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=-149.3734526114282 stress="25.23786801164844 2.804116469647994 -0.4516151785663177 2.804116469647994 34.63603145464722 -0.2512729945601335 -0.4516151785663177 -0.2512729945601335 33.83579955001599" free_energy=-149.3734526114282 pbc="F T T"
Mo       0.21219253      -0.07514625       0.12990665     205.95015951     -66.42498038      50.22592529
Mo       1.28220450       1.68758231       0.06210000    -164.35047340      45.60271891      67.33334896
Mo       1.63362859      -0.17297059       1.44753934    -323.24316713     -76.39793792     -49.89865298
Mo       0.04852473       1.55473499       1.41561068     281.64348101      97.22019939     -67.66062128