4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=5756.473309779195 stress="-998.2816511877943 461.1033957894829 75.57916901968821 461.1033957894829 -950.9411633443532 56.8937028451526 75.57916901968821 56.8937028451526 -708.8232075972431" pbc="T F T" Cf -0.02770132 0.11493595 -0.18237293 -3000.07698248 -4597.96034206 -1992.94412601 Cf 1.58898653 1.72897096 0.13444783 1282.47386677 4320.31860419 -3741.77073995 Cf 1.31863048 0.10088756 1.11893570 13825.29544517 -15346.97513898 1906.03913556 Cf 0.16088069 1.29811157 1.36121753 -12107.69232947 15624.61687685 3828.67573039