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=9.266453381315184 stress="-14.166026370630382 -1.8312471866875848 0.5148618248388068 -1.8312471866875848 -12.158159255647549 -0.9322055194976411 0.5148618248388068 -0.9322055194976411 -17.852623014211474" pbc="F F F" Mg 0.03369179 0.02598936 -0.27670350 -5.46986752 -5.22484073 -5.82195094 Mg 1.46375436 1.40583543 -0.24440284 5.00477489 5.53668191 -4.96335074 Mg 1.20178472 0.29874826 1.27290972 5.36001098 -4.64401557 6.23138205 Mg -0.11909813 1.36136659 1.55835534 -4.89491835 4.33217439 4.55391963