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=106.069869692285 stress="-187.74926396088057 -15.216783956137526 -24.375142807793296 -15.216783956137526 -194.07222433190108 15.818977888275114 -24.375142807793296 15.818977888275114 -199.40799970857273" pbc="F F F" Se 0.17061300 0.29169807 -0.03136998 -102.77085638 -49.65393070 -100.61333533 Se 1.44630638 1.53851086 0.14982991 77.97968880 89.42339065 -33.86236863 Se 1.24795387 -0.17070544 1.28747849 70.28567827 -81.16418443 77.34903655 Se -0.10523254 1.37993804 1.78095696 -45.49451069 41.39472448 57.12666741