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=128.1553783381067 stress="-10.95484631284886 0.13270115930242718 2.327635606198795 0.13270115930242718 -11.045206286283117 1.7572700388689015 2.327635606198795 1.7572700388689015 -17.280136916259202" pbc="F F T" Mo 0.29874826 0.05835534 -0.25354363 -104.99112898 -112.35891834 7.36798551 Mo 1.48193431 1.42001865 0.20070203 122.04068917 119.00338979 -71.85528356 Mo 1.20342959 0.28187239 1.36500085 134.35656800 -132.24253595 31.65847457 Mo 0.10170120 1.37793365 1.21904386 -151.40612820 125.59806449 32.82882348