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=3.588734384181839 stress="-65.28071464310796 -18.55884489794731 -4.938117884463825 -18.55884489794731 -50.713291940945 5.895813389425964 -4.938117884463825 5.895813389425964 -32.30480945721662" pbc="F F F" Zr -0.03036777 0.15586213 -0.09604453 -32.90821759 -26.06038595 -8.11297628 Zr 1.33226600 1.23049600 0.12036030 33.92938467 33.97485865 -11.81821970 Ni 1.31063118 0.24843919 1.64432661 13.41096305 -20.01841540 15.91211756 Ni -0.10404381 1.48237238 1.68778210 -14.43213013 12.10394270 4.01907842