32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=4153.510428977933 stress="-17035.91708264144 -1680.356491212956 1337.2313152482207 -1680.356491212956 -20079.252064930664 -781.2274475473387 1337.2313152482207 -781.2274475473387 -19697.089075588225" pbc="F F F" Li -0.02140349 -0.17287050 -0.18625241 -381.60045548 -420.04283989 -24.92249923 Li 1.17895100 1.11829546 -0.15733827 395.54460765 420.91986309 -25.72250632 Li 1.56514789 -0.14682168 1.61537975 -21.92035933 -52.41436510 -45.47218076 Li -0.12281074 1.17799850 1.57100310 -61.00020117 46.54377874 -97.21568223 Li 3.30631554 -0.02416568 -0.03923790 -1455.67100475 -136.77248234 -1761.21210545 Li 4.60820741 1.48225611 0.44798701 311.28837352 989.62662828 -848.85019542 Li 4.30938603 0.03843313 1.19395166 1294.92267743 -1250.27045638 2223.13079065 Li 3.15111220 1.27643213 2.03605153 -449.24520554 656.10944567 -576.19965428 Li 0.12516080 3.29481292 0.00830433 145.39125236 -1243.00973982 -1459.94378140 Li 1.87779416 4.52731399 0.28968673 -665.84611348 1725.02835567 -696.14125074 Li 1.66744515 3.16633828 1.24818280 -500.94270773 -1181.88631383 833.88039164 Li -0.08976710 4.35512299 1.20398278 -311.98150889 1251.54947824 1393.77977380 Li 2.93609062 3.26246664 -0.04445597 855.91489910 -849.84814595 -501.57453712 Li 4.47232256 4.54780647 -0.03638096 70.95845973 58.39503292 -0.67522173 Li 4.56122565 2.80104530 1.71424115 728.55139751 136.66951595 -444.59403504 Li 2.91368249 4.40848773 1.79658037 1078.90558735 1083.37469142 -1491.37688786 Li -0.03069261 -0.02388104 3.16696149 -841.07216784 -4401.66549045 -4248.68201629 Li 1.22316273 1.52205133 3.23611286 2783.06916026 1041.59274098 -2424.58814893 Li 1.56375401 0.24145945 4.64628946 198.24617445 -1515.47212901 679.61674507 Li 0.15179956 1.00567103 4.20809808 -2781.09917765 3578.01844155 6297.30642529 Li 2.97670359 -0.07254225 3.09669218 -105.94230670 -720.79401099 345.17804553 Li 4.73431360 1.21412189 2.88993496 558.49887804 831.27644877 -925.42723054 Li 4.57207430 0.25157265 4.20516969 -37.51884327 -885.75016556 1284.42285003 Li 2.72451553 1.40057690 4.37065427 1047.16576563 849.38538339 3.13774171 Li -0.09925656 2.66804469 3.01124292 -419.67374336 444.48227837 -67.37621978 Li 1.57210011 4.66128354 2.70470779 -1207.18200818 276.07647433 832.77561278 Li 1.89600094 3.18259464 4.54239734 -735.68872521 -647.47299047 52.56409161 Li 0.42916318 4.60751823 4.47440140 -68.75497365 44.59876792 32.22516894 Li 3.29536560 3.15653280 2.78542886 -592.09893388 -1237.32383533 1423.42272382 Li 4.35611673 4.59807488 2.98045328 469.64488355 487.74031121 -11.60123436 Li 4.55421043 3.47954180 4.52479401 849.66038860 -597.61236584 164.66338848 Li 3.10493973 4.35857274 4.51275907 -150.52406906 1218.94769446 85.47163814