360 Lattice="12.151567004610001 0.0 0.0 0.0 12.151567004610001 0.0 0.0 0.0 40.5052233487" Properties=species:S:1:pos:R:3:forces:R:3 energy=-858.0398404856968 stress="44.31836953365963 1.0275433165899219e-07 0.00930480811607105 1.0275433165899219e-07 44.31836866711964 0.010542566898819347 0.00930480811607105 0.010542566898819347 -0.01535620263929062" pbc="T T F" Au -0.00405928 0.00314392 -0.32985299 0.00000331 0.00000412 -0.00000504 Au 1.99000853 0.01558332 1.83734239 0.00000316 0.00000381 -0.00000490 Au 0.00837951 1.99721235 1.83734231 0.00000311 0.00000376 -0.00000483 Au 1.97995821 1.98716145 -0.29081679 0.00000328 0.00000406 -0.00000499 Au 0.00250368 0.00970829 3.90216521 0.00000272 0.00000353 -0.00000463 Au 1.99642066 0.01933308 5.95539119 0.00000263 0.00000291 -0.00000417 Au 0.01212743 2.00362631 5.95539115 0.00000253 0.00000278 -0.00000424 Au 1.97929038 1.98649502 3.90597027 0.00000288 0.00000334 -0.00000456 Au 0.00595794 0.01316472 8.00171895 0.00000216 0.00000225 -0.00000370 Au 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Au 1.98526871 6.09660859 7.99829461 0.00000218 0.00000230 -0.00000386 Au 0.00717394 4.04429543 12.08874051 0.00000128 0.00000120 -0.00000256 Au 1.98494280 4.04255228 14.13362352 0.00000090 0.00000078 -0.00000179 Au 0.00705662 6.09475530 14.13344839 0.00000084 0.00000077 -0.00000188 Au 1.98524108 6.09628933 12.08888626 0.00000130 0.00000123 -0.00000261 Au 0.00703468 4.04417786 16.17812809 0.00000044 0.00000042 -0.00000103 Au 1.98484740 4.04249113 18.22276566 0.00000012 0.00000015 -0.00000023 Au 0.00704502 6.09485489 18.22274644 0.00000004 0.00000010 -0.00000030 Au 1.98484741 6.09649737 16.17821448 0.00000049 0.00000043 -0.00000108 Au 0.00705506 4.04417821 20.26733485 -0.00000035 -0.00000010 0.00000057 Au 1.98487718 4.04253571 22.31186625 -0.00000069 -0.00000043 0.00000138 Au 0.00706458 6.09485525 22.31195331 -0.00000073 -0.00000044 0.00000132 Au 1.98485739 6.09654198 20.26731494 -0.00000024 -0.00000018 0.00000054 Au 0.00710580 4.04427777 24.35663326 -0.00000114 -0.00000078 0.00000213 Au 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0.00000321 Au 4.03399351 8.14917211 32.53674516 -0.00000269 -0.00000282 0.00000425 Au 6.09223559 8.15463202 34.58148336 -0.00000311 -0.00000338 0.00000452 Au 4.03416857 10.12786032 34.58071224 -0.00000303 -0.00000326 0.00000468 Au 6.08884673 10.12550602 32.53404705 -0.00000264 -0.00000288 0.00000420 Au 4.03028582 8.15813114 36.63282707 -0.00000365 -0.00000382 0.00000485 Au 6.08771472 8.14673769 38.75570119 -0.00000425 -0.00000420 0.00000490 Au 4.03630258 10.12722513 38.77936102 -0.00000381 -0.00000375 0.00000502 Au 6.09094870 10.13140666 36.64212741 -0.00000341 -0.00000407 0.00000477 Au 8.12648007 0.02063247 -0.29914601 0.00000336 0.00000416 -0.00000518 Au 10.12655129 0.00513270 1.82650242 0.00000325 0.00000384 -0.00000497 Au 8.14750591 1.98417813 1.84844552 0.00000319 0.00000380 -0.00000500 Au 10.11104582 2.00519843 -0.29914667 0.00000337 0.00000413 -0.00000511 Au 8.13167615 0.01732597 3.90422134 0.00000296 0.00000335 -0.00000476 Au 10.11957651 0.01212628 5.95560313 0.00000272 0.00000291 -0.00000448 Au 8.14060757 1.99109547 5.95358478 0.00000264 0.00000280 -0.00000434 Au 10.11436589 2.00001585 3.90422084 0.00000306 0.00000329 -0.00000471 Au 8.12611398 0.02042280 8.00084157 0.00000217 0.00000241 -0.00000392 Au 10.11823669 0.01349578 10.04561646 0.00000205 0.00000182 -0.00000325 Au 8.13760797 1.99412470 10.04447535 0.00000189 0.00000159 -0.00000332 Au 10.11129356 2.00560263 8.00084113 0.00000227 0.00000222 -0.00000387 Au 8.12556616 0.02052647 12.08912004 0.00000138 0.00000124 -0.00000272 Au 10.11840162 0.01336799 14.13354259 0.00000144 0.00000099 -0.00000191 Au 8.13801234 1.99375737 14.13358435 0.00000105 0.00000061 -0.00000194 Au 10.11122385 2.00618430 12.08911947 0.00000164 0.00000096 -0.00000264 Au 8.12586977 0.02039729 16.17808884 0.00000052 0.00000049 -0.00000118 Au 10.11851146 0.01329899 18.22269965 0.00000072 0.00000047 -0.00000050 Au 8.13820327 1.99360722 18.22274142 0.00000026 -0.00000006 -0.00000034 Au 10.11139248 2.00592007 16.17808819 0.00000096 0.00000006 -0.00000113 Au 8.12593425 0.02040544 20.26736258 -0.00000040 0.00000015 0.00000044 Au 10.11850628 0.01334570 22.31203690 -0.00000020 -0.00000021 0.00000134 Au 8.13818334 1.99366861 22.31193058 -0.00000051 -0.00000062 0.00000120 Au 10.11142588 2.00589708 20.26736193 0.00000001 -0.00000037 0.00000041 Au 8.12579544 0.02049570 24.35657352 -0.00000101 -0.00000072 0.00000197 Au 10.11835531 0.01353610 26.40071854 -0.00000104 -0.00000108 0.00000277 Au 8.13783434 1.99405694 26.40108049 -0.00000134 -0.00000134 0.00000272 Au 10.11137650 2.00607667 24.35657291 -0.00000067 -0.00000106 0.00000200 Au 8.12560767 0.02065488 28.44511529 -0.00000179 -0.00000177 0.00000341 Au 10.11865096 0.01327450 30.48836322 -0.00000200 -0.00000215 0.00000381 Au 8.13834571 1.99357939 30.49042076 -0.00000216 -0.00000239 0.00000400 Au 10.11125460 2.00630150 28.44511480 -0.00000158 -0.00000196 0.00000344 Au 8.12818818 0.01945802 32.53469199 -0.00000272 -0.00000278 0.00000446 Au 10.12210559 0.00984508 34.58791844 -0.00000308 -0.00000357 0.00000490 Au 8.14531853 1.98663124 34.58411308 -0.00000289 -0.00000348 0.00000473 Au 10.11248165 2.00375067 32.53469163 -0.00000277 -0.00000287 0.00000438 Au 8.13460043 0.01573004 36.65274181 -0.00000315 -0.00000438 0.00000503 Au 10.12866985 0.00329690 38.81993748 -0.00000392 -0.00000477 0.00000512 Au 8.14465095 1.98731215 38.78090083 -0.00000328 -0.00000410 0.00000516 Au 10.11623079 1.99735763 36.65274165 -0.00000359 -0.00000394 0.00000495 Au 8.13938358 4.04409983 -0.26561313 0.00000335 0.00000409 -0.00000519 Au 10.12405669 4.04086453 1.84796049 0.00000322 0.00000383 -0.00000505 Au 8.15078231 6.10152817 1.85726139 0.00000319 0.00000382 -0.00000517 Au 10.11987137 6.09551093 -0.28927325 0.00000337 0.00000412 -0.00000530 Au 8.14729114 4.03957826 3.90860532 0.00000295 0.00000341 -0.00000482 Au 10.11817553 4.04296776 5.95604158 0.00000267 0.00000286 -0.00000442 Au 8.14184221 6.09782114 5.95334414 0.00000265 0.00000288 -0.00000455 Au 10.12051940 6.09764509 3.90937603 0.00000298 0.00000340 -0.00000491 Au 8.13924132 4.04231520 7.99829660 0.00000230 0.00000228 -0.00000396 Au 10.11716155 4.04430849 10.04424111 0.00000193 0.00000171 -0.00000339 Au 8.13891649 6.09621768 10.04375141 0.00000191 0.00000174 -0.00000347 Au 10.11727371 6.09493099 8.00015317 0.00000231 0.00000230 -0.00000407 Au 8.13930047 4.04267043 12.08888886 0.00000150 0.00000121 -0.00000271 Au 10.11750287 4.04422453 14.13345044 0.00000113 0.00000078 -0.00000199 Au 8.13961697 6.09642771 14.13363014 0.00000111 0.00000078 -0.00000207 Au 10.11736735 6.09466425 12.08874621 0.00000154 0.00000120 -0.00000280 Au 8.13973150 4.04250352 16.17821744 0.00000066 0.00000045 -0.00000123 Au 10.11755364 4.04416742 18.22274867 0.00000034 0.00000014 -0.00000039 Au 8.13975131 6.09653119 18.22277264 0.00000026 0.00000013 -0.00000047 Au 10.11754411 6.09482301 16.17813438 0.00000074 0.00000040 -0.00000127 Au 8.13976130 4.04250190 20.26731798 -0.00000011 -0.00000014 0.00000040 Au 10.11757403 4.04421008 22.31195549 -0.00000044 -0.00000040 0.00000119 Au 8.13976128 6.09652954 22.31187311 -0.00000052 -0.00000044 0.00000114 Au 10.11756368 6.09486567 20.26734124 -0.00000005 -0.00000014 0.00000035 Au 8.13966593 4.04260540 24.35646029 -0.00000089 -0.00000077 0.00000195 Au 10.11743480 4.04436883 26.40134338 -0.00000129 -0.00000118 0.00000268 Au 8.13936757 6.09636257 26.40120134 -0.00000131 -0.00000120 0.00000256 Au 10.11755205 6.09480853 24.35663932 -0.00000085 -0.00000078 0.00000191 Au 8.13900030 4.04281540 28.44633849 -0.00000176 -0.00000170 0.00000328 Au 10.11737288 4.04410204 30.48993581 -0.00000217 -0.00000227 0.00000389 Au 8.13933995 6.09671769 30.49179286 -0.00000218 -0.00000224 0.00000374 Au 10.11724574 6.09472452 28.44584822 -0.00000171 -0.00000170 0.00000322 Au 8.14195339 4.04121173 32.53674481 -0.00000254 -0.00000281 0.00000431 Au 10.12064113 4.04138771 34.58071214 -0.00000297 -0.00000330 0.00000465 Au 8.14741209 6.09945416 34.58148313 -0.00000286 -0.00000321 0.00000458 Au 10.11828699 6.09606513 32.53404696 -0.00000249 -0.00000278 0.00000421 Au 8.15091025 4.03750371 36.63282685 -0.00000307 -0.00000336 0.00000490 Au 10.12000639 4.04352108 38.77936076 -0.00000378 -0.00000369 0.00000510 Au 8.13951594 6.09493015 38.75570107 -0.00000318 -0.00000310 0.00000494 Au 10.12418452 6.09816776 36.64212713 -0.00000287 -0.00000358 0.00000488 Au 8.14451808 8.15172133 -0.29081279 0.00000331 0.00000410 -0.00000539 Au 10.11610081 8.14167571 1.83734630 0.00000319 0.00000384 -0.00000526 Au 8.13447189 10.12330464 1.83734622 0.00000317 0.00000381 -0.00000522 Au 10.12853484 10.13573805 -0.32984977 0.00000335 0.00000411 -0.00000535 Au 8.14519740 8.15240204 3.90597542 0.00000296 0.00000345 -0.00000502 Au 10.11236978 8.13528251 5.95539692 0.00000274 0.00000299 -0.00000458 Au 8.12807687 10.11957542 5.95539689 0.00000261 0.00000288 -0.00000469 Au 10.12198392 10.12918853 3.90216985 0.00000293 0.00000346 -0.00000497 Au 8.13824704 8.14545384 7.99966871 0.00000230 0.00000239 -0.00000416 Au 10.11117036 8.13273166 10.04497455 0.00000201 0.00000192 -0.00000359 Au 8.12552370 10.11837833 10.04497452 0.00000181 0.00000169 -0.00000354 Au 10.11855196 10.12575875 8.00172608 0.00000256 0.00000212 -0.00000419 Au 8.13776718 8.14497626 12.08900976 0.00000150 0.00000137 -0.00000288 Au 10.11132731 8.13295647 14.13351688 0.00000123 0.00000101 -0.00000211 Au 8.12574638 10.11853745 14.13351685 0.00000093 0.00000064 -0.00000212 Au 10.11828796 10.12549707 12.08937146 0.00000170 0.00000110 -0.00000292 Au 8.13815353 8.14536454 16.17816003 0.00000067 0.00000062 -0.00000133 Au 10.11141583 8.13313602 18.22272801 0.00000052 0.00000045 -0.00000044 Au 8.12592423 10.11862768 18.22272800 0.00000004 -0.00000008 -0.00000058 Au 10.11847640 10.12568743 16.17805344 0.00000095 0.00000024 -0.00000131 Au 8.13821328 8.14542586 20.26734925 -0.00000014 0.00000003 0.00000028 Au 10.11142238 8.13311300 22.31200170 -0.00000022 -0.00000008 0.00000102 Au 8.12589962 10.11863580 22.31200167 -0.00000068 -0.00000052 0.00000116 Au 10.11852148 10.12573411 20.26739076 0.00000049 -0.00000062 0.00000035 Au 8.13806134 8.14527563 24.35650611 -0.00000094 -0.00000061 0.00000183 Au 10.11129122 8.13284870 26.40097012 -0.00000121 -0.00000101 0.00000252 Au 8.12563342 10.11850659 26.40097010 -0.00000143 -0.00000127 0.00000256 Au 10.11845074 10.12566506 24.35654762 -0.00000066 -0.00000090 0.00000179 Au 8.13769181 8.14490823 28.44561456 -0.00000177 -0.00000158 0.00000312 Au 10.11139244 8.13343033 30.48924784 -0.00000211 -0.00000218 0.00000376 Au 8.12621277 10.11861034 30.48924783 -0.00000231 -0.00000244 0.00000361 Au 10.11832073 10.12553723 28.44447322 -0.00000171 -0.00000172 0.00000312 Au 8.14071872 8.14793749 32.53650421 -0.00000256 -0.00000282 0.00000410 Au 10.11448662 8.13901704 34.58586719 -0.00000255 -0.00000325 0.00000444 Au 8.13179741 10.12170771 34.58586725 -0.00000293 -0.00000358 0.00000456 Au 10.11968773 10.12690686 32.53448569 -0.00000218 -0.00000321 0.00000424 Au 8.14763411 8.15485470 36.64164273 -0.00000314 -0.00000379 0.00000473 Au 10.11117624 8.13383389 38.78923411 -0.00000231 -0.00000396 0.00000494 Au 8.12661366 10.11840341 38.78923426 -0.00000348 -0.00000518 0.00000486 Au 10.12667893 10.13390099 36.66358544 -0.00000293 -0.00000399 0.00000475