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=-78.27742475641675 stress="-66.30340414833094 -6.1920403472531955 -7.975952457867855 -6.1920403472531955 -53.75050782340982 -2.673730838678452 -7.975952457867855 -2.673730838678452 -70.77022043525983" pbc="F F F" Zr 0.18365717 0.20288723 0.08343331 -2.19916729 -2.36957026 -4.58721694 Zr 1.29585403 1.44809454 1.72094491 -0.08816966 6.26692862 -4.85736485 Zr 3.22965093 0.18190327 -0.17816502 -0.32899280 -1.37960579 -1.73358158 Zr 4.71219253 1.42485375 1.62990665 3.65591696 0.39901406 -1.46901151 Zr -0.21779550 3.56465436 0.06210000 -2.00479098 -0.72580268 -2.87814920 Zr 1.63362859 4.32702941 1.57034430 -0.52336948 9.19872641 -3.93090650 Zr 3.05853665 3.05473499 -0.08438932 -0.06609383 -1.48414941 -4.47517803 Zr 4.63661615 4.40480033 1.36172843 2.47595069 2.10651414 0.51569042 Zr -0.20130994 0.11041876 2.76735611 -6.14842438 -4.46498383 3.04871985 Zr 1.43703565 1.11942000 4.58611608 -1.04239950 1.06720460 4.63840834 Zr 2.75273565 0.02598936 2.72329650 3.71098158 -7.82855582 1.12404363 Zr 4.46375436 1.40666145 4.25559716 2.08201053 -0.41509405 3.36499681 Zr -0.29821528 3.54498924 2.77290972 -5.28803327 -1.08223362 2.63714114 Zr 1.52392589 4.36136659 4.55835534 -0.70657140 2.25833607 3.55427262 Zr 2.74645637 2.98193431 2.92001865 5.21342965 -2.71992059 3.90721628 Zr 4.55569096 4.31385818 4.25598017 1.25772319 1.17319215 1.14091952