32
Lattice="21.0 0.0 0.0 0.0 21.0 0.0 0.0 0.0 21.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2657.9688322514785 stress="-0.3943313436898384 0.005518719022877752 0.0010408965688247062 0.005518719022877752 -0.3658812639071897 0.006586706059797461 0.0010408965688247062 0.006586706059797461 -0.370973149308912" free_energy=2657.9688322514785 pbc="F F F"
C       10.35540510      10.61115480      10.61044915     -89.34920253    -305.31185736    -188.78090427
C       11.49329349      11.08742386      10.33833517      -5.03690852      16.18522835    -283.84504951
C       10.76159245      10.33509776      11.35416852     -22.97876673    -160.85928226     -27.65385297
C       10.27812781      11.17462428      10.83394168    -202.79148626     265.95923575      54.38584892
C       11.57857878      10.45894820      10.70259391      47.59010858    -262.11174977     -84.02163806
C       12.81504129      11.25740770      10.36550211     155.26309205     -68.11646688    -196.54735337
C       12.31093591      10.72277084      11.43584377      17.24174075    -213.61607471     -77.67828963
C       12.06452997      11.44581920      11.25821668    -243.04475262    -201.19124820      -6.90302231
C       10.76959405      12.23461768      10.35402479    -132.78052610     -72.80275552    -266.09640083
C       11.20641978      12.74207130      10.65300231      32.66745757     223.60425613    -103.84511790
C       11.28848316      11.93968090      11.16852158    -154.11009974    -115.20102318     -54.23962016
C       10.45789336      12.63825682      10.94043468    -261.48496295     160.39907716      11.63620319
C       12.19178619      12.37965721      10.79140871     133.57540710     115.90767405    -296.43151042
C       12.86455359      12.78253581      10.64904689     156.85794223     142.31389223    -131.20604002
C       12.53091226      11.80952252      11.21603997     468.83217158     122.33729807    -149.31206686
C       11.70683191      12.57157598      11.26361598     -56.26261102     349.19754811      53.94397439
C       10.35198705      10.47567541      12.06123474    -177.38529822     -82.52811848      20.62175110
C       11.18745442      11.02846858      12.27638667     -27.71622252      37.02332138      58.43434658
C       11.10128012      10.34140700      12.56668137      10.27978512    -240.27539408     141.49512217
C       10.41986395      10.97849886      12.84073906    -109.81863403       4.96491669     111.42979988
C       12.37390083      10.43381326      12.13132919      21.91664311    -169.85306389     123.65463556
C       13.00978669      10.85385878      11.78504734     263.64631415     -61.41918608      17.13005525
C       12.93365717      10.42193109      12.83343331      68.09938824     -56.20381337     120.36122895
C       11.79668005      11.44433552      12.97094491      41.03757123    -134.05836776     247.69806437
C       10.73171545      12.18190327      11.96485899    -223.16636426       1.32162777      40.03566679
C       11.31718146      12.67485375      12.24033525     -17.53802102     261.47688577     -17.19143116
C       11.03220450      12.28278197      12.81210000     341.57323745    -342.64121147     168.04694988
C       10.63362859      12.57702941      12.82034430    -644.58276173     428.55976335     110.31951968
C       12.25799597      11.90986350      11.91561068      81.48891007     -27.53340647      72.42627435
C       12.88661615      12.65480033      11.87719504     185.90699606     161.12997417      90.21565697
C       12.54869006      12.16322590      12.51735611     235.67688356      77.82968220     231.89214914
C       11.83533445      12.49148635      12.83611608     106.39296940     145.51263831     210.02505033