32 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=-92.4605290555 stress="0.08601616670555247 0.08085777786048122 -0.2547018377185734 0.08085777786048122 -0.20777915667064364 -0.25649937777287946 -0.2547018377185734 -0.25649937777287946 0.19876039615561633" pbc="F F F" Fe -0.16305859 0.29004398 -0.26612504 -1.33363463 -2.01207561 3.14109315 Fe 1.33796632 1.56603388 0.00693356 4.02265787 -10.65942806 -10.97492148 C 1.66501753 -0.01352205 1.42866320 0.36272999 -0.03471348 7.95882065 C 0.18883157 1.67827349 1.54313966 2.57749615 -2.49088780 3.13943327 C 3.13936952 0.22831344 -0.03332758 0.58938049 2.16811459 2.72786885 C 4.77143892 1.35578961 0.10338854 -2.97701886 -0.09373881 5.19168965 Fe 4.74759167 -0.10628532 1.42518197 -2.16366319 2.39478251 -3.54687907 Fe 2.74663523 1.48702489 1.44857885 17.62218781 -26.91954692 0.61260224 Fe 0.18843096 3.17061300 0.29169807 -9.68329299 1.56803054 -10.76550556 C 1.46863002 4.44630638 0.03851086 4.80695642 -3.60323934 7.13064728 Fe 1.64982991 2.74795387 1.32929456 -12.65582531 20.65101962 5.68035800 C -0.21252151 4.09549705 1.37993804 0.66406184 3.90270210 8.80811691 C 3.28095696 2.83693978 0.26008946 -14.56416127 -3.91101278 -13.42274798 Fe 4.22304388 4.11292217 0.52799990 4.30954595 9.76183982 -1.72492138 C 4.25346517 2.76772449 1.27715687 14.41864715 -10.05238852 14.82930223 C 2.74014891 4.14355227 1.32743118 -8.25081517 5.27504036 -3.67461410 Fe -0.20453718 -0.29059379 3.03632024 6.66806921 4.46714058 -1.42275279 C 1.22956938 1.33885520 3.03926819 -2.65893035 3.41825631 -4.18832050 C 1.73010044 0.09566688 4.62528982 9.21421634 1.11166645 -14.67757359 C 0.27127097 1.82632862 4.71182891 -1.52511777 2.21983624 -1.59658362 C 2.55718278 -0.26758015 3.07255377 -12.02495001 5.24946648 1.77718423 Fe 4.65656166 1.51258782 3.20717378 -0.92194441 -3.02841761 -1.64037462 C 4.30454100 0.12365747 4.53386486 -8.43464596 9.51788654 -0.62100521 C 2.95297513 1.34681875 4.63493612 5.68242426 -9.37579101 -2.33718864 Fe 0.04737131 3.03238783 3.24404962 -3.77819157 -7.81060427 -7.99162321 Fe 1.36810690 4.62937675 2.75818085 2.50949904 2.89442808 -2.48465857 Fe 1.59119645 2.79640878 4.70965477 8.86810872 -3.20753197 1.30809548 Fe 0.31012966 4.35263676 4.68492541 -0.81457231 4.78027844 5.53371759 Fe 2.83178173 2.88323780 2.76192411 5.90583080 5.41784905 14.06781370 Fe 4.65536770 4.26260376 3.12263099 -0.95244899 3.22985388 -5.80217305 Fe 4.54530481 3.02372722 4.62593290 -3.86917082 -1.65857006 7.55010293 C 2.76589471 4.39901191 4.41812645 -1.61342844 -3.17024535 -2.58500277