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=116.58214907482287 stress="-10.53514305292007 1.0844517335761041 -0.5622979184808211 1.0844517335761041 -11.434277657360404 -0.024565430686322522 -0.5622979184808211 -0.024565430686322522 -10.987626339413008" free_energy=116.58214907482287 pbc="T T T" Cd 2.85540510 0.11115480 0.11044915 33.26252981 -36.92031537 -8.69772537 Cd 1.70960170 1.31143450 2.83833517 -53.44279246 17.13475881 6.76227994 Cd 1.28829595 2.71189181 1.64041416 -7.94873251 17.59055829 -13.04657034 Cd 2.77812781 1.47773705 1.32834452 28.12899516 2.19499828 14.98201576