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=3.4270762767577847 stress="-0.16387050443418905 -0.002125263952987581 -0.11551627731710121 -0.002125263952987581 0.1381700114123879 0.1335378164672037 -0.11551627731710121 0.1335378164672037 -0.6254204523026868" free_energy=3.4270762767577847 pbc="F F T" N 0.21456242 0.27913633 -0.14736324 -0.80138415 2.30792144 -1.94491701 N 1.68492541 1.33178173 -0.11676220 2.42100553 -0.86612512 -1.28828193 N 1.26192411 0.12263099 1.54530481 0.63486483 1.05908808 4.66529908 N 0.12593290 1.34000708 1.31713836 -2.25448620 -2.50088440 -1.43210014