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=-4.224062407435094 stress="-0.5370226349513437 -0.05415532654453428 -0.19854302413866515 -0.05415532654453428 -0.6068400032440993 -0.20010689682458438 -0.19854302413866515 -0.20010689682458438 -1.6519507143372314" free_energy=-4.224062407435094 pbc="F F T"
Mo       0.00082602       0.24624097       0.30733484      -6.40207343      -5.80335421      -5.70605975 
Mo       1.35498893       1.61042859       0.19791189       6.43365599       6.08335217       2.26937495 
Mo       1.35512851       0.05280714       1.31305857       4.82591503      -5.60930746       1.46478686 
Mo       0.15488783       1.55988540       1.07611881      -4.85749759       5.32930950       1.97189794