32
Lattice="100.625 0.0 0.0 0.0 100.625 0.0 0.0 0.0 100.625" Properties=species:S:1:pos:R:3:forces:R:3 energy=37.811333214095065 stress="-7.036997926292585e-05 2.61676211617743e-07 1.2233635513213815e-07 2.61676211617743e-07 -6.921566878245505e-05 -3.6402420357161367e-07 1.2233635513213815e-07 -3.6402420357161367e-07 -7.041144516762736e-05" free_energy=37.811333214095065 pbc="F F F"
C      50.19200425      50.40512900      50.40454096      -0.59298628      -0.60759927      -0.67742646 
C      54.10899458      53.77076988      50.17777930      -0.04836971       0.09631508      -1.02521335 
C      53.49924371      50.17508147      53.99305710       0.11401941      -0.99257134       0.02497593 
C      50.12760651      53.84343690      53.55953473      -0.99843109       0.14698417       0.17834217 
C      57.14881565      50.27829016      50.48132826       0.16133572      -0.87788286      -0.73628305 
C      61.14795107      53.91242308      50.20041843       0.78267248      -0.07788167      -0.83558916 
C      60.91710516      50.49814236      54.06111981       0.85117708      -0.94805509      -0.26896312 
C      57.65302342      54.06943267      53.83938317      -0.17058153      -0.16831917      -0.00409659 
C      50.53716171      57.54763683      50.19085399      -0.75725137      -0.08212895      -0.93038232 
C      53.96569167      61.08714275      50.44000193      -0.00420256       0.88679415      -0.96350243 
C      53.93831930      57.46478882      53.88698077      -0.17202062      -0.22393873       0.05928259 
C      50.27741114      61.00063068      53.50364367      -0.86076629       0.87971329       0.12807338 
C      57.64476708      57.64912932      50.55534059       0.01910534      -0.05655883      -1.25973409 
C      61.18921133      61.12086318      50.43670575       0.56266764       0.57211320      -0.51061908 
C      60.91117688      57.52175966      54.04520167       1.21290422       0.03580075      -0.08591775 
C      57.09117486      60.94506332      53.83497304       0.18567859       1.26466808       0.10543294 
C      50.18915588      50.29222951      57.55102895      -0.85731256      -0.68999177       0.00398130 
C      54.08902234      53.72998375      57.48253973      -0.11325540       0.11115614      -0.01409233 
C      53.85872450      50.18033916      60.94098448       0.08213324      -0.82875812       0.79597500 
C      50.24571995      53.69288789      61.16936589      -0.73661004       0.12658057       0.68920671 
C      57.62511106      50.25734438      57.37531088      -0.07984465      -1.03500181       0.15854832 
C      61.31023891      53.67785427      57.32087278       1.05519447       0.12203888       0.21319600 
C      61.24679764      50.48157269      61.16327776       0.45391943      -0.48606014       0.56241042 
C      57.33056671      54.06819626      61.27787076       0.01309190      -0.10432323       0.99007906 
C      50.50559621      57.77077274      57.23068659      -1.05615095      -0.17162350       0.03734554 
C      54.17510094      61.03112812      57.78281491      -0.13948619       1.18137584      -0.17811638 
C      53.60402751      57.73565164      61.14550000       0.01039091      -0.33940523       1.03395890 
C      50.42385716      60.94960784      61.15237025      -0.74356545       0.65964269       0.55921812 
C      57.58444322      57.54561249      57.42967557      -0.05003792      -0.14068856       0.14784138 
C      61.20759679      61.01441694      57.32544490       0.78330933       0.89800683       0.07023142 
C      60.92599172      57.46414473      60.89988009       0.87779346      -0.01132785       0.82901384 
C      57.36277871      60.87832196      61.16551340       0.21547937       0.86092646       0.90282308