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=-2.252475429366012 stress="-0.6200678603778504 0.012288961678511847 0.14364924181341013 0.012288961678511847 -1.0947495394500295 -0.048177310410326524 0.14364924181341013 -0.048177310410326524 -0.8699253668178946" pbc="F F T" Be 0.10170120 0.00082602 0.24624097 -4.00443244 -11.65515482 -8.22396715 Be 1.64302402 1.35498893 0.11042859 7.63376640 8.45438373 -12.68812135 Be 1.70947124 0.05280714 1.41333883 3.32485596 -8.70520974 9.36953135 Be 0.15488783 1.55988540 1.20245745 -6.95418992 11.90598083 11.54255715