32
Lattice="79.39268493652344 0.0 0.0 0.0 79.39268493652344 0.0 0.0 0.0 79.39268493652344" Properties=species:S:1:pos:R:3:forces:R:3 energy=-34.32589857620214 stress="-2.230305140887814e-05 6.681708507606908e-07 -1.3969148829674051e-06 6.681708507606908e-07 -1.8432991041516378e-05 -1.3344878392758427e-07 -1.3969148829674051e-06 -1.3344878392758427e-07 -2.0925085493964884e-05" pbc="F F F"
Ca      39.57584671      39.78897146      39.78838343      -0.15087977      -0.12965481      -0.25020836 
Ca      42.73454008      42.37465759      39.56162177       0.05428691       0.38810619      -0.10096021 
Ca      42.35537546      39.58058173      42.41822105       0.45076146      -0.08677946       0.39599309 
Ca      39.76040587      42.54745288      42.38874927      -0.28178807       0.12478647       0.17885683 
Ca      45.26457691      39.66213263      39.86517072      -0.01094096      -0.19669630      -0.21375294 
Ca      48.25690264      42.28901170      39.58426090       0.12397262       0.26399454      -0.10912657 
Ca      48.02605673      39.88198483      42.68666531       0.31642842      -0.48781292      -0.11425135 
Ca      45.52027195      42.69497817      42.65417058      -0.56944204      -0.19105099       0.07673996 
Ca      39.92100418      45.51413381      39.57469646      -0.23846201      -0.30435084      -0.27603367 
Ca      42.51752310      48.19609432      39.82384439       0.18808505       0.27768382      -0.35052313 
Ca      42.46461636      45.33203736      42.46389681       0.20123238      -0.35258502       0.29365625 
Ca      39.66125360      48.10958225      42.34047553      -0.14734008       0.34805233       0.31601410 
Ca      45.52707036      45.51637785      39.93918306      -0.22995881      -0.35602435      -0.58442166 
Ca      48.29816289      48.22981475      39.82054821       0.09957572       0.19312313      -0.24735941 
Ca      48.02012845      45.45565932      42.38796764       0.59729842      -0.33742301       0.16800423 
Ca      45.25419486      48.05401488      42.54314215      -0.00168142       0.53475784       0.13430807 
Ca      39.57299835      39.67607198      45.41999792      -0.27725824      -0.17630222      -0.21024816 
Ca      42.47967419      42.34718598      45.36267710       0.40037620       0.54953881      -0.17593370 
Ca      42.39951900      39.56418163      48.04993604       0.16554192      -0.31660226       0.27205543 
Ca      39.62956242      42.31843339      48.06703110      -0.13598787       0.42708180       0.13829875 
Ca      45.59408156      39.64118685      45.47668953      -0.42445652      -0.22471873      -0.22876485 
Ca      48.40413574      42.30339977      45.18812132       0.05176286       0.62385418       0.27580024 
Ca      48.35574921      39.86541516      48.27222933       0.09720983      -0.12169091       0.17790053 
Ca      45.19712689      42.48854095      48.38682233       0.07191733       0.20627515      -0.12984817 
Ca      39.88943868      45.51883460      45.21877768      -0.42296607      -0.40895760       0.03379431 
Ca      42.70862261      48.14007969      45.47550408      -0.13802742       0.31690859      -0.37778826 
Ca      42.35029925      45.60290018      48.25445157       0.16748399      -0.56847614       0.10427451 
Ca      39.80769963      48.05855941      48.26132182      -0.33385927       0.19157422       0.12051428 
Ca      45.40768581      45.41286103      45.29692411      -0.25932309      -0.59664308       0.12591685 
Ca      48.31654836      48.12336851      45.26491107       0.11834167       0.32185839       0.13557457 
Ca      48.03494329      45.45926417      48.00883166       0.30461916      -0.30965953       0.23521271 
Ca      45.23002724      47.98727353      48.27446497       0.21347772       0.39783272       0.18630574