16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-17.9682228532 stress="0.2641349834527918 0.037802489608041376 0.06695429808490828 0.037802489608041376 0.33051329700076204 0.0340907591483965 0.06695429808490828 0.0340907591483965 0.30812800882033947" pbc="F F F" Fe -0.14487149 0.05280714 -0.08666117 2.82593823 2.60010348 2.79785364 Fe 1.52762600 1.37241235 1.15056165 1.73349165 3.08847738 -1.75023907 Fe 2.91049160 -0.27713580 0.06960551 -2.68721481 0.45103867 -0.03088983 C 4.25205420 1.65488783 1.55988540 -1.08863005 4.18900641 2.51243650 Fe -0.29754255 3.16431082 -0.18574270 1.25682777 -2.97432832 1.02916647 C 1.48844065 4.53277713 1.39971974 1.94994516 -2.47856696 1.60869205 C 2.87366136 2.96097674 -0.21780693 -2.19204683 -2.63814674 2.19830701 Fe 4.71813893 4.26716069 1.69410236 0.42175508 -2.08287295 0.51202764 Fe -0.16903503 -0.11798803 3.03295842 1.94568706 2.01034597 -1.69443047 C 1.22002482 1.27696427 4.41661558 -1.46548092 -1.47121103 -1.46720134 C 2.96512192 0.22586561 3.29391194 2.04892759 2.26284534 1.56675071 Fe 4.22614529 1.52103145 4.27761356 -2.15836296 -1.87139715 -3.06192452 C 0.18220204 2.89362841 3.23573857 0.00000000 0.00000000 0.00000000 C 1.52724172 4.27538150 4.20296332 1.32537562 -0.90144020 -1.17598009 Fe 3.11008056 3.22083292 2.78984966 -2.28761597 1.41394107 0.41426562 C 4.48735431 4.42299150 4.40698366 -1.62859663 -1.59779496 -3.45883432