108 Lattice="11.357392549193811 0.0 0.0 0.0 11.357392549193811 0.0 0.0 0.0 11.357392549193811" Properties=species:S:1:pos:R:3:forces:R:3 energy=-576.0999983954424 stress="-0.008948562025457293 0.0004683023652389671 -0.0030911683516453422 0.0004683023652389671 -0.009708552091296176 0.002155941274824435 -0.0030911683516453422 0.002155941274824435 -0.010237559575848376" free_energy=-576.0999983954424 pbc="F F F" Si 0.03639356 0.02424828 0.03299614 0.77713169 0.77089627 0.80635810 Si 1.87570921 1.88128607 0.02505099 -1.53266711 -1.40717932 1.33706936 Si 1.90621432 0.01144608 1.90540266 -1.75211687 1.11517551 -1.68120315 Si 0.01066260 1.86225666 1.92067566 1.27374719 -1.27797599 -1.66221222 Si 3.75936051 0.00092561 0.00787569 0.28071460 1.05226976 1.05336621 Si 5.62805266 1.88629321 0.01723326 0.65850536 -2.62151010 0.77463755 Si 5.61908539 0.04015626 1.92823280 0.67449327 0.32923950 -3.09073860 Si 3.74254279 1.88191539 1.88886660 0.44721443 -2.00917546 -2.14445610 Si 7.59758023 0.00456563 0.02652965 1.50615754 2.08297061 2.14879636 Si 9.49937653 1.88489631 0.01372373 -2.14562456 -1.52450262 2.02035161 Si 9.49972974 0.01396638 1.91076924 -2.14108994 1.93473042 -1.71772081 Si 7.55837758 1.92552809 1.88077005 2.13277258 -2.20815288 -1.70106292 Si 0.01184853 3.74849142 0.03657126 0.98804663 0.38786850 0.89149996 Si 1.89669184 5.67076733 0.00788204 -2.50187107 -0.03034268 0.78323333 Si 1.88372095 3.77741611 1.90207109 -2.39369306 0.28087631 -2.66136172 Si 0.00489428 5.64536643 1.89197437 0.83233283 0.32354944 -2.42086387 Si 3.81923406 3.73813581 0.03456175 -0.30030975 0.46821896 -0.25176502 Si 5.68955379 5.67768722 0.03085868 -0.15660838 -0.06654268 0.14075469 Si 5.71309791 3.76462643 1.90152402 -0.27985332 0.38650083 -3.29340721 Si 3.75329145 5.64684883 1.87366615 0.38165317 0.23272797 -2.77806184 Si 7.58559392 3.79232343 0.01259722 2.21993788 -0.00266648 0.86957851 Si 9.50164242 5.66121040 0.03442886 -1.27274044 0.32745096 0.81651895 Si 9.45441994 3.81024987 1.85973418 -0.81120491 -0.44534399 -2.04933145 Si 7.60872533 5.72239391 1.90376043 1.94804436 -0.50780148 -2.60185465 Si 0.03126433 7.55521179 0.00850309 1.89527716 1.72389050 1.65601665 Si 1.92371323 9.49351527 0.02805747 -1.68928201 -2.24222502 1.78136069 Si 1.88532747 7.54291571 1.89628740 -1.43612553 1.84701115 -1.82217124 Si 0.02519102 9.44017887 1.85516346 1.84146649 -1.76171629 -1.26030913 Si 3.79541521 7.57257625 0.00985589 0.00381987 2.30717485 1.23008366 Si 5.69795455 9.46759735 0.00676525 -0.23222413 -1.36231031 1.31348708 Si 5.70494422 7.55271936 1.91724322 -0.65241405 2.64524374 -2.68980450 Si 3.76510323 9.44980615 1.90225773 0.28063818 -1.08152889 -2.49549168 Si 7.53691576 7.53645897 0.02289321 2.14976689 2.04760842 1.31425523 Si 9.45412000 9.47224923 0.03090815 -1.12360014 -1.16426763 0.98661204 Si 9.47356212 7.57081951 1.88077409 -1.89633084 1.95610114 -1.53848814 Si 7.53549830 9.45834947 1.86856770 2.07166021 -1.93185905 -1.28675323 Si 0.02057441 0.01968817 3.77033007 0.91264781 0.69825604 0.40850904 Si 1.88235758 1.91029121 3.76267043 -2.46849285 -2.44224417 0.54429560 Si 1.86646348 0.02981405 5.67123220 -2.13621152 0.79070337 0.21517390 Si 0.00648769 1.89221046 5.68088573 0.71246759 -2.30196179 0.02922984 Si 3.77104947 0.03097314 3.77023168 0.10984300 -0.09158553 0.56580346 Si 5.69035504 1.88381048 3.74843424 -0.10363427 -2.95609591 0.45742557 Si 5.69749192 0.01624513 5.65458776 -0.09423620 0.10642624 0.34192414 Si 3.81054183 1.91264524 5.68377285 -0.14183495 -3.80926243 0.12589973 Si 7.57355645 0.02458034 3.80184244 2.70448332 0.90405471 -0.45462270 Si 9.48970241 1.91235688 3.76184828 -1.35151964 -2.47173985 0.17374918 Si 9.47162805 0.02732752 5.66405221 -0.99377651 1.06823518 -0.15385730 Si 7.58871256 1.89238372 5.67152211 2.49382828 -2.12650827 0.02289601 Si 0.00742415 3.80619846 3.75964688 0.11234504 0.00409663 0.54207990 Si 1.88174715 5.69951332 3.81213117 -3.02966403 -0.25912568 -0.01414900 Si 1.91802871 3.75132600 5.70589640 -3.74996870 0.55296564 -0.47570158 Si 0.03008925 5.70231776 5.74589066 0.03642499 -0.24355371 -0.71997977 Si 3.75807692 3.76038604 3.81745575 0.38027633 0.44742588 -0.49410476 Si 5.71605252 5.65508730 3.76546239 -0.65568428 0.41628190 0.20137373 Si 5.67399304 3.75355114 5.63401706 0.04820388 0.42872139 0.42853407 Si 3.78985262 5.66890469 5.69282609 0.04754978 0.20966685 -0.29666706 Si 7.55055410 3.80776414 3.78792680 3.86517588 -0.28959992 0.11731955 Si 9.43965041 5.71158165 3.79879657 0.38702292 -0.45983022 0.07743145 Si 9.49040300 3.77865236 5.65218068 -0.57523247 0.01309880 0.49502328 Si 7.57835829 5.68953083 5.69786511 2.77333607 -0.34130075 -0.14585098 Si 0.03188301 7.59866703 3.78642634 0.41104480 2.10859568 -0.15985716 Si 1.88920892 9.46053764 3.81086496 -2.20709801 -0.60614696 -0.55521708 Si 1.88303235 7.60770999 5.64242418 -2.25541356 2.02059333 0.80921378 Si 0.00467018 9.48166686 5.64732463 1.08468386 -1.26914470 0.42426764 Si 3.75328182 7.56733228 3.77909976 0.53020430 3.20922270 0.01988226 Si 5.71591438 9.47633504 3.77598535 -0.36029131 -0.31518829 0.37394452 Si 5.67926721 7.55530794 5.67314239 0.05627908 3.27570781 -0.10003289 Si 3.78183646 9.44181864 5.67650643 0.08979098 -0.10591771 -0.06526634 Si 7.58577292 7.56522809 3.83086817 2.06142767 2.70217572 -0.61181044 Si 9.47737326 9.48158449 3.79622025 -1.41071267 -1.30872756 -0.27650814 Si 9.43858887 7.54178295 5.63133619 -0.53868645 3.06438003 0.86802293 Si 7.56125474 9.47624608 5.65808741 2.54987828 -1.16215020 0.51780748 Si 0.00549649 0.00073903 7.56996433 1.84334125 2.12671590 1.49098564 Si 1.88433360 1.91879213 7.54342295 -1.27966720 -2.24067242 2.13325274 Si 1.87084138 0.01000465 9.42906844 -1.40608161 1.91341705 -1.76452540 Si 0.00112332 1.91649651 9.45123515 1.82840128 -1.93209805 -1.90289479 Si 3.82258626 0.00333984 7.60540783 -0.36594312 1.18288412 2.22378900 Si 5.67401755 1.90859157 7.56780763 0.05244974 -2.47752763 2.64161028 Si 5.70169415 0.00325775 9.45269032 -0.19955026 1.22356724 -1.24237631 Si 3.78510226 1.90379510 9.49342241 0.08641756 -2.49411139 -1.47712427 Si 7.59442483 0.02075285 7.53963252 1.46526837 1.89960898 2.16015949 Si 9.49523573 1.88586060 7.58705592 -2.18558636 -1.52431221 1.45695803 Si 9.46799105 0.01423182 9.48532373 -1.38282499 1.31392309 -1.30456268 Si 7.54911147 1.91215267 9.48558505 1.89008441 -1.92518259 -2.05159394 Si 0.02660527 3.78302404 7.55690232 0.40488634 0.03522237 2.46265168 Si 1.88110359 5.67765053 7.60128318 -2.05869491 0.33215708 1.98241924 Si 1.86603612 3.79496548 9.43950546 -2.04456054 -0.10692690 -0.74815555 Si 0.03279046 5.71063122 9.47156455 0.77119049 -0.28283982 -0.98720036 Si 3.77236084 3.81681115 7.55471498 0.17688805 -0.44907916 3.59111636 Si 5.69637118 5.65622786 7.55234476 -0.10016020 0.30781558 3.72501070 Si 5.63076661 3.80447937 9.47773994 0.54262352 -0.05764188 -0.44297784 Si 3.74738967 5.65045194 9.48824795 0.59203318 0.55525824 -0.36427074 Si 7.55483907 3.76674981 7.57458094 2.80853033 0.08540962 2.48343436 Si 9.45277453 5.70739964 7.53735735 -0.89468314 -0.28341293 3.09034859 Si 9.43944391 3.74833365 9.43553448 -0.98265415 0.52014439 -1.09489154 Si 7.58809413 5.67172329 9.48292508 2.25693508 0.09576968 -1.41658133 Si 0.00563723 7.55946042 7.59278278 1.62992277 2.15498196 1.49045083 Si 1.87409508 9.44930207 7.58617831 -1.44006790 -1.83464523 1.56329694 Si 1.86974580 7.57210504 9.49788197 -1.21444602 1.86344623 -2.06131443 Si 0.01807038 9.49449344 9.49169037 1.12263948 -1.23130521 -1.17303384 Si 3.79043496 7.55306214 7.54970456 -0.11529723 2.67642292 3.22713003 Si 5.68806365 9.45859214 7.55823052 -0.20086685 -0.95573775 2.43138476 Si 5.69113223 7.60570325 9.46320787 -0.40860174 1.78515159 -1.37004282 Si 3.76820386 9.48503916 9.46487415 0.23287851 -1.48927834 -1.50014739 Si 7.53866247 7.55436393 7.57976723 2.36184815 2.31006393 1.75196287 Si 9.50171996 9.50075138 7.56945461 -2.69979338 -2.76503790 1.70747435 Si 9.49383017 7.56892349 9.50208846 -2.63595912 1.79673900 -2.74386014 Si 7.54203851 9.48370787 9.45063173 2.20901954 -2.16381780 -1.98098689