864 Lattice="15.337147641664169 0.0 0.0 15.33714764166417 18.784092915903795 0.0 0.0 0.0 35.419625278063364" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2998.2680260325474 stress="39.19789814797943 -0.013190067568729091 -0.03126021177075344 -0.013190067568729091 20.87972398412822 0.02767124718631564 -0.03126021177075344 0.02767124718631564 0.00321327099644364" pbc="T T F" Cu 0.00140692 -0.01998032 0.09341826 -0.00000594 0.00000563 0.00000038 Cu 3.83569199 2.05497839 0.76956575 -0.00000559 0.00000527 0.00000148 Cu 2.55759814 -0.01998068 0.09341845 -0.00000592 0.00000568 0.00000045 Cu 6.39188324 2.05498003 0.76956455 -0.00000564 0.00000487 0.00000137 Cu 17.89474299 16.69808075 1.45739271 -0.00000582 0.00000522 -0.00000042 Cu 6.39188137 0.00477911 2.24520947 -0.00000558 0.00000437 0.00000116 Cu 20.45093400 16.69808195 1.45739147 -0.00000533 0.00000466 0.00000017 Cu 8.94807268 0.00478009 2.24520867 -0.00000600 0.00000484 0.00000153 Cu 20.45092991 14.61940828 2.94507199 -0.00000526 0.00000477 -0.00000021 Cu 24.28521465 16.69617733 3.68039659 -0.00000486 0.00000382 0.00000158 Cu 23.00712116 14.61940985 2.94507066 -0.00000495 0.00000358 0.00000012 Cu 26.84140593 16.69617686 3.68039719 -0.00000572 0.00000421 0.00000074 Cu 23.00711131 12.52374752 4.44442997 -0.00000443 0.00000371 -0.00000126 Cu 26.84139620 14.61235859 5.16463999 -0.00000450 0.00000381 0.00000032 Cu 10.22615482 12.52374791 4.44442971 -0.00000392 0.00000340 -0.00000019 Cu 14.06043982 14.61235695 5.16464132 -0.00000436 0.00000492 -0.00000035 Cu 10.22614498 10.43597339 5.90281804 -0.00000434 0.00000352 -0.00000001 Cu 14.06042713 12.52397349 6.65048089 -0.00000270 0.00000345 0.00000037 Cu 12.78233610 10.43597228 5.90281909 -0.00000271 0.00000293 -0.00000060 Cu 16.61661862 12.52397227 6.65048168 -0.00000454 0.00000459 0.00000005 Cu 12.78232585 8.35024327 7.38047631 -0.00000286 0.00000281 -0.00000079 Cu 16.61660598 10.43646563 8.11938575 -0.00000339 0.00000416 0.00000009 Cu 15.33851724 8.35024166 7.38047741 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13.28644265 -0.00000173 0.00000056 0.00000094 Cu 11.50416178 2.08847714 14.02376545 -0.00000171 0.00000112 0.00000183 Cu 10.22607513 0.00134170 13.28644252 -0.00000227 0.00000029 0.00000065 Cu 14.06035311 2.08847576 14.02376668 -0.00000183 0.00000101 0.00000065 Cu 25.56320317 16.69828449 14.76186828 -0.00000105 -0.00000011 -0.00000013 Cu 14.06033383 0.00137056 15.49994537 -0.00000145 0.00000094 0.00000050 Cu 28.11939449 16.69828340 14.76186913 -0.00000155 0.00000057 -0.00000015 Cu 1.27937743 0.00136960 15.49994604 -0.00000085 0.00000113 0.00000055 Cu 12.78222669 14.61122389 16.23766117 -0.00000098 0.00000012 0.00000037 Cu 16.61650553 16.69833397 16.97558440 -0.00000028 0.00000037 0.00000021 Cu 15.33841790 14.61122250 16.23766222 0.00000013 0.00000054 -0.00000057 Cu 19.17269681 16.69833445 16.97558396 -0.00000046 0.00000031 0.00000097 Cu 15.33839724 12.52413824 17.71359220 0.00000174 -0.00000039 -0.00000126 Cu 19.17267596 14.61125014 18.45151415 0.00000015 0.00000084 -0.00000015 Cu 17.89458873 12.52413795 17.71359236 -0.00000068 0.00000032 -0.00000116 Cu 21.72886714 14.61125167 18.45151316 0.00000118 -0.00000063 -0.00000042 Cu 17.89456957 10.43700938 19.18923032 0.00000046 -0.00000009 -0.00000052 Cu 21.72884686 12.52419222 19.92730509 0.00000155 -0.00000126 -0.00000061 Cu 20.45076074 10.43701053 19.18922960 0.00000198 -0.00000022 -0.00000099 Cu 24.28503812 12.52419313 19.92730431 0.00000160 -0.00000133 0.00000102 Cu 20.45074236 8.34990546 20.66540790 0.00000283 -0.00000149 -0.00000102 Cu 8.94787147 10.43704296 21.40272973 0.00000164 -0.00000044 -0.00000025 Cu 7.66978617 8.34990678 20.66540690 0.00000040 -0.00000123 -0.00000077 Cu 11.50406265 10.43704247 21.40273011 0.00000275 -0.00000149 -0.00000085 Cu 7.66976954 6.26290374 22.14110443 0.00000184 -0.00000173 0.00000010 Cu 11.50404591 8.34989689 22.87943860 0.00000255 -0.00000205 -0.00000080 Cu 10.22596076 6.26290389 22.14110421 0.00000188 -0.00000146 -0.00000033 Cu 14.06023719 8.34989543 22.87943955 0.00000267 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0.00000402 -0.00000350 0.00000009 Cu 20.45066403 16.69850057 28.03869470 0.00000347 -0.00000353 -0.00000018 Cu 8.94780001 0.00241138 28.78635419 0.00000404 -0.00000476 0.00000036 Cu 20.45065063 14.61011706 29.52453459 0.00000549 -0.00000399 0.00000000 Cu 24.28493539 16.69872973 30.24474306 0.00000504 -0.00000466 -0.00000022 Cu 23.00684188 14.61011836 29.52453351 0.00000559 -0.00000405 0.00000009 Cu 26.84112664 16.69872916 30.24474327 0.00000559 -0.00000475 0.00000082 Cu 23.00683441 12.52630003 31.00877604 0.00000635 -0.00000487 -0.00000029 Cu 26.84111690 14.60306680 31.74410261 0.00000605 -0.00000428 0.00000005 Cu 10.22587812 12.52630015 31.00877575 0.00000531 -0.00000458 -0.00000023 Cu 14.06016049 14.60306545 31.74410375 0.00000637 -0.00000462 -0.00000027 Cu 10.22587767 10.43360430 32.44396343 0.00000503 -0.00000483 -0.00000036 Cu 14.06015846 12.52439172 33.23178421 0.00000617 -0.00000460 -0.00000066 Cu 12.78206893 10.43360318 32.44396425 0.00000480 -0.00000445 -0.00000076 Cu 16.61634998 12.52439086 33.23178509 0.00000613 -0.00000455 -0.00000070 Cu 12.78206903 8.38340208 33.91960856 0.00000430 -0.00000486 -0.00000102 Cu 16.61635459 10.45835842 34.59575823 0.00000446 -0.00000450 -0.00000125 Cu 15.33826039 8.38340069 33.91960963 0.00000418 -0.00000442 -0.00000133 Cu 19.17254592 10.45835901 34.59575792 0.00000448 -0.00000471 -0.00000114 Cu 5.11378224 6.24138835 0.09341668 -0.00000418 0.00000438 0.00000094 Cu 8.94806854 8.31634738 0.76956659 -0.00000390 0.00000391 0.00000107 Cu 7.66997359 6.24139010 0.09341558 -0.00000398 0.00000384 0.00000120 Cu 11.50426019 8.31634686 0.76956710 -0.00000432 0.00000426 0.00000083 Cu 7.66997555 4.17535559 1.45738581 -0.00000504 0.00000412 0.00000167 Cu 11.50425836 6.26614438 2.24520849 -0.00000440 0.00000427 0.00000214 Cu 10.22616723 4.17535595 1.45738559 -0.00000533 0.00000391 0.00000186 Cu 14.06044961 6.26614288 2.24520980 -0.00000429 0.00000493 0.00000086 Cu 10.22616621 2.09668191 2.94506526 -0.00000665 0.00000391 0.00000122 Cu 14.06044797 4.17344690 3.68039499 -0.00000463 0.00000400 0.00000122 Cu 12.78235730 2.09668080 2.94506631 -0.00000442 0.00000385 0.00000100 Cu 16.61663932 4.17344573 3.68039578 -0.00000531 0.00000572 0.00000135 Cu 12.78235035 0.00101860 4.44442640 -0.00000506 0.00000392 0.00000056 Cu 16.61663334 2.08962766 5.16463706 -0.00000489 0.00000453 0.00000213 Cu 0.00139405 0.00101711 4.44442753 -0.00000551 0.00000392 0.00000047 Cu 3.83567707 2.08962811 5.16463671 -0.00000531 0.00000447 0.00000082 Cu 15.33853198 16.69733543 5.90281804 -0.00000535 0.00000390 -0.00000091 Cu 3.83566645 0.00124471 6.65047686 -0.00000458 0.00000368 0.00000071 Cu 17.89472326 16.69733506 5.90281818 -0.00000400 0.00000378 -0.00000032 Cu 6.39185775 0.00124624 6.65047570 -0.00000485 0.00000438 0.00000135 Cu 17.89471020 14.61160572 7.38047833 -0.00000410 0.00000389 -0.00000043 Cu 21.72899194 16.69783253 8.11938154 -0.00000330 0.00000286 0.00000164 Cu 20.45090145 14.61160700 7.38047740 -0.00000344 0.00000270 -0.00000035 Cu 24.28518325 16.69783366 8.11938088 -0.00000446 0.00000276 0.00000111 Cu 20.45088642 12.52401987 8.86093332 -0.00000282 0.00000259 -0.00000175 Cu 24.28516735 14.61130324 9.59540109 -0.00000326 0.00000249 0.00000055 Cu 23.00707769 12.52402145 8.86093214 -0.00000315 0.00000217 -0.00000049 Cu 26.84135855 14.61130275 9.59540151 -0.00000262 0.00000291 -0.00000001 Cu 23.00706262 10.43671642 10.33405162 -0.00000352 0.00000210 -0.00000007 Cu 11.50419389 12.52404583 11.07328322 -0.00000154 0.00000135 0.00000041 Cu 10.22610606 10.43671683 10.33405142 -0.00000129 0.00000132 -0.00000043 Cu 14.06038526 12.52404424 11.07328431 -0.00000287 0.00000258 0.00000062 Cu 10.22609035 8.34985117 11.80973723 -0.00000105 0.00000078 -0.00000066 Cu 14.06036802 10.43684264 12.54807262 -0.00000200 0.00000255 0.00000020 Cu 12.78228177 8.34985000 11.80973808 -0.00000284 0.00000146 -0.00000037 Cu 16.61655929 10.43684172 12.54807351 -0.00000133 0.00000204 -0.00000138 Cu 12.78226517 6.26270457 13.28644528 -0.00000293 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19.17282680 10.43481008 3.68040085 -0.00000408 0.00000496 0.00000008 Cu 17.89473404 8.35804295 2.94507103 -0.00000400 0.00000459 -0.00000001 Cu 21.72901804 10.43481156 3.68039945 -0.00000379 0.00000489 -0.00000007 Cu 17.89472884 6.26238073 4.44442769 -0.00000551 0.00000470 0.00000010 Cu 21.72901079 8.35099347 5.16463886 -0.00000311 0.00000360 0.00000078 Cu 5.11377230 6.26238193 4.44442671 -0.00000300 0.00000380 0.00000034 Cu 8.94805447 8.35099451 5.16463805 -0.00000439 0.00000444 0.00000130 Cu 5.11376629 4.17460764 5.90281436 -0.00000403 0.00000365 0.00000063 Cu 8.94804575 6.26261140 6.65047544 -0.00000388 0.00000352 0.00000240 Cu 7.66995762 4.17460924 5.90281319 -0.00000507 0.00000287 0.00000137 Cu 11.50423700 6.26261096 6.65047602 -0.00000382 0.00000350 0.00000056 Cu 7.66994778 2.08888029 7.38047194 -0.00000581 0.00000281 0.00000063 Cu 11.50422691 4.17510462 8.11937920 -0.00000356 0.00000220 0.00000111 Cu 10.22613880 2.08888071 7.38047177 -0.00000311 0.00000228 0.00000086 Cu 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5.11374250 0.00129174 8.86092887 -0.00000355 0.00000272 0.00000059 Cu 8.94802232 2.08857492 9.59539711 -0.00000348 0.00000241 0.00000261 Cu 7.66993381 0.00129336 8.86092785 -0.00000422 0.00000174 0.00000084 Cu 11.50421366 2.08857448 9.59539765 -0.00000393 0.00000225 0.00000110 Cu 23.00706523 16.69808120 10.33404895 -0.00000345 0.00000155 -0.00000042 Cu 11.50419720 0.00131765 11.07327919 -0.00000310 0.00000161 0.00000089 Cu 25.56325644 16.69808157 10.33404873 -0.00000263 0.00000148 0.00000019 Cu 14.06038846 0.00131606 11.07328025 -0.00000287 0.00000282 0.00000092 Cu 25.56323861 14.61121565 11.80973691 -0.00000264 0.00000126 0.00000041 Cu 14.06037016 16.69820746 12.54806966 -0.00000170 0.00000144 0.00000095 Cu 12.78228215 14.61121455 11.80973781 -0.00000164 0.00000112 -0.00000035 Cu 16.61656149 16.69820643 12.54807035 -0.00000248 0.00000191 0.00000068 Cu 12.78226348 12.52406882 13.28644742 -0.00000057 0.00000054 -0.00000139 Cu 16.61654217 14.61120308 14.02377025 -0.00000172 0.00000212 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24.35512271 0.00000220 -0.00000141 0.00000002 Cu 17.89451699 16.69842854 23.61589184 0.00000140 -0.00000155 -0.00000041 Cu 6.39164968 0.00166710 24.35512164 0.00000256 -0.00000300 0.00000033 Cu 17.89449838 14.61117164 25.09377374 0.00000347 -0.00000215 -0.00000009 Cu 21.72877982 16.69845507 25.82824162 0.00000318 -0.00000316 -0.00000031 Cu 20.45068958 14.61117283 25.09377296 0.00000398 -0.00000214 -0.00000020 Cu 24.28497103 16.69845596 25.82824079 0.00000384 -0.00000363 0.00000120 Cu 20.45067400 12.52464257 26.56979296 0.00000557 -0.00000340 -0.00000062 Cu 24.28495474 14.61086879 27.30869680 0.00000447 -0.00000296 0.00000010 Cu 23.00686542 12.52464390 26.56979195 0.00000358 -0.00000333 -0.00000046 Cu 26.84114601 14.61086826 27.30869714 0.00000495 -0.00000394 -0.00000012 Cu 23.00685467 10.43713720 28.03869733 0.00000475 -0.00000373 -0.00000020 Cu 11.50398653 12.52513899 28.78635715 0.00000523 -0.00000411 -0.00000068 Cu 10.22589835 10.43713733 28.03869714 0.00000461 -0.00000355 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