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=-8.99196914377067 stress="-0.06099525665766316 0.05558211592912781 0.006728732640157571 0.05558211592912781 -0.15588855886316433 -0.042228609143560754 0.006728732640157571 -0.042228609143560754 0.2825473985843996" pbc="T F T" H 0.00531388 0.18840780 0.31362555 0.02020113 0.09691316 0.05428557 H 1.43211553 1.41165276 0.21282567 0.00772012 -0.05129735 -0.07155713 Ni 1.42866320 0.18883157 1.49955875 1.17109469 -3.43727335 -0.95748550 Ni 0.04313966 1.44832183 1.75980354 -1.19901593 3.39165754 0.97475706