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=13.580774858964237 stress="-2.5162731603923842 0.3024650365644104 -0.945616548275917 0.3024650365644104 -2.831586564976344 -0.7437983530110486 -0.945616548275917 -0.7437983530110486 -4.255738298085033" pbc="F T T" Ni 0.02031036 0.18745344 0.23996280 -34.24216458 -4.67112399 -26.57526828 Ni 1.37970777 1.77711528 -0.12128882 20.95309362 -20.89215913 -11.68399515 Ni 1.25213077 -0.26874888 1.21824351 33.97604828 15.47772222 33.13932075 Ni 0.13616082 1.26429260 1.62968218 -20.68697732 10.08556090 5.11994267