180 Lattice="9.90239983053 0.0 0.0 0.0 9.90239983053 0.0 0.0 0.0 33.0079994351" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1334.4730609008427 stress="28.777092672596847 0.1397439711456807 0.0017295656205496002 0.1397439711456807 29.061611183755865 -0.008909462504962686 0.0017295656205496002 -0.008909462504962686 1.0355290142732843e-06" pbc="T T F" Nb 0.11181266 0.01037424 0.15600035 0.00000133 -0.00000683 -0.00000000 Nb 1.64225384 1.75844399 1.65027466 0.00000133 -0.00000681 0.00000000 Nb 0.00641583 0.00574443 3.19033851 0.00000129 -0.00000662 0.00000002 Nb 1.64528287 1.64921423 4.94328903 0.00000124 -0.00000637 -0.00000002 Nb -0.00241769 0.00889435 6.56877528 0.00000119 -0.00000602 0.00000002 Nb 1.64854820 1.65551831 8.25131550 0.00000105 -0.00000539 0.00000001 Nb -0.00169347 0.01088317 9.89506836 0.00000091 -0.00000458 0.00000001 Nb 1.64895635 1.65938497 11.55657734 0.00000069 -0.00000348 0.00000003 Nb -0.00148714 0.01104829 13.20450462 0.00000045 -0.00000223 0.00000000 Nb 1.64887851 1.66106669 14.85895664 0.00000016 -0.00000080 0.00000004 Nb -0.00148235 0.01099902 16.50745293 -0.00000010 0.00000065 0.00000000 Nb 1.64860699 1.66243860 18.15932878 -0.00000040 0.00000209 0.00000004 Nb -0.00155721 0.01093402 19.80616939 -0.00000062 0.00000338 0.00000000 Nb 1.64790856 1.66488970 21.45741829 -0.00000086 0.00000451 0.00000004 Nb -0.00138762 0.01088457 23.09921472 -0.00000100 0.00000537 -0.00000000 Nb 1.64547214 1.67200212 24.75073298 -0.00000115 0.00000602 0.00000003 Nb 0.00051826 0.01085818 26.38182138 -0.00000123 0.00000642 0.00000003 Nb 1.63579931 1.68568041 28.03203821 -0.00000133 0.00000659 0.00000009 Nb 0.03397877 0.01084628 29.66290057 -0.00000071 0.00000687 -0.00000025 Nb 1.80001435 1.50852205 31.29737579 -0.00000131 0.00000657 -0.00000019 Nb -0.12434624 3.46982667 0.06969999 0.00000133 -0.00000683 0.00000001 Nb 1.64903568 4.96239270 1.72458230 0.00000135 -0.00000678 -0.00000001 Nb -0.00746680 3.31518691 3.33711099 0.00000130 -0.00000664 -0.00000002 Nb 1.64903286 4.96238234 5.00114881 0.00000121 -0.00000633 0.00000000 Nb -0.00140324 3.30388434 6.62272428 0.00000114 -0.00000598 -0.00000003 Nb 1.64902606 4.96235757 8.27898781 0.00000100 -0.00000534 -0.00000000 Nb -0.00113151 3.30851039 9.91596595 0.00000087 -0.00000456 -0.00000003 Nb 1.64900792 4.96230938 11.56920715 0.00000064 -0.00000344 -0.00000000 Nb -0.00127836 3.31075224 13.21396470 0.00000042 -0.00000220 -0.00000004 Nb 1.64895540 4.96224140 14.86654015 0.00000013 -0.00000077 -0.00000000 Nb -0.00137444 3.31205971 16.51455394 -0.00000014 0.00000068 -0.00000006 Nb 1.64880966 4.96216789 18.16904460 -0.00000043 0.00000211 -0.00000001 Nb -0.00149605 3.31362736 19.81776308 -0.00000067 0.00000342 -0.00000008 Nb 1.64826626 4.96210603 21.47896399 -0.00000090 0.00000454 -0.00000001 Nb -0.00200131 3.31745263 23.12594175 -0.00000105 0.00000542 -0.00000007 Nb 1.64512817 4.96206768 24.80780926 -0.00000120 0.00000604 -0.00000002 Nb -0.00792507 3.32778627 26.44800012 -0.00000126 0.00000647 -0.00000005 Nb 1.63740587 4.96205120 28.19076625 -0.00000131 0.00000665 -0.00000002 Nb -0.00674909 3.25614429 29.80441602 -0.00000132 0.00000693 -0.00000002 Nb 1.66854778 4.96204539 31.22123944 -0.00000137 0.00000684 0.00000000 Nb -0.00944576 6.46093617 0.06997216 0.00000133 -0.00000683 -0.00000002 Nb 1.65581652 8.16634378 1.65027456 0.00000132 -0.00000681 0.00000000 Nb 0.00361985 6.62472820 3.34135926 0.00000127 -0.00000663 0.00000003 Nb 1.65278000 8.27555330 4.94328852 0.00000124 -0.00000637 0.00000002 Nb -0.00133951 6.62230595 6.62314612 0.00000114 -0.00000598 0.00000006 Nb 1.64949036 8.26919973 8.25131520 0.00000105 -0.00000539 -0.00000001 Nb -0.00121833 6.61639246 9.91582791 0.00000086 -0.00000456 0.00000005 Nb 1.64901176 8.26523626 11.55657842 0.00000069 -0.00000348 -0.00000004 Nb -0.00130364 6.61384960 13.21386860 0.00000041 -0.00000220 0.00000005 Nb 1.64887515 8.26341759 14.85895826 0.00000017 -0.00000080 -0.00000004 Nb -0.00138103 6.61236011 16.51451307 -0.00000014 0.00000068 0.00000005 Nb 1.64860375 8.26189829 18.15933067 -0.00000038 0.00000209 -0.00000005 Nb -0.00149774 6.61064458 19.81774670 -0.00000067 0.00000342 0.00000006 Nb 1.64790714 8.25932371 21.45742056 -0.00000085 0.00000451 -0.00000005 Nb -0.00200163 6.60671557 23.12593505 -0.00000105 0.00000542 0.00000005 Nb 1.64547185 8.25213458 24.75073515 -0.00000116 0.00000602 -0.00000008 Nb -0.00792513 6.59632807 26.44799781 -0.00000131 0.00000641 -0.00000003 Nb 1.63579918 8.23842162 28.03203851 -0.00000113 0.00000699 0.00000029 Nb -0.00674872 6.66794668 29.80441500 -0.00000136 0.00000692 0.00000001 Nb 1.80001432 8.41556938 31.29737492 -0.00000099 0.00000736 -0.00000042 Nb 3.18625627 0.01201514 0.15599545 0.00000133 -0.00000683 -0.00000000 Nb 4.94169717 1.71781263 1.58127148 0.00000134 -0.00000681 0.00000002 Nb 3.29165141 0.01663486 3.19032446 0.00000129 -0.00000662 -0.00000002 Nb 4.95081710 1.64694802 4.92710871 0.00000124 -0.00000637 0.00000002 Nb 3.30048416 0.01345612 6.56872373 0.00000119 -0.00000602 -0.00000002 Nb 4.95024927 1.65504109 8.24759832 0.00000105 -0.00000538 0.00000005 Nb 3.29974466 0.01139440 9.89484675 0.00000091 -0.00000458 -0.00000001 Nb 4.94992830 1.65925960 11.55541758 0.00000068 -0.00000348 0.00000007 Nb 3.29948485 0.01110900 13.20374524 0.00000045 -0.00000223 -0.00000000 Nb 4.94995194 1.66101505 14.85816620 0.00000017 -0.00000081 0.00000008 Nb 3.29933034 0.01101183 16.50509030 -0.00000010 0.00000062 0.00000000 Nb 4.95009478 1.66237988 18.15781116 -0.00000038 0.00000206 0.00000011 Nb 3.29906472 0.01093874 19.79993716 -0.00000061 0.00000332 0.00000001 Nb 4.95042196 1.66460385 21.45348586 -0.00000084 0.00000447 0.00000013 Nb 3.29822693 0.01088745 23.08465346 -0.00000100 0.00000529 0.00000001 Nb 4.95169093 1.67003323 24.74030869 -0.00000114 0.00000599 0.00000016 Nb 3.29620403 0.01085934 26.35127161 -0.00000124 0.00000637 0.00000004 Nb 4.96359619 1.67638689 28.01006076 -0.00000104 0.00000699 -0.00000016 Nb 3.30410201 0.01084820 29.50893719 -0.00000258 0.00000618 0.00000026 Nb 4.81176332 1.50653494 31.29722055 -0.00000116 0.00000714 0.00000023 Nb 3.30751706 3.46385395 0.06996775 0.00000133 -0.00000680 0.00000003 Nb 4.96183639 4.91812632 1.78251927 0.00000129 -0.00000669 -0.00000009 Nb 3.29445321 3.30005075 3.34135149 0.00000126 -0.00000664 -0.00000003 Nb 4.95303434 4.95932329 5.01821890 0.00000121 -0.00000631 -0.00000001 Nb 3.29940727 3.30244250 6.62311961 0.00000114 -0.00000598 -0.00000005 Nb 4.95036586 4.96213539 8.28582491 0.00000100 -0.00000532 -0.00000001 Nb 3.29927552 3.30829022 9.91573299 0.00000086 -0.00000456 -0.00000005 Nb 4.94987893 4.96227790 11.57164025 0.00000063 -0.00000343 -0.00000001 Nb 3.29932365 3.31073288 13.21358245 0.00000041 -0.00000222 -0.00000003 Nb 4.94985487 4.96223373 14.86698982 0.00000013 -0.00000079 0.00000000 Nb 3.29928186 3.31213007 16.51374230 -0.00000014 0.00000065 -0.00000003 Nb 4.94988936 4.96216614 18.16808909 -0.00000043 0.00000207 0.00000000 Nb 3.29904689 3.31385373 19.81581694 -0.00000066 0.00000336 -0.00000002 Nb 4.95004475 4.96210633 21.47565567 -0.00000090 0.00000449 0.00000001 Nb 3.29819911 3.31809638 23.12080439 -0.00000105 0.00000536 0.00000000 Nb 4.95173629 4.96206787 24.79760038 -0.00000120 0.00000603 0.00000001 Nb 3.29755511 3.32822693 26.42901346 -0.00000122 0.00000643 0.00000003 Nb 4.96791776 4.96205029 28.16400441 -0.00000129 0.00000669 0.00000000 Nb 3.31725099 3.28898937 29.72476505 -0.00000137 0.00000699 0.00000001 Nb 5.05497611 4.96204533 31.21216648 -0.00000136 0.00000689 0.00000001 Nb 3.42241853 6.45496213 0.06969841 0.00000136 -0.00000687 0.00000002 Nb 4.93534041 8.23713158 1.62658016 0.00000132 -0.00000682 0.00000001 Nb 3.30553988 6.60959306 3.33710046 0.00000130 -0.00000664 0.00000002 Nb 4.94558992 8.28066413 4.93688437 0.00000125 -0.00000637 0.00000000 Nb 3.29947095 6.62086199 6.62269288 0.00000114 -0.00000598 0.00000003 Nb 4.94957226 8.26972329 8.24956874 0.00000106 -0.00000538 -0.00000003 Nb 3.29918805 6.61615823 9.91586585 0.00000087 -0.00000456 0.00000003 Nb 4.94987760 8.26533189 11.55589971 0.00000069 -0.00000348 -0.00000006 Nb 3.29929755 6.61377720 13.21367415 0.00000042 -0.00000222 0.00000002 Nb 4.94995214 8.26346187 14.85829851 0.00000016 -0.00000081 -0.00000007 Nb 3.29927503 6.61226932 16.51377924 -0.00000013 0.00000064 0.00000002 Nb 4.95009706 8.26195626 18.15785186 -0.00000040 0.00000206 -0.00000009 Nb 3.29904521 6.61041523 19.81582901 -0.00000067 0.00000336 0.00000002 Nb 4.95042367 8.25961075 21.45350225 -0.00000087 0.00000448 -0.00000011 Nb 3.29819909 6.60607315 23.12080836 -0.00000106 0.00000536 -0.00000000 Nb 4.95169199 8.25410474 24.74031777 -0.00000116 0.00000599 -0.00000010 Nb 3.29755565 6.59588841 26.42901601 -0.00000124 0.00000643 -0.00000005 Nb 4.96359699 8.24771373 28.01006574 -0.00000125 0.00000660 -0.00000014 Nb 3.31725093 6.63510374 29.72476673 -0.00000132 0.00000709 0.00000001 Nb 4.81176328 8.41755691 31.29721986 -0.00000148 0.00000675 0.00000001 Nb 6.60023813 0.01119502 0.14864191 0.00000133 -0.00000682 -0.00000000 Nb 8.26513262 1.68765719 1.62658652 0.00000132 -0.00000680 -0.00000002 Nb 6.60024048 0.01118799 3.17827465 0.00000126 -0.00000658 0.00000000 Nb 8.25488874 1.64410263 4.93690289 0.00000125 -0.00000637 -0.00000001 Nb 6.60024822 0.01117376 6.56255079 0.00000118 -0.00000600 -0.00000000 Nb 8.25092780 1.65499087 8.24965211 0.00000106 -0.00000538 0.00000003 Nb 6.60027771 0.01113796 9.89280124 0.00000091 -0.00000458 -0.00000000 Nb 8.25067671 1.65927228 11.55620762 0.00000069 -0.00000348 0.00000005 Nb 6.60035566 0.01107809 13.20348301 0.00000045 -0.00000223 -0.00000000 Nb 8.25073753 1.66095311 14.85925844 0.00000017 -0.00000080 0.00000003 Nb 6.60053993 0.01100487 16.50644784 -0.00000010 0.00000063 -0.00000001 Nb 8.25090252 1.66218411 18.16055964 -0.00000039 0.00000210 0.00000001 Nb 6.60095455 0.01093589 19.80425897 -0.00000062 0.00000335 -0.00000002 Nb 8.25137579 1.66410568 21.46062143 -0.00000085 0.00000454 0.00000000 Nb 6.60199901 0.01088546 23.09534133 -0.00000100 0.00000534 -0.00000002 Nb 8.25333625 1.66834314 24.75904280 -0.00000115 0.00000605 0.00000000 Nb 6.60477020 0.01085795 26.37456147 -0.00000123 0.00000643 0.00000000 Nb 8.26107411 1.65765465 28.05731341 -0.00000135 0.00000676 -0.00000002 Nb 6.57248248 0.01084718 29.65259453 -0.00000130 0.00000684 -0.00000013 Nb 8.24947757 1.50454770 31.30421758 -0.00000145 0.00000730 0.00000016 Nb 6.72495003 3.46280793 0.06862374 0.00000133 -0.00000682 0.00000001 Nb 8.23863925 5.00665819 1.78252320 0.00000131 -0.00000674 0.00000001 Nb 6.61338444 3.29002666 3.33859532 0.00000131 -0.00000662 0.00000003 Nb 8.24744938 4.96543980 5.01823111 0.00000121 -0.00000631 0.00000002 Nb 6.60097645 3.29993193 6.62291918 0.00000115 -0.00000598 -0.00000002 Nb 8.25013720 4.96257805 8.28586114 0.00000100 -0.00000532 0.00000002 Nb 6.60026952 3.30773621 9.91624578 0.00000087 -0.00000456 -0.00000002 Nb 8.25066505 4.96233962 11.57174448 0.00000063 -0.00000343 0.00000001 Nb 6.60032116 3.31055213 13.21394244 0.00000042 -0.00000222 -0.00000002 Nb 8.25077577 4.96224858 14.86726779 0.00000012 -0.00000076 0.00000001 Nb 6.60049254 3.31200857 16.51392653 -0.00000013 0.00000066 -0.00000002 Nb 8.25096615 4.96216974 18.16882142 -0.00000043 0.00000213 0.00000001 Nb 6.60095715 3.31364071 19.81576599 -0.00000066 0.00000338 -0.00000000 Nb 8.25174683 4.96210578 21.47759505 -0.00000091 0.00000458 0.00000001 Nb 6.60281884 3.31736939 23.11987904 -0.00000104 0.00000538 0.00000003 Nb 8.25544765 4.96206611 24.80454860 -0.00000119 0.00000612 0.00000001 Nb 6.61140482 3.32500008 26.42561742 -0.00000128 0.00000640 0.00000009 Nb 8.25097822 4.96205099 28.19488168 -0.00000130 0.00000670 0.00000000 Nb 6.59517516 3.21636049 29.72298337 -0.00000136 0.00000689 -0.00000002 Nb 8.13586414 4.96204481 31.21918963 -0.00000132 0.00000694 0.00000003 Nb 6.47552561 6.46198239 0.06862509 0.00000131 -0.00000685 0.00000001 Nb 8.25877487 8.20697645 1.58127943 0.00000134 -0.00000681 -0.00000001 Nb 6.58709502 6.63475030 3.33859739 0.00000129 -0.00000660 -0.00000002 Nb 8.24966349 8.27781829 4.92712915 0.00000124 -0.00000637 -0.00000002 Nb 6.59952363 6.62481473 6.62291925 0.00000115 -0.00000598 0.00000002 Nb 8.25025172 8.26967841 8.24768512 0.00000105 -0.00000538 -0.00000005 Nb 6.60028244 6.61693889 9.91624551 0.00000087 -0.00000456 0.00000002 Nb 8.25062628 8.26537655 11.55572965 0.00000068 -0.00000348 -0.00000005 Nb 6.60035715 6.61400343 13.21394215 0.00000041 -0.00000221 0.00000003 Nb 8.25073739 8.26353738 14.85912847 0.00000016 -0.00000080 -0.00000004 Nb 6.60050523 6.61240093 16.51392628 -0.00000014 0.00000066 0.00000003 Nb 8.25090413 8.26215317 18.16052398 -0.00000039 0.00000210 -0.00000002 Nb 6.60096125 6.61062974 19.81576629 -0.00000068 0.00000339 0.00000002 Nb 8.25137678 8.26010661 21.46061211 -0.00000086 0.00000454 -0.00000001 Nb 6.60282056 6.60679943 23.11988069 -0.00000107 0.00000539 -0.00000001 Nb 8.25333695 8.25579181 24.75904070 -0.00000117 0.00000605 -0.00000001 Nb 6.61140597 6.59911471 26.42561969 -0.00000129 0.00000647 -0.00000001 Nb 8.26107272 8.26644500 28.05731359 -0.00000131 0.00000673 -0.00000004 Nb 6.59517554 6.70773073 29.72298391 -0.00000136 0.00000693 -0.00000002 Nb 8.24947726 8.41954191 31.30421601 -0.00000144 0.00000659 0.00000021