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=-11.345632467778856 stress="22.869126811269226 0.6456693393533237 0.6154313484514464 0.6456693393533237 20.39104609112554 -1.1100700043519058 0.6154313484514464 -1.1100700043519058 21.797997690122195" pbc="F F F" Mn -0.27713580 -0.06141927 -0.24794580 6.60053732 5.99536305 6.22223509 Mn 1.65488783 1.55988540 -0.29754255 -6.47110460 -6.01959365 6.60964952 Mn 1.66431082 -0.18574270 1.48844065 -6.32943532 6.72791403 -5.76676010 Mn 0.03277713 1.39971974 1.37366136 6.20000260 -6.70368343 -7.06512451