32 Lattice="7.080895214762712 0.0 0.0 0.0 7.080895214762712 0.0 0.0 0.0 7.080895214762712" Properties=species:S:1:pos:R:3:forces:R:3 energy=-97.97458272012902 stress="-0.00818290814042394 -0.0005285780481555889 -0.0015731473405528112 -0.0005285780481555889 -0.00747666877739791 -0.0009144919342680231 -0.0015731473405528112 -0.0009144919342680231 -0.007512029148124482" pbc="F F F" Fe 0.00893106 0.03062722 0.02071687 0.15134150 0.28912972 0.19995423 Fe 1.77144898 1.78629803 0.00446353 0.09939973 -0.09878399 -0.28799960 Fe 1.75846346 0.02385052 1.75651486 0.14691353 -0.37098949 0.07324783 Fe 0.00561558 1.80330975 1.79745758 -0.36790916 -0.22810307 -0.07218896 Fe 3.56027205 0.02560899 0.00884292 -0.12855282 -0.04995367 0.07306629 Fe 5.29674412 1.73928420 0.01710839 -0.00897761 0.25551119 0.08756287 Fe 5.30284326 0.01550054 1.81802481 0.00849543 -0.09299458 -0.06337819 Fe 3.54524227 1.78024243 1.80283057 -0.23642659 -0.16106572 -0.22926204 Fe 0.03536631 3.51576626 0.02833255 -0.16636931 0.04592462 -0.19764484 Fe 1.77986422 5.28884597 0.03283733 -0.05927049 0.22074351 -0.20749222 Fe 1.75930700 3.56888451 1.78531694 0.16100550 -0.48526886 0.26091404 Fe 0.03059116 5.28737010 1.76394312 -0.17228455 0.12198879 0.12604753 Fe 3.51594197 3.56836580 0.03146097 0.34393768 -0.16527821 -0.44779167 Fe 5.34231164 5.31150374 0.00699734 -0.41440805 -0.35394442 0.41407740 Fe 5.27786326 3.53624479 1.79543166 0.61759886 0.16199273 -0.34714326 Fe 3.51325475 5.28298289 1.80105088 0.44194283 0.61126347 -0.15330972 Fe 0.03239770 0.01445294 3.56068964 -0.18595811 -0.11898476 -0.16794113 Fe 1.76425720 1.74773487 3.56815553 0.21389933 0.20821357 -0.14035831 Fe 1.75041570 0.01115953 5.31620090 0.20511972 -0.05332388 0.15595673 Fe 0.00082088 1.74648976 5.32314778 -0.10182872 0.14443113 0.03306267 Fe 3.56700219 0.01477494 3.59484925 -0.19329005 -0.35649341 -0.12643453 Fe 5.32928274 1.77440668 3.53352617 0.48982500 -0.12045694 0.15746132 Fe 5.34445121 0.01326082 5.28082013 -0.11837616 0.23468502 -0.17107092 Fe 3.57303196 1.77616445 5.34304142 -0.16580911 -0.14750897 0.29347794 Fe 0.00515232 3.54097521 3.55623690 -0.40637049 0.17733129 0.11068367 Fe 1.79945569 5.33329481 3.52785614 -0.30864461 0.27706581 0.23326546 Fe 1.74833112 3.53467308 5.27616977 0.19448625 0.11955851 0.40382631 Fe 0.02317128 5.32967440 5.32206465 0.33910606 -0.25137709 -0.32977145 Fe 3.57423706 3.51392185 3.53662144 -0.44682762 0.21359416 0.30237624 Fe 5.32141584 5.31113483 3.55119214 -0.13159622 -0.02065755 -0.00289679 Fe 5.29350464 3.51599033 5.28080201 0.09827167 0.22904584 0.11999349 Fe 3.50725429 5.34530901 5.29731183 0.10155662 -0.23529476 -0.10029039