32
Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=7146.698592232891 stress="-0.4472258423660335 -0.016185811498789792 0.07377280739870493 -0.016185811498789792 -0.3699358030632753 0.06122014489364148 0.07377280739870493 0.06122014489364148 -0.46466412285755937" free_energy=7146.698592232891 pbc="F F F"
In      21.27815438      20.96656208      20.87947289   -1148.08811882    -344.83537451   -1065.95955932
In      22.53171229      22.42271793      21.08050854    -606.60788386    2029.41961720    -558.43256251
In      22.41118507      20.93127051      22.26680931   -2196.73291937    -696.09261819    4294.32020699
In      20.94996254      22.59052626      22.50463004   -2032.38997369   -1878.01979045    -146.16378501
In      23.54834261      20.99695165      21.09487256    3901.30746989   -1390.67008634   -3127.52913762
In      25.09302004      22.34492380      20.92019865     396.67226921      14.32887761    -714.86848032
In      25.37960793      21.20623725      22.49719834    1131.11694716   -1393.03285458   -1466.02984942
In      24.11362052      22.72238223      22.55679381   -2179.21911317    -634.36590463    -492.07507304
In      20.91303852      24.02382053      21.27463406    -606.04278229    -202.88402880   -1392.28641197
In      22.47045765      25.56116365      21.23860716    1188.04949788     278.70217396   -1387.89155011
In      22.21270060      23.74431257      22.65769529    2491.86881597    2271.98141478   -1316.20785688
In      21.22434230      25.38992533      22.45042432   -1467.78272367     998.87849796    1616.32155687
In      24.28429938      24.20023554      21.11871331   -3437.32078074    -508.47942480   -3197.29092456
In      25.47520412      25.48837863      20.93309118    1098.46815447    1247.29851863    -291.49210051
In      25.25999408      24.03375554      22.43317150    3840.22872101     688.41722105    2686.10534888
In      23.95735964      25.61950962      22.68667975    1261.16283704    1038.82441922   -1868.98663822
In      20.93071378      20.93014721      23.80068268    -153.69381507    -225.19641113     122.07520867
In      22.20708358      22.64611051      23.99877280    1198.91453078   -1952.35148149    1189.67238428
In      23.03401627      20.84371123      24.98851965   -2043.24929639    -952.57448747    2576.01879457
In      20.74757245      22.69810058      25.21999209    -941.54069378   -1182.44690241    1174.06766883
In      24.03151538      21.20073357      23.70207718     448.04963925    -410.20094380   -1556.07468781
In      25.39045214      22.41133125      23.80997216    1514.44071096    1177.20018791    1654.92978954
In      25.52779422      20.93088600      25.43314966      39.69858596     -56.44602417      81.61418745
In      23.70126207      22.70748563      25.53231540    2407.71864936   -1573.58369279    -197.94121771
In      21.03735024      24.04977399      24.09788417    -873.75723021    1692.80671073    -449.49153005
In      22.70385435      25.60610503      23.89122824   -2054.13896145     695.11314755    1008.90043561
In      22.36055196      23.70183975      25.75645612   -1991.05208819    1869.89772789     747.02455870
In      20.90201964      25.40335492      25.56916303     -61.00537129     228.29585591     206.88294090
In      24.01585264      24.29758538      23.92634292     109.31938887   -1466.57048944     689.50643982
In      25.72154934      25.36446410      23.97768582     350.12981414     696.76680629    -221.17697682
In      25.62757867      23.89282536      25.16675334     174.87126086    -312.15894264     637.79960857
In      23.70891239      25.38788228      25.50965883     240.60445918     251.97828094     764.65921223