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=19.2638212662 stress="-14.221385685001106 0.20675624549717725 -0.5596211115065535 0.20675624549717725 -10.369058113117811 -0.04000832957932649 -0.5596211115065535 -0.04000832957932649 -14.3124106771835" pbc="F F F" Se 0.04852473 0.05473499 -0.08438932 -21.37186833 -14.43481245 -24.79640747 Se 1.63661615 1.40480033 -0.12280496 14.80568645 17.82233639 -15.02668827 Se 1.29869006 0.11041876 1.26735611 25.32234659 -20.42285715 23.70030442 Se -0.16466555 1.24148635 1.58611608 -18.75616471 17.03533320 16.12279133