64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-69.8722898132 stress="-0.5094791050996065 0.05790713364532453 -0.133806768014862 0.05790713364532453 -0.5137757801597268 0.0639165470095753 -0.133806768014862 0.0639165470095753 -0.43952079393595356" pbc="F F F" Fe -0.00714941 -0.19068735 -0.36091253 0.41781746 0.06302843 0.73365784 C 1.65069931 1.66444697 1.25592154 -43.34357349 -43.38230348 68.88513373 C 2.29501545 2.29814022 0.23360583 43.30799298 43.08133836 -68.49765358 C 4.23831635 4.08633809 0.95346217 -4.40780430 -6.46256003 7.15176481 Fe 1.64995856 -0.36181975 2.42240867 -0.76519474 1.57736674 -0.35544622 C 4.52724297 0.87984170 4.20835961 0.23025909 -0.72780322 0.75263296 Fe 0.82995000 2.72359697 2.63820906 -17.60789924 -120.44298396 -84.53789430 Fe 1.00230909 3.92116535 3.47998276 2.54281663 128.73255552 58.87875088 Fe 5.49993591 -0.40354130 0.36243373 -0.75519701 -4.00650805 -1.61690066 Fe 6.02778404 1.38423686 1.37245546 -10.35857628 25.27279600 -47.41280226 C 7.40103789 2.00715940 0.52192034 1.42218993 -0.10581482 1.02817158 Fe 9.06788933 3.52553782 0.92309932 -1.98737942 -1.36420694 0.31396204 Fe 7.03916316 0.39804483 2.20270003 46.24361573 -45.42321333 38.48301986 C 8.71796430 1.75381568 3.81485848 -3.25647856 0.98920375 2.08786599 C 4.96959328 2.25512234 1.67767469 -35.32110137 27.85429745 10.06469012 C 6.12433971 3.81603876 3.91351280 28.10933567 -11.28638160 -18.67465967 Fe 0.86392473 4.24775704 0.29196564 0.42307166 2.17711569 1.77905126 C 1.45701461 6.31741256 1.49668054 2.27925969 -4.70117573 -2.01577256 C 3.34677320 6.87150216 0.45935638 -0.87634845 1.10132827 1.97258668 Fe 3.52892570 8.94223571 1.35213313 -38.92712967 19.64797152 -16.58555033 C 2.52379306 4.70996391 2.01599372 0.71250429 2.49462090 0.56404801 Fe 3.62193878 6.04686969 3.19141996 -1.03577046 -1.14369065 -0.18295368 C -0.03243217 7.99135582 2.84836566 -31.29642995 -30.40302475 -18.57133385 Fe 0.89981165 8.88412559 3.39634390 28.68974047 33.30935665 15.87701517 C 4.90195283 5.01175581 -0.17955456 4.20470181 6.33981806 -4.80204229 C 5.83447285 6.51749446 1.06873050 -2.15388867 0.85905920 -0.61965049 C 7.29139520 8.18011213 -0.20382763 1.66620381 0.58233601 2.68061040 C 8.26446434 8.58072992 1.18136122 -1.78276916 -0.74007171 -2.59258263 C 7.83321154 5.47262487 2.86145756 0.43184854 -0.43972554 0.06491113 C 8.79245239 7.06808142 4.53468772 -4.03992462 1.77021508 4.40381250 Fe 4.94501170 8.14377025 1.95063158 37.81637222 -24.14317309 11.51460758 C 5.61681924 8.31236092 3.49048400 1.45740340 0.60818550 4.60075825 C 0.52052398 0.23586549 4.88168636 1.89581005 0.25181325 0.37202753 Fe 1.85273851 0.74570200 6.16713254 -20.00184521 33.18499239 -44.92665519 Fe 2.03493309 3.26893551 4.83483733 17.01749174 -9.93972170 21.83645609 Fe 3.65440115 4.24244203 6.46567694 23.92664823 -20.08186282 -20.44775378 Fe 2.37355605 -0.22420223 7.44715237 18.44194996 -33.33777103 44.49894865 Fe 3.99982619 0.96395054 9.07030401 0.40699787 1.62522123 -1.50867735 Fe 0.49663771 2.60545297 7.28242352 0.97982227 -3.70908917 -4.11319285 Fe 0.31135108 4.15158596 8.66444262 -0.16818231 4.02140914 3.03206539 Fe 5.39550081 -0.44181049 5.17405465 0.31974049 1.98895297 -0.16361920 C 6.41378034 1.39770342 6.20139570 -27.19275009 -22.58260892 24.24752770 Fe 7.31689414 2.12775954 5.38703745 29.94505452 21.67605990 -26.28830350 C 8.69757661 4.08376824 6.15864073 -2.11481907 -0.30795816 0.49109765 Fe 7.37911031 -0.49428966 7.51428139 -0.31590568 1.15243310 -0.58244404 Fe 9.16765537 1.42209010 8.84990670 -0.47955032 -0.38739869 -0.56119525 C 4.64524424 2.69092780 7.98148769 -0.03953521 0.05464189 0.76123553 C 6.27662645 4.12590939 8.64193867 0.34777606 -0.03217434 -2.31842873 Fe 0.45889177 5.42046722 4.93698748 -1.77580803 1.36878547 1.61562483 Fe 2.14212983 5.84500813 6.30156401 -20.71009730 29.38711392 -33.58316700 Fe 2.17437186 7.62160551 4.50025609 3.21270371 -3.05307704 2.33016070 Fe 3.39986949 9.18383255 6.08283717 0.06407966 -1.05718513 0.24538049 C 2.75629908 5.04760334 7.27719268 0.43770550 -8.86416657 55.40898372 Fe 3.66342922 6.80361071 8.43164098 -4.44057802 -2.94090673 1.43021189 C -0.00056285 7.99566899 7.98340045 -129.81493737 -72.39868272 -48.14339679 C 1.05829075 8.58438790 8.37207137 130.24468938 72.45247991 47.98963182 C 4.95183931 4.30795443 4.71095229 -28.76543381 11.38659917 20.43803003 Fe 6.66515985 6.30866074 6.63974970 -27.33739791 36.69716527 -16.04449866 C 7.03012021 6.99189601 5.08429258 4.96503187 1.61069326 -4.44121005 C 9.12270121 8.38835109 6.40318577 -0.65837393 -2.49236548 -3.49652814 Fe 7.56192899 4.99949709 7.31423933 26.74236269 -38.05524194 21.29831839 C 8.82453383 6.27399381 8.53151844 -1.31295746 -1.22701458 -1.26629507 C 4.90755927 7.57454810 7.60063805 4.53665714 2.52790636 -2.96630561 Fe 5.93054462 8.67903687 8.64843324 -0.39601740 -0.60699844 -0.51583748