16 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=2927.0325158063756 stress="-12541.74628450401 -6755.897315479451 -9822.560047686635 -6755.897315479451 -10439.359029885461 -6819.073412969434 -9822.560047686635 -6819.073412969434 -15872.290375215955" pbc="F F F" Bk 0.16352147 -0.19353581 -0.03295953 -20.36874907 -10.08977656 -15.61540586 Bk 1.61372066 1.49966229 1.79740139 -484.82250885 -307.28226659 -488.83257586 Bk 3.12011177 -0.08247577 -0.15045985 -27.21054235 -66.14032545 -80.67835435 Bk 4.30030451 1.44319182 1.58360165 480.58375496 350.69131203 -356.52790485 Bk 0.07051144 3.36831540 0.03342267 -396.82102368 -222.19943587 -306.16470437 Bk 1.73384982 4.32885096 1.30600166 -901.23661151 1410.27668230 -848.53989886 Bk 3.31722963 3.38340069 -0.19303455 -2282.30198459 -2646.27158741 -4233.90958495 Bk 4.23037671 4.30210124 1.25568934 2874.71329732 2678.67839911 3782.82042105 Bk -0.18894636 -0.04140783 3.03859379 -280.31356387 -297.90490435 -241.78291304 Bk 1.04859546 1.32336418 4.47582005 273.51995157 123.40351006 418.25541999 Bk 3.14732708 0.10470978 3.01837169 -178.31255119 -620.77884106 477.30245545 Bk 4.63785264 1.43930113 4.65384690 61.73128478 54.53505220 73.57627044 Bk 0.01888536 3.24473802 3.23393203 -4493.95345422 -3461.86022316 -4106.79008103 Bk 1.20739627 4.23044501 4.34951801 4151.35876359 3743.66447796 4276.13995073 Bk 2.72645286 3.21901898 2.78643470 1214.30318972 -736.75458615 1640.69674208 Bk 4.70971888 4.68389699 4.35273326 9.13074737 8.03251297 10.05016344