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=615.319270894 stress="-6613.511071465645 -6685.350379712121 1031.5892667886199 -6685.350379712121 -6797.45717634835 1050.233911364282 1031.5892667886199 1050.233911364282 -176.53238997492147" pbc="F F F" Nb 0.00003141 0.26741370 0.19307059 -14312.81738868 -14511.53612231 2227.11830865 Nb 1.26703360 1.55191908 -0.00540895 14312.10031952 14509.35359626 -2253.70362930 Zr 1.15407992 0.38136590 1.67966896 28.65947466 -27.70820510 18.12127396 Zr 0.21443710 1.32032136 1.43369298 -27.94240550 29.89073116 8.46404668