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=-7.4196822831 stress="-6.79573119857581 -2.4858167524685206 0.6119242723887354 -2.4858167524685206 -5.0799679091486745 -0.1454009611541083 0.6119242723887354 -0.1454009611541083 -8.14880552886109" pbc="F F F" Mo 0.23171545 0.18190327 -0.17816502 -9.44635108 -8.80752574 -9.75737506 Mo 1.71219253 1.42485375 0.12990665 12.90645453 10.37929430 -7.64173981 Mo 1.28220450 0.28278197 1.56210000 3.39135702 -6.07888785 9.50583739 Mo 0.13362859 1.32702941 1.57034430 -6.85146048 4.50711930 7.89327749