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=87037.3249233577 stress="-13822.802257392903 3050.60882622549 -8395.595712597085 3050.60882622549 -9081.916299946119 -1738.2254690166371 -8395.595712597085 -1738.2254690166371 -16212.655078219068" pbc="F F T" Tb 0.13709659 0.05358858 0.20329209 -185030.10987937 -42618.55181383 -177470.15160295 Tb 1.40430859 1.70538023 0.09507746 78157.49994531 34105.69846454 43480.13468448 Tb 1.21727905 0.14745835 1.46700198 266686.81506341 -127187.40663367 161022.00174623 Tb 0.22405307 1.53343310 1.73522695 -159814.20512935 135700.25998296 -27031.98482776