32
Lattice="5.357214263457811 0.0 0.0 0.0 5.357214263457811 0.0 0.0 0.0 5.357214263457811" Properties=species:S:1:pos:R:3:forces:R:3 energy=-74.95991437544667 stress="-0.10538984940515995 0.01649229757623748 -0.01623604664701017 0.01649229757623748 -0.11219586845397496 -0.008042859719961649 -0.01623604664701017 -0.008042859719961649 -0.09554484706171365" free_energy=-74.95991437544667 pbc="F F F"
C        0.00064208       0.01121038       0.00214241       2.08954259       1.81352321       2.12635050
C        1.31649678       1.34036815       0.00701667       0.90275281      -0.38784841      -7.83474655
C        1.33873130       0.01513309       1.31814625      -0.77013272      -7.16870891       0.89071084
C        0.02617486       1.35662198       1.32950937      -7.82388252      -1.57731947       0.70749990
C        2.68845120       0.03975673       0.02705332      -0.48709587      -0.29979321      -0.47223652
C        4.02816141       1.31796619       0.00796221       0.65117381       1.36427945      -0.05640989
C        4.03154843       0.02154036       1.31930301       0.34317821      -0.18275977       1.81460103
C        2.68031229       1.33343247       1.31969694      -1.89028181       1.50536726       1.51392971
C        0.00762866       2.65528538       0.00615424       0.49327037       3.55012741       0.37443122
C        1.35437901       4.01344712       0.00675149      -2.98221370      -0.71381522       1.11482869
C        1.33303984       2.67460644       1.31298363       1.58055666      -0.56958890       1.39663455
C        0.00385305       4.01458310       1.37275446       1.83618186      -1.56474092      -1.50527654
C        2.66530734       2.70525416       0.00693647       1.04034958      -0.83956254      -6.75843288
C        4.01154457       4.02351960       0.00404054      -2.76989153      -2.86111785       3.12123155
C        3.99210491       2.66783477       1.31254368       5.75803935       1.40392973       0.60810162
C        2.66074310       4.03109132       1.33627682       2.05989728       6.34686315       2.97465793
C        0.01921478       0.02156353       2.70064046      -0.12757346      -0.26929297      -1.63513653
C        1.32875786       1.32036317       2.67169615       2.05792806       1.16947765      -1.18413556
C        1.35108697       0.03831807       3.99025010       1.45577556       0.14076911       0.31357346
C        0.00228150       1.31666468       4.01549227       0.04950686       2.34408142       0.02256460
C        2.70466620       0.02315672       2.66904743       1.12990708      -5.93323823       0.04494117
C        4.02857394       1.35422267       2.68382160       6.53541238      -0.74179990       0.10606928
C        4.01319116       0.02301743       4.03631005      -3.34384078       3.23822186      -3.31904756
C        2.68058885       1.36641054       4.02112340       0.21026616       0.17475913       6.89960579
C        0.00016437       2.64882165       2.66231596      -6.25373038       0.21505580       2.07133376
C        1.33098414       4.02807075       2.67909192       1.00355542       5.89502725       1.04579717
C        1.34520835       2.70384144       3.99953707       0.06017943       0.95282769       5.07941583
C        0.00955924       4.01228911       4.03485629       3.45869036      -3.08731466      -3.13617713
C        2.67544519       2.66870965       2.65721636      -2.09386996      -0.25389508      -2.54117833
C        4.04322395       4.02190100       2.71265415      -3.13048881      -2.30750084      -0.93264594
C        4.03361513       2.68350572       3.99974927      -0.89079530       0.72239120      -0.71691651
C        2.70556435       4.03265533       4.03530033      -0.15236699      -2.07840443      -2.13393867