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=39.50634536045347 stress="-2.5141850008686997 -0.2828012936803003 -0.27922740679267216 -0.2828012936803003 -3.622536331318542 -0.11153667966349656 -0.27922740679267216 -0.11153667966349656 -4.4804293505074995" pbc="F T T" Cd 0.02031036 0.18745344 0.02015752 -22.14370786 3.40457973 6.18371571 Cd 1.37970777 1.77711528 -0.12128882 30.18387211 -25.38993554 -3.07201630 Cd 1.25213077 -0.26874888 1.21824351 24.89544992 35.48808277 10.82083152 Cd 0.13616082 1.48409788 1.62968218 -32.93561417 -13.50272697 -13.93253093