64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-230.15718335749446 stress="-549.1083763911207 -10.349085092946353 -13.23775877273576 -10.349085092946353 -473.0950876259442 -23.29093574312043 -13.23775877273576 -23.29093574312043 -535.2507411490136" pbc="F F F" Nb 0.01670848 -0.15496399 -0.14505645 0.89313598 1.19492214 1.10816750 Nb 1.40339319 1.30091033 1.00026671 -5.19559794 -5.57320829 2.75023190 Nb 2.49243980 2.66984928 -0.03872436 -0.53331331 1.25969350 -10.45756509 Nb 3.62055534 3.72040607 1.34603891 8.66583251 -1.35106273 -3.33961818 Nb 2.61611682 0.05191447 2.60493997 -6.86847328 -6.61404171 -8.02011431 Nb 3.72104474 1.03530499 3.94538611 -18.82591751 21.87215740 -6.07024816 Nb -0.17445876 2.39828550 2.34957496 -0.38772659 -0.62219316 0.02796692 Nb 1.33213919 3.94949190 3.58798024 -23.30032639 -38.10092062 8.13499761 Nb 4.99617552 0.24538072 -0.06687772 -1.20247507 1.01837897 1.01236314 Nb 6.35730317 1.37572892 1.33136735 -4.76472280 -1.61417794 1.97336992 Nb 7.62593804 2.61758042 0.15364698 -2.07832465 -1.64386334 -8.84120831 Nb 8.67243622 3.82142487 1.38199913 10.12182277 0.71978602 1.28180904 Nb 7.88105279 0.18690727 2.53754270 -5.70656013 -7.80981283 -6.61924148 Nb 8.97523022 1.12923179 3.78692491 8.21795459 5.39089181 7.08191937 Nb 4.77133999 2.54158756 2.77297089 1.00530929 -1.93155438 -2.80199066 Nb 6.14259795 3.90602811 3.82452220 3.52748589 -32.24962785 -14.18366118 Nb -0.18009938 4.77933781 0.17514789 -0.04361819 -1.52714189 0.37094630 Nb 1.36079653 6.02341231 1.20406040 -5.22366240 4.62141513 -6.21880370 Nb 2.73729435 7.48617888 0.09157613 -6.73982687 -7.49395136 -11.93038411 Nb 3.71322788 8.53556290 1.30607690 4.33000439 11.12910788 7.94616568 Nb 2.35506182 4.81107158 2.55852184 32.41532229 29.47590650 -24.90975792 Nb 3.83780918 6.00534325 3.97306365 -8.29380232 6.02348553 -7.97312932 Nb -0.05321866 7.34688516 2.37186953 0.05048262 0.65191368 1.20034216 Nb 1.39868648 8.87127916 3.87162318 -1.66362504 0.33592639 -1.84636706 Nb 4.87326624 5.09057058 0.02833753 -5.76649101 -1.06154969 -5.66019888 Nb 6.50670958 5.81683954 0.93115944 4.78556211 4.37525578 0.58263339 Nb 7.58751974 7.78792391 0.08654643 -3.82189407 -2.24849689 -3.78857901 Nb 8.80228999 8.82975746 1.22108972 3.31924418 2.81324776 4.70223153 Nb 7.35314436 4.79823057 2.74448936 11.72206856 9.77211599 -12.74038968 Nb 8.52790666 6.33358036 3.62197433 14.40941280 -2.07175340 -5.60054839 Nb 5.19665124 7.66536093 2.67083783 -11.34990526 -14.26686004 -15.51380554 Nb 6.31546322 8.50578044 3.86902589 -8.13134095 38.90970718 -4.28647575 Nb -0.15476291 0.22365368 5.23515345 -9.08153426 -9.93317064 -8.03224650 Nb 1.03297384 1.44039549 6.12083743 10.22217856 -5.72828162 6.56306956 Nb 2.07737041 2.68742795 4.96115111 9.33047023 -3.97497689 -0.08873790 Nb 3.64729270 3.78327428 6.03223236 4.43776272 -3.40657608 0.65731692 Nb 2.46188705 0.07474107 7.68219926 -2.94999075 -3.66564908 -2.76930879 Nb 3.76599560 1.44687183 8.55268715 -10.31200036 -3.54290845 11.41340246 Nb -0.14677563 2.41685287 7.33445667 -9.09649890 7.01051719 8.40928035 Nb 1.27588384 3.95390175 8.61535533 -7.62804695 -6.83832684 9.53747508 Nb 4.84485507 0.00735245 4.81195668 23.70254703 -22.12318543 18.50327579 Nb 6.34065031 1.48210412 6.41970194 12.57823657 -12.94940360 -14.63652535 Nb 7.46083850 2.65710250 4.93329613 -5.98718926 -10.91074726 -11.98040989 Nb 8.70675731 3.37731482 6.11046357 16.29732975 6.81098198 12.94258049 Nb 7.62085986 -0.10767881 7.15434956 3.39806484 -1.94924591 1.71321308 Nb 8.71506093 1.27521175 8.70330736 -1.86147684 0.30920373 -1.77945830 Nb 5.16501953 2.31852632 7.54363837 -7.98917859 15.87271389 5.29878386 Nb 6.17783251 3.78984556 8.70744613 1.94748896 4.11914337 4.04360629 Nb 0.24045141 4.97427207 4.60752852 -20.35782868 17.72999478 17.45954301 Nb 1.10680830 6.45165196 6.46356377 14.71075804 -11.45668710 -15.33139965 Nb 2.85674254 7.68023684 5.00911661 -9.19322056 -5.09877893 -9.71386198 Nb 3.85922972 8.56217465 6.42396681 -11.76564501 29.96485383 -7.60375413 Nb 2.45095708 4.89209796 7.40907482 7.04919516 7.02916666 -3.58499347 Nb 3.71969587 6.32339941 8.90436496 -1.93318066 -1.97537435 3.61028358 Nb -0.02558164 7.46944255 7.43330594 -19.24885299 13.08964115 11.50836529 Nb 1.19085282 8.44189989 8.86341524 3.57491561 1.63398027 2.44964862 Nb 5.23248622 4.93732002 4.89365129 -13.45839963 18.15030601 31.81868851 Nb 6.35773924 6.43186106 6.13120330 -6.03184512 -7.77624905 13.24836998 Nb 7.34127033 7.40765748 4.79325082 26.12162393 -6.27869730 16.91390306 Nb 8.77959145 8.60891156 6.46679022 -1.28406761 -1.35144542 -0.01375518 Nb 7.71451944 5.07168954 7.40731892 -10.77274905 -10.00618234 -10.94407343 Nb 8.79346324 6.01488352 8.54452792 12.21295005 11.72231359 13.04342662 Nb 4.85822949 7.48235548 7.42567966 14.11055357 -20.64252536 16.21086663 Nb 6.20764906 8.50982273 8.62989578 5.69159598 2.78189966 3.76236768