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=-5.302829490575654 stress="-7.957776913066077 1.62929131849492 0.7928286711684942 1.62929131849492 -7.550363779754667 1.3185182621976441 0.7928286711684942 1.3185182621976441 -8.17928327899439" pbc="F F F" Ni -0.08950840 -0.27713580 -0.06141927 -1.90064662 -1.06221850 -2.11020779 Ni 1.25205420 1.65488783 0.05988540 2.41443377 2.39118948 -4.02003612 Ni 1.20245745 0.16431082 1.31425730 3.91980743 -3.89914676 3.39571475 Ni -0.01155935 1.53277713 1.39971974 -4.43359457 2.57017578 2.73452916