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=-49.10148662003355 stress="-125.3034510403463 13.166882695294454 -7.843663475144666 13.166882695294454 -107.2656682968879 -21.075883718468504 -7.843663475144666 -21.075883718468504 -118.74772689990589" pbc="F F F" Zr -0.08129564 0.04860922 0.20118821 -2.18796477 -0.95223472 -2.02294986 Zr 1.70960170 1.31143450 1.33833517 -10.05245597 12.46077179 0.77099311 Zr 2.78829595 -0.16490224 0.14041416 7.11630967 -10.99075285 -9.92876919 Zr 4.27812781 1.79098848 1.26215777 9.53893702 -5.17379145 1.57134279 Zr -0.12320595 3.09027739 0.20259391 -6.59021073 -2.80653704 -3.91446010 Zr 1.56504129 4.20865944 1.36550211 -16.98403052 23.63337165 9.63104261 Zr 2.78802619 3.22277084 0.18584377 11.85742955 -6.74923924 -23.08204595 Zr 4.40955323 4.48086654 1.83050726 4.11478814 4.07032352 -0.93443345 Zr 0.26959405 0.17626233 2.85402479 -4.94928250 -2.48629692 3.63063789 Zr 1.91285063 1.57550460 4.65300231 -1.92212517 -1.62453625 5.08734917 Zr 2.83433719 -0.04225341 2.86661612 4.92581970 -7.92750502 5.48043801 Zr 4.45789336 1.60920173 4.27041603 3.38657521 -1.32393456 1.40229113 Zr 0.19178619 3.41067064 3.47331198 -16.08445581 -10.96296530 -10.79267125 Zr 1.43638857 4.53253581 4.64904689 11.66807555 12.53355941 12.86039158 Zr 2.78091226 3.10609294 2.96603997 5.37656420 -3.28017698 8.59155538 Zr 4.51817278 4.24642973 4.64352264 0.78602641 1.57994395 1.64928812