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=-1.2666177603060509 stress="-0.5782306329960779 -0.0007640456201828857 0.011277863735547174 -0.0007640456201828857 -0.996280136799768 -0.028430624975670192 0.011277863735547174 -0.028430624975670192 -1.0228668048116276" pbc="F T T" Ni 0.27711528 -0.04800945 -0.24786923 -8.20850352 -1.25224900 2.27106852 Ni 1.23125112 1.21824351 0.13616082 7.79188448 2.95849378 1.47212468 Ni 1.26429260 0.12968218 1.71980528 8.46877525 -2.86517787 -1.68404013 Ni 0.29977655 1.55969664 1.45460942 -8.05215622 1.15893309 -2.05915307