32 Lattice="7.715205603752111 0.0 0.0 0.0 7.715205603752111 0.0 0.0 0.0 7.715205603752111" Properties=species:S:1:pos:R:3:forces:R:3 energy=-265.825335891229 stress="-0.04311287172981073 -0.001996082365190654 0.00032790191090513183 -0.001996082365190654 -0.03514307259032172 0.002510459170191542 0.00032790191090513183 0.002510459170191542 -0.04490584436282244" free_energy=-265.825335891229 pbc="F F F" Mo 0.00423039 0.00378166 0.02282561 3.33344379 3.45489824 3.39298829 Mo 1.91744123 1.95055838 0.02315157 -1.10530043 -1.37591959 -5.33772066 Mo 1.94103750 0.03822125 1.92265031 -1.40484899 -4.48839906 -0.90244856 Mo 0.02950706 1.92245843 1.91021847 -4.89385094 -1.60957426 -0.76629647 Mo 3.84038837 0.04017888 0.00678437 -0.34728793 -0.39513041 -0.47156674 Mo 5.78498290 1.98534887 0.03095032 0.27832680 0.43343547 -0.22732843 Mo 5.73897143 0.04692049 1.93327366 0.24034365 -0.26543015 0.34559653 Mo 3.87315428 1.91819888 1.90327647 -0.79976458 1.04259870 0.66804719 Mo 0.02725450 3.89846675 0.03228834 -0.98543202 -0.53581618 -0.87034280 Mo 1.92456725 5.74636015 0.01927856 0.72496490 0.78394919 -0.60741394 Mo 1.91524551 3.83563460 1.90326307 1.35979605 -0.99979734 1.81474006 Mo 0.02375350 5.76235328 1.90199584 -0.44426308 0.52699478 0.89730527 Mo 3.82552415 3.86094669 0.01891162 1.74690939 1.47629559 -4.40556472 Mo 5.77581872 5.81296342 0.02100342 -3.90962033 -3.87385116 3.89015300 Mo 5.81488964 3.88134174 1.94268858 4.56689960 2.09250332 -1.36623725 Mo 3.85686004 5.78069817 1.96176650 2.04401314 4.09923042 -1.19763099 Mo 0.04104296 0.01411461 3.90755189 0.09321566 -0.06118978 -0.66445732 Mo 1.92892291 1.94595620 3.89427593 0.34400047 0.97792401 -1.25495210 Mo 1.87578109 0.06821555 5.81074535 0.41185715 -0.46956634 0.38208191 Mo 0.02836574 1.94436376 5.81122468 -0.36233704 0.71154279 0.21729111 Mo 3.86035979 0.03077157 3.88084511 1.32522815 -4.96098242 1.60742916 Mo 5.76303879 1.95843892 3.83158152 4.75761197 -0.87501339 1.38992644 Mo 5.78710598 0.01845860 5.77861101 -3.63235226 3.43520198 -3.45735981 Mo 3.85885801 1.90174755 5.76017037 1.55883403 -0.99962573 4.89205173 Mo 0.01472030 3.85044880 3.86280133 -4.30153790 1.70496640 1.72055331 Mo 1.96041217 5.75470698 3.83902561 -1.46615111 3.71578850 1.88482603 Mo 1.95535808 3.87203165 5.80983114 -1.52661297 2.05346346 4.63282795 Mo 0.02717439 5.82256817 5.80276024 4.14778005 -4.36637496 -4.22017543 Mo 3.89377759 3.83010525 3.87047425 -0.31456723 0.11946569 -0.49695192 Mo 5.81141245 5.79578514 3.89918869 -0.84541280 -0.71012318 -0.17286101 Mo 5.79205685 3.82745187 5.81265612 -0.51880518 0.02263144 -0.48934053 Mo 3.87718200 5.76338253 5.81283168 -0.07508001 -0.66409601 -0.82716931