32 Lattice="7.080894527692388 0.0 0.0 0.0 7.080894527692388 0.0 0.0 0.0 7.080894527692388" Properties=species:S:1:pos:R:3:forces:R:3 energy=-97.97458181070832 stress="-0.008183076542735672 -0.0005285973356861914 -0.0015731335387980762 -0.0005285973356861914 -0.0074768268945753944 -0.0009144945520087377 -0.0015731335387980762 -0.0009144945520087377 -0.007512210159630075" pbc="F F F" Fe 0.00893106 0.03062723 0.02071687 0.15133995 0.28912785 0.19995296 Fe 1.77144881 1.78629786 0.00446353 0.09939948 -0.09878145 -0.28800255 Fe 1.75846328 0.02385052 1.75651469 0.14691081 -0.37099046 0.07324771 Fe 0.00561558 1.80330959 1.79745742 -0.36790869 -0.22810399 -0.07218890 Fe 3.56027171 0.02560900 0.00884293 -0.12855108 -0.04995535 0.07306596 Fe 5.29674360 1.73928402 0.01710839 -0.00897632 0.25551219 0.08756044 Fe 5.30284274 0.01550054 1.81802466 0.00849703 -0.09299711 -0.06337853 Fe 3.54524193 1.78024226 1.80283041 -0.23642842 -0.16106550 -0.22926209 Fe 0.03536632 3.51576591 0.02833255 -0.16636849 0.04592300 -0.19764424 Fe 1.77986405 5.28884545 0.03283734 -0.05927046 0.22074452 -0.20749260 Fe 1.75930683 3.56888417 1.78531677 0.16100270 -0.48526808 0.26091382 Fe 0.03059117 5.28736958 1.76394294 -0.17228489 0.12198896 0.12604690 Fe 3.51594162 3.56836547 0.03146098 0.34393853 -0.16527977 -0.44779399 Fe 5.34231113 5.31150323 0.00699734 -0.41440705 -0.35394266 0.41407719 Fe 5.27786274 3.53624445 1.79543149 0.61759924 0.16199347 -0.34714243 Fe 3.51325440 5.28298236 1.80105072 0.44194238 0.61126458 -0.15330855 Fe 0.03239771 0.01445295 3.56068930 -0.18596129 -0.11898655 -0.16794447 Fe 1.76425703 1.74773469 3.56815519 0.21390144 0.20821575 -0.14035743 Fe 1.75041553 0.01115953 5.31620038 0.20512078 -0.05332543 0.15595929 Fe 0.00082088 1.74648958 5.32314727 -0.10183156 0.14443065 0.03306802 Fe 3.56700185 0.01477494 3.59484892 -0.19329170 -0.35649432 -0.12643557 Fe 5.32928223 1.77440651 3.53352582 0.48982780 -0.12045793 0.15746275 Fe 5.34445070 0.01326083 5.28081961 -0.11837301 0.23468366 -0.17106892 Fe 3.57303162 1.77616428 5.34304091 -0.16580985 -0.14750865 0.29347830 Fe 0.00515232 3.54097486 3.55623656 -0.40637168 0.17733239 0.11068354 Fe 1.79945553 5.33329430 3.52785579 -0.30864338 0.27706821 0.23326260 Fe 1.74833094 3.53467273 5.27616925 0.19448532 0.11955742 0.40382846 Fe 0.02317129 5.32967389 5.32206414 0.33910485 -0.25137610 -0.32977003 Fe 3.57423673 3.51392150 3.53662110 -0.44682732 0.21359420 0.30237367 Fe 5.32141532 5.31113431 3.55119180 -0.13159443 -0.02065609 -0.00289887 Fe 5.29350412 3.51598997 5.28080148 0.09827286 0.22904608 0.11999492 Fe 3.50725394 5.34530851 5.29731131 0.10155646 -0.23529351 -0.10028735