16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=188.89674523660753 stress="-0.004174179093517124 -0.00018899394059233962 -0.0003100547959294591 -0.00018899394059233962 -0.004153204769334289 -0.00020897684039235904 -0.0003100547959294591 -0.00020897684039235904 -0.004145994373631092" free_energy=188.89674523660753 pbc="F F F" P 20.91986395 20.74396547 21.09073906 -5.26708330 -6.11340624 -6.35061758 P 22.77219963 22.43381326 22.63132919 -18.22380644 -16.20960157 -18.83803157 P 24.25978669 20.72592512 20.78504734 3.15851923 -7.55138518 -8.42734028 P 25.68365717 22.70288723 22.58343331 27.34812617 -8.65173733 -8.19776620 P 20.79585403 23.82899641 21.22094491 -9.84423967 3.51784713 -12.77468020 P 22.73171545 25.68190327 22.32183498 -13.81391513 19.50719000 -5.57680570 P 24.07355912 23.92485375 21.12990665 3.85764598 2.84244308 -29.75400622 P 25.28220450 25.78278197 22.56210000 16.97511403 15.19097818 -6.17056456 P 21.13362859 20.82702941 24.07034430 -11.31075128 -13.13708762 4.21484097 P 22.60688008 22.55473499 25.41561068 -6.89220397 -4.15744527 23.88219525 P 24.13661615 20.90480033 23.87719504 6.70708574 -27.34662869 4.36862639 P 25.29869006 22.61041876 25.26735611 19.66352449 -3.64515806 21.70666388 P 20.83533445 23.74148635 23.83257245 -18.59566808 6.04893951 6.40040736 P 22.53369179 25.52598936 25.22329650 -9.29891061 11.78962515 11.82070397 P 23.96375436 23.90583543 23.75559716 5.61405284 19.36330493 12.88864141 P 25.20178472 25.79874826 25.27290972 9.92251000 8.55212198 10.80773308