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=-0.8704907543950587 stress="-0.9756766014481015 0.0845531935404822 0.06660727700149943 0.0845531935404822 -0.30896063391786927 -0.08775993492926558 0.06660727700149943 -0.08775993492926558 -1.0412878334875304" free_energy=-0.8704907543950587 pbc="T F T"
O       2.91446098       0.23956773       2.72557373       2.98123528      -3.71258066      -0.14917600 
O       1.40977949       1.36749164       2.94318902       1.61992591       2.86118085       1.07628590 
O       1.70902946       0.29708965       1.45874788      -0.49754460      -4.55450252      -2.21715713 
O       0.04052745       1.23417086       1.44170993      -4.10361658       5.40590233       1.29004723