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=235108.598089858 stress="-869389.5825198637 -74897.79713689745 -202848.07124337798 -74897.79713689745 -1110709.9405986024 161414.52064186893 -202848.07124337798 161414.52064186893 -845662.4251818885" pbc="F F F" Xe -0.16548349 0.10535810 0.39397009 -13608.63268141 -6016.73959862 -4090.86803556 Xe 1.33268130 0.76741069 0.84410269 13015.71893584 5789.01873932 3587.24029810 Xe 1.64919348 2.61204406 -0.17773131 59.35152158 615.78070159 -457.08793268 Xe 2.98134164 4.07917266 1.28232034 1252.89799438 -1562.10178899 -4035.78162008 Xe 2.24217325 -0.14702596 2.47687593 -13867.40542044 -12473.21503426 -9354.76681022 Xe 3.35961812 0.78492223 3.26964376 13757.40693019 11939.18740695 9602.66476938 Xe 0.05236494 2.39055695 2.67204097 -66.69963594 1.50575361 -43.94083901 Xe 1.55604684 4.07636534 3.99475015 -161637.82909719 294894.71502383 -151209.13467176 Xe 5.70088882 0.54050247 -0.00117644 -114.71275982 -98.40429691 -216.00700292 Xe 6.66337300 1.36674795 1.94832907 -3859.02927256 3693.28015238 -1502.07782814 Xe 7.86277397 2.52887429 0.13407940 -6392.29127734 -8611.48625112 -8477.54939143 Xe 8.67164286 3.61541692 1.18479006 6502.34751730 8613.10194236 8346.13972029 Xe 7.93908890 0.17473801 2.50606904 1881.36917017 -6379.12664664 -1460.45691023 Xe 8.78110695 1.23326230 3.78594819 6285.83002170 -596.60720410 -3064.04233277 Xe 4.69020290 2.57777497 2.77741105 -650.98110341 -246.77269616 -750.36441000 Xe 6.02074724 3.51099541 4.05570660 967.48186922 435.41456711 449.07388039 Xe -0.30622799 4.99586385 0.35582450 -130.93387744 -81.25130766 -96.30632085 Xe 1.36826737 6.12442926 1.63175822 -147.50739200 -678.85881459 -72.73372050 Xe 2.29345274 7.29085015 0.09374850 -184.06538239 15.00715182 -1054.77406091 Xe 3.61643991 8.32327578 1.40123177 -118209.86397157 72831.59058982 -80056.09695642 Xe 2.49628893 4.73932125 2.95902960 29953.71295856 23103.51630027 -30336.05895540 Xe 4.14193657 6.14159098 3.05157904 -655.07054734 -3068.86255635 2033.25776796 Xe 0.57718541 7.76939185 2.70660126 -136.18533089 -891.90543238 -2968.72601213 Xe 0.46670815 8.56634079 4.42105497 -380.61916505 1965.94841175 3115.83082038 Xe 5.62134983 5.36716718 -0.09774872 -303.39605614 -321.79106022 -552.77492795 Xe 6.55001050 6.34881552 1.57847405 -48427.52349342 41236.25333241 -39142.15386076 Xe 7.03909150 8.34588795 -0.26436668 -122.94706511 -28.43043758 -165.59930123 Xe 8.55875820 8.93086425 1.45407384 132.09153666 54.14179263 144.11432521 Xe 7.52861623 5.52701693 2.37163078 46422.30126189 -43077.63698957 36487.46045697 Xe 8.53760724 6.38896908 3.68453127 4534.26727018 -417.97247063 1741.56249736 Xe 4.66448343 7.68403127 2.11226018 118838.62258749 -69126.39024735 77127.48897502 Xe 5.71516120 7.93281997 3.81358906 -4208.49211266 921.99253373 -489.35373010 Xe 0.49133878 0.41385920 4.50427763 -16510.47029540 -71043.48267362 -73258.31613494 Xe 0.72537574 1.42200066 5.54480565 16203.01864810 70726.90503510 73425.68432112 Xe 2.00297454 2.99791377 4.62151619 131996.69790962 -317702.69658132 184672.12906472 Xe 3.78243708 3.51836867 6.81092657 -17798.51633769 -14703.91343136 23900.92632879 Xe 1.72507306 0.26357726 7.58695412 -770.14007163 -273.25387102 -275.78119985 Xe 3.60175368 0.82109747 8.37957487 578.51288126 54.03447689 467.11707781 Xe 0.19188989 3.43113208 7.68280383 -276111.02333874 -159345.42844886 -164573.24455461 Xe 1.21823021 4.02325150 8.29514912 67652.12738088 -80001.72103721 354468.73813141 Xe 4.49937938 0.22198360 4.97615061 389.10455168 -240.16187391 619.34612754 Xe 6.48837336 1.00831489 6.43404765 -40433.31211980 65002.95294201 -35305.82197948 Xe 7.87610597 1.93808096 5.15118991 -17105.44786764 -47862.55144391 -42336.00100828 Xe 8.16214879 3.02171062 6.16224051 13642.16899003 51457.68541521 48020.90832765 Xe 7.20384740 -0.14918067 7.03810700 41195.88879379 -66716.01543035 34785.93783716 Xe 8.86711865 1.22502115 8.65084414 25.97915246 16.24728426 27.75167444 Xe 5.22865493 2.14039452 7.44921816 -951.66515304 -1000.99422154 -522.39700932 Xe 5.58029149 3.47117941 8.82796402 495.92752235 1754.10790713 1860.41479643 Xe 0.12004424 5.00042707 5.00682194 -1699.88806800 -159.66459246 501.40007018 Xe 0.46449589 6.83541913 5.87433342 11477.20078159 -16399.86462314 -20709.99582459 Xe 2.49308810 7.33652103 4.54899916 -378.16028936 -606.19647016 -971.04093279 Xe 3.44716409 8.23465428 6.12953737 511.03912208 629.70113515 955.65255647 Xe 1.96786264 4.88429939 7.61156932 208320.08562130 239433.12999236 -189818.97964767 Xe 4.41085560 6.10936237 8.54917825 -941.06020548 -937.80850390 1366.56102264 Xe -0.15088738 7.76766083 7.04035502 -11430.83826272 17174.16407074 21495.84697269 Xe 1.41851943 8.83337009 8.68242222 57.68083653 40.80397626 63.77698962 Xe 4.60675953 4.24865510 5.64950065 16909.03569470 15273.36546590 -24045.66995878 Xe 5.89974943 6.22892384 6.12165250 46729.83038185 -82494.44593873 -94746.51189866 Xe 7.42514645 7.72433644 4.45486603 3033.42372937 1873.67401393 3304.30822012 Xe 8.90918678 8.68770482 6.32374220 39.79554209 27.35853121 48.34682424 Xe 7.89864609 5.36253528 7.01114327 -212.72736288 -640.11263489 -1180.41140091 Xe 8.43271795 6.23545638 8.76561610 396.39918846 643.61490051 1298.20456700 Xe 5.39757659 7.11536967 7.13716159 -45815.70304078 83573.60968045 93410.31391528 Xe 6.35328338 9.02988149 8.99820222 5.82175197 14.05538282 12.62884454