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=3.7776341173482746 stress="-0.6652273118284603 -0.3315374554331949 0.02344911068333086 -0.3315374554331949 -0.1707701184938868 -0.01926342945773729 0.02344911068333086 -0.01926342945773729 0.07985654233374148" free_energy=3.7776341173482746 pbc="T F F" N 0.11018303 0.18843096 0.17061300 -4.80343616 -2.37845003 0.85852946 N 1.79169807 1.46863002 0.03851086 4.17588661 1.20768774 1.01258758 N 1.64982991 0.28095696 1.32464588 -2.60978611 -1.52715658 -1.32076797 N 0.26008946 1.37675974 1.07576983 3.23733566 2.69791887 -0.55034906