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=49.89825116203242 stress="-3.647036547044703 -0.075755982728783 0.10020018266846939 -0.075755982728783 -3.3175898468509035 0.35638788227629625 0.10020018266846939 0.35638788227629625 -5.927252810101499" free_energy=49.89825116203242 pbc="F F T" Se 0.19273990 0.05332204 2.88436473 -29.97419823 -39.20142334 17.27605454 Se 1.73110688 1.49816022 0.01283276 28.44744661 31.45233904 6.88878113 Se 1.70071341 0.14720807 1.58942344 38.29931537 -32.96713792 -7.92960125 Se 0.27559981 1.21321713 1.71736445 -36.77256375 40.71622223 -16.23523441