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=11101.697248502911 stress="-46116.79113605723 -21232.706584644977 -13698.546225664491 -21232.706584644977 -50191.198162655215 3461.58542071168 -13698.546225664491 3461.58542071168 -39291.96028276694" pbc="F F F" Ho 0.26594084 0.00337897 0.04218822 -31504.36470995 -29742.25096903 -15807.88612145 Ho 1.32680296 1.48517660 -0.20462667 18644.94753717 27576.92746509 -9700.04509429 Ho 1.45134888 0.22657099 1.48353494 19851.39320794 -4508.98251714 21569.71111551 Ho -0.13524351 1.55172593 1.51707082 -6991.97603516 6674.30602109 3938.22010023