131995 22.43974631 0.00000407 0.00000485 0.00000390 Au 10.17422969 6.11131771 20.56943935 0.00000429 0.00000361 -0.00000232 Au 8.13918311 4.07627038 24.40715714 0.00000412 0.00000451 -0.00000206 Au 10.17425011 4.07628155 26.45772288 0.00000531 0.00000573 0.00000095 Au 8.13919492 6.11133675 26.45772286 0.00000509 0.00000561 0.00000092 Au 10.17423824 6.11132550 24.40715715 0.00000489 0.00000485 -0.00000220 Au 8.13921022 4.07629669 28.49711731 0.00000554 0.00000649 -0.00000068 Au 10.17428585 4.07631767 30.53110119 0.00000560 0.00000678 0.00000018 Au 8.13923059 6.11137293 30.53110118 0.00000558 0.00000677 0.00000019 Au 10.17426545 6.11135194 28.49711730 0.00000562 0.00000644 -0.00000067 Au 8.13925588 4.07634457 32.56585342 0.00000514 0.00000642 -0.00000021 Au 10.17434080 4.07637695 34.60098743 0.00000414 0.00000529 0.00000005 Au 8.13928552 6.11143220 34.60098744 0.00000416 0.00000529 0.00000004 Au 10.17431115 6.11139985 32.56585342 0.00000514 0.00000639 -0.00000020 Au 8.13931870 4.07641382 36.63606311 0.00000273 0.00000349 -0.00000002 Au 10.17440947 4.07645368 38.67111286 0.00000095 0.00000122 0.00000004 Au 8.13935420 6.11150892 38.67111289 0.00000097 0.00000122 0.00000001 Au 10.17437397 6.11146906 36.63606314 0.00000271 0.00000350 -0.00000004 Au 8.13939052 4.07649458 40.70616517 -0.00000093 -0.00000122 0.00000007 Au 10.17448126 4.07653445 42.74121495 -0.00000270 -0.00000351 -0.00000002 Au 8.13942604 6.11158967 42.74121494 -0.00000271 -0.00000350 -0.00000001 Au 10.17444577 6.11154981 40.70616515 -0.00000093 -0.00000122 0.00000008 Au 8.13945924 4.07657132 44.77629069 -0.00000417 -0.00000531 0.00000017 Au 10.17454408 4.07660369 46.81142482 -0.00000510 -0.00000645 -0.00000025 Au 8.13948891 6.11165891 46.81142481 -0.00000516 -0.00000646 -0.00000023 Au 10.17451444 6.11162654 44.77629065 -0.00000414 -0.00000531 0.00000019 Au 8.13951420 4.07663056 48.84617702 -0.00000562 -0.00000676 0.00000051 Au 10.17458978 4.07665147 50.88016115 -0.00000555 -0.00000642 -0.00000093 Au 8.13953456 6.11170674 50.88016123 -0.00000560 -0.00000652 -0.00000104 Au 10.17456939 6.11168579 48.84617712 -0.00000557 -0.00000679 0.00000044 Au 8.13954983 4.07666654 52.91955518 -0.00000521 -0.00000559 0.00000176 Au 10.17461698 4.07667764 54.97012138 -0.00000455 -0.00000387 -0.00000360 Au 8.13956162 6.11173300 54.97012135 -0.00000458 -0.00000441 -0.00000375 Au 10.17460513 6.11172185 52.91955532 -0.00000516 -0.00000582 0.00000181 Au 8.13956761 4.07668327 56.93753080 -0.00000382 -0.00000406 0.00000721 Au 10.17462557 4.07668578 58.80783901 -0.00000408 -0.00000388 -0.00000462 Au 8.13957036 6.11174103 58.80783878 -0.00000415 -0.00000423 -0.00000312 Au 10.17462296 6.11173864 56.93753062 -0.00000408 -0.00000497 0.00000656 Au 8.13917447 8.14637293 20.56943935 0.00000379 0.00000383 -0.00000145 Au 10.17423233 8.14637521 22.43974636 0.00000372 0.00000406 0.00000403 Au 8.13917713 10.18143055 22.43974647 0.00000379 0.00000334 0.00000330 Au 10.17422971 10.18142819 20.56943952 0.00000407 0.00000370 -0.00000264 Au 8.13918307 8.14638071 24.40715717 0.00000470 0.00000465 -0.00000268 Au 10.17425010 8.14639196 26.45772281 0.00000544 0.00000576 0.00000092 Au 8.13919494 10.18144722 26.45772273 0.00000504 0.00000581 0.00000111 Au 10.17423821 10.18143600 24.40715713 0.00000524 0.00000457 -0.00000216 Au 8.13921024 8.14640718 28.49711722 0.00000550 0.00000647 -0.00000057 Au 10.17428584 8.14642818 30.53110114 0.00000561 0.00000676 0.00000022 Au 8.13923061 10.18148341 30.53110111 0.00000558 0.00000675 0.00000024 Au 10.17426545 10.18146242 28.49711717 0.00000561 0.00000646 -0.00000057 Au 8.13925589 8.14645509 32.56585342 0.00000512 0.00000640 -0.00000021 Au 10.17434079 8.14648742 34.60098747 0.00000416 0.00000530 0.00000002 Au 8.13928555 10.18154266 34.60098748 0.00000414 0.00000530 0.00000001 Au 10.17431114 10.18151030 32.56585341 0.00000514 0.00000642 -0.00000020 Au 8.13931871 8.14652430 36.63606318 0.00000272 0.00000349 -0.00000007 Au 10.17440947 8.14656416 38.67111292 0.00000094 0.00000122 -0.00000001 Au 8.13935422 10.18161942 38.67111295 0.00000095 0.00000121 -0.00000003 Au 10.17437398 10.18157953 36.63606319 0.00000270 0.00000350 -0.00000008 Au 8.13939052 8.14660507 40.70616519 -0.00000093 -0.00000123 0.00000004 Au 10.17448127 8.14664491 42.74121492 -0.00000271 -0.00000350 0.00000001 Au 8.13942605 10.18170019 42.74121497 -0.00000272 -0.00000353 -0.00000003 Au 10.17444578 10.18166034 40.70616519 -0.00000095 -0.00000125 0.00000004 Au 8.13945925 8.14668176 44.77629063 -0.00000418 -0.00000529 0.00000020 Au 10.17454410 8.14671408 46.81142480 -0.00000512 -0.00000638 -0.00000022 Au 8.13948892 10.18176928 46.81142477 -0.00000518 -0.00000637 -0.00000020 Au 10.17451446 10.18173699 44.77629064 -0.00000416 -0.00000529 0.00000020 Au 8.13951421 8.14674097 48.84617708 -0.00000561 -0.00000672 0.00000049 Au 10.17458980 8.14676196 50.88016129 -0.00000555 -0.00000642 -0.00000114 Au 8.13953456 10.18181718 50.88016112 -0.00000560 -0.00000645 -0.00000098 Au 10.17456941 10.18179616 48.84617704 -0.00000559 -0.00000675 0.00000051 Au 8.13954984 8.14677717 52.91955527 -0.00000528 -0.00000568 0.00000195 Au 10.17461702 8.14678841 54.97012134 -0.00000494 -0.00000433 -0.00000366 Au 8.13956160 10.18184383 54.97012138 -0.00000436 -0.00000555 -0.00000360 Au 10.17460514 10.18183246 52.91955523 -0.00000518 -0.00000575 0.00000197 Au 8.13956767 8.14679389 56.93753074 -0.00000456 -0.00000356 0.00000572 Au 10.17462556 8.14679619 58.80783866 -0.00000389 -0.00000355 -0.00000277 Au 8.13957038 10.18185141 58.80783897 -0.00000440 -0.00000358 -0.00000353 Au 10.17462298 10.18184927 56.93753081 -0.00000422 -0.00000434 0.00000602