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=20762.815204471044 stress="-59621.8269479341 -430.7013221304933 -12242.21625881585 -430.7013221304933 -88115.87968688508 19453.51855600252 -12242.21625881585 19453.51855600252 -105088.73063029925" pbc="F F F" Nd 0.04847024 -0.21726400 0.27900824 -22628.96383729 -33439.92673678 -26970.33395691 Nd 1.51673611 1.20334954 -0.02911850 8844.02445242 41282.54771866 -47897.47091249 Nd 1.65751575 0.09229243 1.45873160 27784.42049954 -35070.05840784 53173.93577835 Nd -0.08939564 1.26379700 1.55124348 -13999.48111467 27227.43742596 21693.86909105