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=-77.52763839824237 stress="-0.4932049008045423 -0.051327186959914624 -0.01523478309383273 -0.051327186959914624 -0.5581741107399886 0.05227964411491948 -0.01523478309383273 0.05227964411491948 -0.4975645207208859" free_energy=-77.52763839824237 pbc="F F F"
Fe       0.40181173       0.29793992       0.32101351     -25.24068862     -16.10303931     -16.69790753
C        1.15449286       1.41343681       0.29390162      11.83820621      19.45038766      -1.41907646
Fe       1.54263272       0.12304213       1.50795275      19.39517453      -5.73287963       7.13594826
C        0.06088235       1.31744557       1.64234241      -2.67602102       2.63511699       0.67780455
C        2.92773702       0.19862249       0.15944719       3.05198478       2.31301700       8.31169423
C        4.75900491       1.38008494       0.25685297      -4.52868482     -10.49776112      12.23137668
C        4.21574623       0.12784938       1.43372255      -6.37741814      13.20866144      -8.76759314
C        2.71840775       1.71348194       0.99834099      -5.61277401      -8.80118044       0.85391931
Fe       0.23086343       3.30161159       0.20408111      -8.17835507      -9.75435499     -14.88934590
C        1.48995421       4.24463885       0.20445780       2.53309033       1.41402295       1.99577353
Fe       1.20677130       2.80340219       1.72577322      16.73007234      11.83114216     -23.16759243
Fe       0.28340739       4.59364432       1.48967139      -0.20726437      12.41246100       7.85097620
C        3.31601326       2.80359158       0.15873884       4.00758456       6.43363464      -2.66080126
Fe       4.29599801       4.26588498       0.45607141      10.86226496      18.61550537     -26.14844973
C        4.12131989       3.40682263       1.38581798      -2.20143705     -21.29582017      23.17633303
Fe       2.74841186       4.56166149       1.47184183      -8.19508815       0.96598320       5.12479414
Fe       0.19215061       0.16717744       2.97357653     -12.86942258      -8.79908908       2.23541379
Fe       1.25491735       1.66523617       2.88290997      28.18378873     -36.29662551       7.77537184
Fe       1.37846166       0.33604598       4.62919136       4.84812082      -2.91784091       4.67482813
C        0.08189244       1.26152546       4.53665104      -0.59110395       3.09097274      -3.22778647
C        2.84806592       0.37901464       2.61250752       6.90228182       1.37639745      -2.05140139
Fe       4.52034757       1.57473240       2.76010779       2.80260738      -4.54576551     -13.05572593
C        4.20579093       0.07408066       4.33866701       0.00147160       1.74763955      -1.48276539
Fe       3.23715536       1.52704010       4.21795973     -10.24292006     -14.45385514       3.72699372
Fe       0.20470050       2.77493780       3.12749873     -40.47814936      23.39917330      14.22397932
C        1.74354717       4.61781300       3.16162860       2.47496239      -5.13849043       1.72102164
Fe       1.71611039       2.86129912       4.20918501       1.46993631      10.41227001      16.37781014
C        0.25219415       4.59571277       4.57924967       1.12089305      -2.70969454      -1.42447410
C        2.78416794       2.90409755       2.95091026       5.03839053       0.15089162      -3.21767790
Fe       4.53906884       4.16295854       2.91789209      -1.05106657       4.32734312      -4.28730418
Fe       4.40938640       2.81573811       4.28877715       6.61503915      11.18849885      10.03322696
C        2.90965455       4.00959412       4.45639257       0.57452427       2.07327771      -5.62936366