4 Lattice="3.25 0.0 0.0 0.0 3.25 0.0 0.0 0.0 3.25" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-13.815921301082469 pbc="F T F" Nb 0.14093619 0.03140953 -0.00773330 41 -23.40490384 -3.77837067 -19.36043178 Nb 1.67585060 1.56396683 -0.14047807 41 19.13672094 3.36132513 -8.73243980 Nb 1.62541301 0.07978990 1.69651201 41 13.99313045 -1.14810730 14.02327109 Nb -0.07250553 1.60349175 1.72973562 41 -9.72494755 1.56515284 14.06960049