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=112.10099942267712 stress="-7.707170598877985 0.7121962466954114 -1.1668100517520497 0.7121962466954114 -11.809812725549557 -0.5734888234048567 -1.1668100517520497 -0.5734888234048567 -10.113590095109604" pbc="F T T" Au 0.28095696 -0.17535412 0.26008946 -126.01721501 33.94298418 -112.79143238 Au 1.37675974 1.32230465 0.28460712 92.85794747 -53.64393266 -73.34859457 Cd 1.25346517 -0.23227551 1.27715687 98.46580564 37.67721539 125.19540824 Cd 0.11893942 1.26883758 1.33885520 -65.30653810 -17.97626691 60.94461870