360 Lattice="12.2481375106 0.0 0.0 0.0 12.2481375106 0.0 0.0 0.0 40.8271250352" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-1366.08683021 pbc="T T F" Au -0.00091507 0.00629375 -0.10232601 79 0.00000577 0.00000645 -0.00000064 Au 2.04044324 0.00629606 2.02909468 79 0.00000603 0.00000670 0.00000005 Au -0.00091309 2.04765229 2.02909470 79 0.00000633 0.00000574 -0.00000046 Au 2.04044102 2.04765015 -0.10232601 79 0.00000605 0.00000627 -0.00000066 Au -0.00090954 0.00629967 4.08479029 79 0.00000467 0.00000599 -0.00000144 Au 2.04045150 0.00630478 6.12861405 79 0.00000617 0.00000464 0.00000081 Au -0.00090466 2.04766103 6.12861403 79 0.00000267 0.00000422 0.00000134 Au 2.04044661 2.04765596 4.08479033 79 0.00000693 0.00000562 -0.00000251 Au -0.00089847 0.00631121 8.17039975 79 0.00000331 0.00000573 -0.00000235 Au 2.04046511 0.00631898 10.21183038 79 0.00000573 0.00000333 0.00000108 Au -0.00089103 2.04767520 10.21183041 79 0.00000207 0.00000439 0.00000018 Au 2.04045773 2.04766750 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0.00000050 Au -0.00078169 2.04779022 38.89821841 79 -0.00000660 -0.00000656 0.00000081 Au 2.04057197 2.04778798 36.76679772 79 -0.00000538 -0.00000680 0.00000074 Au -0.00091558 4.08900605 -0.10232603 79 0.00000629 0.00000655 -0.00000072 Au 2.04044311 4.08900860 2.02909468 79 0.00000637 0.00000564 0.00000003 Au -0.00091318 6.13036475 2.02909468 79 0.00000500 0.00000594 0.00000026 Au 2.04044067 6.13036228 -0.10232600 79 0.00000668 0.00000671 -0.00000090 Au -0.00090963 4.08901210 4.08479030 79 0.00000478 0.00000711 -0.00000152 Au 2.04045145 4.08901723 6.12861407 79 0.00000684 0.00000637 0.00000042 Au -0.00090475 6.13037351 6.12861409 79 0.00000477 0.00000520 -0.00000060 Au 2.04044659 6.13036841 4.08479026 79 0.00000576 0.00000523 -0.00000050 Au -0.00089848 4.08902375 8.17039970 79 0.00000332 0.00000427 -0.00000069 Au 2.04046516 4.08903147 10.21183039 79 0.00000421 0.00000400 0.00000062 Au -0.00089104 6.13038778 10.21183038 79 0.00000214 0.00000219 0.00000104 Au 2.04045768 6.13038001 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0.00000109 Au 6.12325432 8.17182429 26.54269342 79 -0.00000054 -0.00000354 0.00000123 Au 4.08189821 10.21318052 26.54269350 79 -0.00000544 -0.00000291 -0.00000141 Au 6.12324524 10.21317077 24.50133564 79 -0.00000194 -0.00000072 -0.00000097 Au 4.08190653 8.17183318 28.58406211 79 -0.00000529 -0.00000338 0.00000146 Au 6.12327004 8.17184106 30.62549287 79 -0.00000282 -0.00000364 -0.00000037 Au 4.08191387 10.21319737 30.62549285 79 -0.00000566 -0.00000568 0.00000027 Au 6.12326266 10.21318948 28.58406213 79 -0.00000110 -0.00000491 0.00000117 Au 4.08192004 8.17184769 32.66727836 79 -0.00000657 -0.00000403 0.00000199 Au 6.12328111 8.17185292 34.71110218 79 -0.00000584 -0.00000482 0.00000091 Au 4.08192484 10.21320924 34.71110221 79 -0.00000594 -0.00000761 -0.00000001 Au 6.12327620 10.21320401 32.66727839 79 -0.00000407 -0.00000543 0.00000102 Au 4.08192833 8.17185663 36.76679774 79 -0.00000606 -0.00000584 0.00000027 Au 6.12328705 8.17185897 38.89821845 79 -0.00000616 -0.00000644 0.00000052 Au 4.08193069 10.21321511 38.89821842 79 -0.00000645 -0.00000631 0.00000066 Au 6.12328449 10.21321301 36.76679772 79 -0.00000563 -0.00000718 0.00000073 Au 8.16450944 0.00629353 -0.10232600 79 0.00000628 0.00000664 -0.00000074 Au 10.20586818 0.00629602 2.02909470 79 0.00000643 0.00000602 -0.00000044 Au 8.16451188 2.04765218 2.02909470 79 0.00000519 0.00000626 -0.00000029 Au 10.20586581 2.04764965 -0.10232601 79 0.00000640 0.00000660 -0.00000086 Au 8.16451537 0.00629963 4.08479027 79 0.00000495 0.00000614 -0.00000099 Au 10.20587648 0.00630469 6.12861407 79 0.00000642 0.00000687 -0.00000007 Au 8.16452027 2.04766100 6.12861407 79 0.00000476 0.00000491 -0.00000007 Au 10.20587162 2.04765588 4.08479024 79 0.00000582 0.00000533 -0.00000005 Au 8.16452655 0.00631122 8.17039971 79 0.00000254 0.00000511 -0.00000108 Au 10.20589015 0.00631895 10.21183038 79 0.00000458 0.00000420 0.00000115 Au 8.16453398 2.04767524 10.21183039 79 0.00000205 0.00000296 0.00000080 Au 10.20588268 2.04766751 8.17039975 79 0.00000649 0.00000387 -0.00000233 Au 8.16454239 0.00632774 12.25319922 79 0.00000194 0.00000250 -0.00000152 Au 10.20590779 0.00633728 14.29455703 79 0.00000344 0.00000278 0.00000083 Au 8.16455159 2.04769354 14.29455702 79 0.00000160 0.00000280 0.00000109 Au 10.20589859 2.04768398 12.25319922 79 0.00000363 0.00000309 -0.00000168 Au 8.16456141 0.00634748 16.33591303 79 -0.00000049 0.00000109 -0.00000115 Au 10.20592771 0.00635806 18.37726853 79 0.00000092 -0.00000095 0.00000147 Au 8.16457153 2.04771425 18.37726854 79 -0.00000173 0.00000074 0.00000142 Au 10.20591756 2.04770375 16.33591307 79 0.00000310 0.00000076 -0.00000242 Au 8.16458167 0.00636870 20.41862415 79 -0.00000035 -0.00000094 -0.00000147 Au 10.20594797 0.00637926 22.45997967 79 -0.00000001 -0.00000082 0.00000043 Au 8.16459175 2.04773548 22.45997966 79 -0.00000112 0.00000010 0.00000059 Au 10.20593796 2.04772492 20.41862410 79 -0.00000117 0.00000029 0.00000020 Au 8.16460153 0.00638954 24.50133562 79 -0.00000353 -0.00000177 -0.00000032 Au 10.20596687 0.00639927 26.54269342 79 -0.00000201 -0.00000306 0.00000084 Au 8.16461068 2.04775552 26.54269344 79 -0.00000449 -0.00000327 0.00000054 Au 10.20595769 2.04774581 24.50133563 79 -0.00000040 -0.00000237 -0.00000073 Au 8.16461902 0.00640820 28.58406216 79 -0.00000473 -0.00000402 0.00000013 Au 10.20598253 0.00641607 30.62549285 79 -0.00000285 -0.00000380 0.00000040 Au 8.16462635 2.04777234 30.62549283 79 -0.00000504 -0.00000469 0.00000063 Au 10.20597521 2.04776442 28.58406215 79 -0.00000265 -0.00000335 0.00000038 Au 8.16463251 0.00642276 32.66727840 79 -0.00000665 -0.00000513 0.00000089 Au 10.20599353 0.00642801 34.71110218 79 -0.00000516 -0.00000620 0.00000120 Au 8.16463731 2.04778426 34.71110217 79 -0.00000688 -0.00000676 0.00000136 Au 10.20598869 2.04777899 32.66727844 79 -0.00000323 -0.00000554 -0.00000031 Au 8.16464061 0.00643185 36.76679774 79 -0.00000564 -0.00000600 0.00000023 Au 10.20599923 0.00643430 38.89821844 79 -0.00000603 -0.00000667 0.00000058 Au 8.16464285 2.04779043 38.89821844 79 -0.00000595 -0.00000671 0.00000058 Au 10.20599709 2.04778791 36.76679771 79 -0.00000621 -0.00000673 0.00000112 Au 8.16450973 4.08900604 -0.10232601 79 0.00000598 0.00000667 -0.00000065 Au 10.20586810 4.08900840 2.02909469 79 0.00000622 0.00000733 -0.00000017 Au 8.16451199 6.13036485 2.02909471 79 0.00000583 0.00000567 -0.00000047 Au 10.20586582 6.13036245 -0.10232601 79 0.00000630 0.00000636 -0.00000061 Au 8.16451541 4.08901215 4.08479028 79 0.00000506 0.00000575 -0.00000131 Au 10.20587648 4.08901727 6.12861407 79 0.00000593 0.00000450 0.00000000 Au 8.16452036 6.13037354 6.12861404 79 0.00000277 0.00000475 0.00000080 Au 10.20587157 6.13036844 4.08479031 79 0.00000724 0.00000514 -0.00000217 Au 8.16452657 4.08902371 8.17039974 79 0.00000239 0.00000549 -0.00000196 Au 10.20589010 4.08903145 10.21183037 79 0.00000632 0.00000436 0.00000140 Au 8.16453400 6.13038771 10.21183043 79 0.00000173 0.00000424 -0.00000032 Au 10.20588273 6.13038000 8.17039969 79 0.00000522 0.00000476 -0.00000067 Au 8.16454238 4.08904023 12.25319918 79 0.00000241 0.00000293 -0.00000065 Au 10.20590783 4.08904980 14.29455706 79 0.00000228 0.00000217 -0.00000042 Au 8.16455162 6.13040607 14.29455703 79 0.00000079 0.00000176 0.00000075 Au 10.20589855 6.13039654 12.25319919 79 0.00000499 0.00000111 -0.00000074 Au 8.16456143 4.08905997 16.33591304 79 -0.00000125 0.00000138 -0.00000154 Au 10.20592766 4.08907047 18.37726852 79 0.00000229 0.00000173 0.00000202 Au 8.16457148 6.13042673 18.37726861 79 -0.00000031 0.00000155 -0.00000059 Au 10.20591760 6.13041617 16.33591301 79 0.00000158 0.00000295 -0.00000034 Au 8.16458168 4.08908124 20.41862412 79 -0.00000049 -0.00000207 -0.00000024 Au 10.20594802 4.08909181 22.45997968 79 -0.00000137 -0.00000211 -0.00000015 Au 8.16459182 6.13044802 22.45997962 79 -0.00000306 -0.00000089 0.00000166 Au 10.20593784 6.13043748 20.41862415 79 0.00000252 -0.00000165 -0.00000150 Au 8.16460156 4.08910206 24.50133564 79 -0.00000441 -0.00000225 -0.00000111 Au 10.20596681 4.08911178 26.54269339 79 -0.00000037 -0.00000310 0.00000202 Au 8.16461071 6.13046799 26.54269343 79 -0.00000510 -0.00000196 0.00000060 Au 10.20595771 6.13045825 24.50133562 79 -0.00000113 -0.00000021 -0.00000058 Au 8.16461901 4.08912069 28.58406215 79 -0.00000430 -0.00000363 0.00000055 Au 10.20598257 4.08912859 30.62549285 79 -0.00000373 -0.00000473 0.00000013 Au 8.16462640 6.13048487 30.62549280 79 -0.00000638 -0.00000571 0.00000169 Au 10.20597516 6.13047699 28.58406217 79 -0.00000117 -0.00000520 -0.00000014 Au 8.16463253 4.08913518 32.66727842 79 -0.00000633 -0.00000387 0.00000002 Au 10.20599355 4.08914039 34.71110220 79 -0.00000449 -0.00000469 0.00000061 Au 8.16463733 6.13049670 34.71110221 79 -0.00000575 -0.00000670 0.00000022 Au 10.20598871 6.13049148 32.66727839 79 -0.00000458 -0.00000516 0.00000106 Au 8.16464079 4.08914409 36.76679773 79 -0.00000642 -0.00000628 0.00000060 Au 10.20599943 4.08914635 38.89821843 79 -0.00000619 -0.00000646 0.00000070 Au 8.16464318 6.13050258 38.89821843 79 -0.00000654 -0.00000629 0.00000070 Au 10.20599692 6.13050043 36.76679774 79 -0.00000521 -0.00000660 0.00000041 Au 8.16450978 8.17171891 -0.10232600 79 0.00000601 0.00000630 -0.00000082 Au 10.20586818 8.17172115 2.02909469 79 0.00000651 0.00000605 -0.00000028 Au 8.16451189 10.21307734 2.02909469 79 0.00000554 0.00000612 -0.00000022 Au 10.20586604 10.21307514 -0.10232601 79 0.00000620 0.00000630 -0.00000067 Au 8.16451545 8.17172468 4.08479026 79 0.00000407 0.00000653 -0.00000085 Au 10.20587648 8.17172974 6.12861404 79 0.00000669 0.00000642 0.00000065 Au 8.16452030 10.21308604 6.12861408 79 0.00000376 0.00000462 -0.00000043 Au 10.20587165 10.21308097 4.08479027 79 0.00000612 0.00000532 -0.00000111 Au 8.16452653 8.17173627 8.17039969 79 0.00000371 0.00000429 -0.00000062 Au 10.20589015 8.17174395 10.21183045 79 0.00000483 0.00000482 -0.00000108 Au 8.16453396 10.21310024 10.21183040 79 0.00000253 0.00000338 0.00000053 Au 10.20588271 10.21309257 8.17039970 79 0.00000596 0.00000265 -0.00000103 Au 8.16454246 8.17175272 12.25319921 79 -0.00000026 0.00000348 -0.00000137 Au 10.20590776 8.17176231 14.29455701 79 0.00000443 0.00000208 0.00000157 Au 8.16455165 10.21311854 14.29455707 79 -0.00000031 0.00000289 -0.00000031 Au 10.20589856 10.21310898 12.25319922 79 0.00000453 0.00000338 -0.00000156 Au 8.16456135 8.17177252 16.33591301 79 0.00000146 -0.00000012 -0.00000032 Au 10.20592769 8.17178303 18.37726862 79 0.00000131 -0.00000013 -0.00000108 Au 8.16457149 10.21313924 18.37726854 79 -0.00000038 0.00000138 0.00000136 Au 10.20591756 10.21312875 16.33591302 79 0.00000294 0.00000060 -0.00000063 Au 8.16458179 8.17179368 20.41862412 79 -0.00000417 -0.00000009 -0.00000064 Au 10.20594794 8.17180430 22.45997959 79 0.00000090 -0.00000167 0.00000246 Au 8.16459182 10.21316053 22.45997966 79 -0.00000324 -0.00000099 0.00000051 Au 10.20593788 10.21314989 20.41862414 79 0.00000101 0.00000160 -0.00000118 Au 8.16460150 8.17181459 24.50133560 79 -0.00000238 -0.00000298 -0.00000009 Au 10.20596686 8.17182426 26.54269346 79 -0.00000216 -0.00000252 -0.00000019 Au 8.16461066 10.21318054 26.54269340 79 -0.00000350 -0.00000351 0.00000176 Au 10.20595770 10.21317083 24.50133560 79 -0.00000077 -0.00000281 -0.00000005 Au 8.16461908 8.17183316 28.58406220 79 -0.00000656 -0.00000262 -0.00000099 Au 10.20598250 8.17184108 30.62549280 79 -0.00000215 -0.00000403 0.00000178 Au 8.16462638 10.21319736 30.62549285 79 -0.00000614 -0.00000489 0.00000029 Au 10.20597521 10.21318944 28.58406218 79 -0.00000269 -0.00000339 -0.00000025 Au 8.16463249 8.17184775 32.66727842 79 -0.00000538 -0.00000524 0.00000020 Au 10.20599345 8.17185302 34.71110221 79 -0.00000436 -0.00000590 0.00000014 Au 8.16463728 10.21320928 34.71110220 79 -0.00000621 -0.00000561 0.00000054 Au 10.20598868 10.21320406 32.66727841 79 -0.00000387 -0.00000645 0.00000058 Au 8.16464076 8.17185672 36.76679771 79 -0.00000646 -0.00000615 0.00000120 Au 10.20599889 8.17185936 38.89821843 79 -0.00000578 -0.00000681 0.00000069 Au 8.16464278 10.21321576 38.89821843 79 -0.00000606 -0.00000725 0.00000072 Au 10.20599684 10.21321311 36.76679773 79 -0.00000524 -0.00000632 0.00000056