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:Z:I:1:forces:R:3 energy=3056.452925975924 pbc="T T T" Se -0.03136998 -0.05369362 0.03851086 34 -4016.23640338 -548.85121277 -3466.69896322 Se 0.89982991 0.49795387 -0.17070544 34 1360.71385224 1132.95083782 -1279.77331416 Se 0.53747849 -0.10523254 0.62993804 34 4087.39584512 -4650.27141766 1953.72440648 Se 0.28095696 0.57464588 1.01008946 34 -1431.87329398 4066.17179261 2792.74787090