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=-7.70712023057 stress="-0.0768726885241793 0.024683223604775168 0.26439579429126064 0.024683223604775168 -0.12026141833018693 0.16215598410432222 0.26439579429126064 0.16215598410432222 -0.17043755481148695" pbc="F F F" Fe -0.04210664 -0.11174318 -0.22958397 0.56908310 0.17877469 0.20083557 Fe 1.69178619 1.67895518 0.29140871 0.67543466 0.53569431 -1.27801480 Fe 1.61455359 0.03253581 1.64904689 -0.48905303 -0.66213002 0.38465454 Fe -0.21908774 1.60609294 1.27202022 -0.75546473 -0.05233898 0.69252470