32 Lattice="7.738938145979342 0.0 0.0 0.0 7.738938145979342 0.0 0.0 0.0 7.738938145979342" Properties=species:S:1:pos:R:3:forces:R:3 energy=-155.85322063398038 stress="-0.011204656143684346 0.0005368884619077402 -0.0007268305636004611 0.0005368884619077402 -0.011090351463773717 0.00028186081753311254 -0.0007268305636004611 0.00028186081753311254 -0.009298265141989682" free_energy=-155.85322063398038 pbc="F F F" Mo 0.03351308 0.00472115 0.00764475 0.67533464 0.68984212 0.63080659 Mo 1.94120743 1.94859093 0.00585521 -0.49627973 -0.52793360 -1.15979270 Mo 1.91179209 0.03616203 1.92071035 -0.29964848 -1.24044714 -0.42775515 Mo 0.02696526 1.92716790 1.91223064 -1.32905066 -0.38659925 -0.29689869 Mo 3.88491470 0.02355996 0.03675276 0.26188069 0.20322446 0.22568032 Mo 5.78904129 1.93051124 0.00772645 -0.20417774 -0.16436349 0.29402506 Mo 5.81746066 0.02650685 1.94015775 -0.13636392 0.18447082 -0.29234294 Mo 3.90644116 1.93491228 1.94237335 0.21240336 -0.35585489 -0.64195913 Mo 0.01407303 3.90069702 0.00530667 0.27656611 0.32205333 0.30876602 Mo 1.95600534 5.77283401 0.00116929 -0.46765884 -0.18847827 0.33848672 Mo 1.90036203 3.85449066 1.94041696 -0.31791238 0.63612191 -0.42917072 Mo 0.00834142 5.83566050 1.95130057 0.34536782 -0.37120914 -0.41851232 Mo 3.83606334 3.84858666 0.03846387 0.82546189 0.58406393 -1.16932210 Mo 5.83422446 5.77785238 0.02056569 -0.90212144 -0.84798509 0.86670352 Mo 5.79405271 3.90079973 1.96892091 1.26717790 0.31829829 -0.88400134 Mo 3.86213723 5.76671036 1.94468292 0.56878445 1.24833632 -0.56914032 Mo 0.02180165 0.01136640 3.88928642 0.31826277 0.34800898 0.34576543 Mo 1.97195255 1.92311328 3.85969572 -1.03470237 -0.34427349 0.67367755 Mo 1.93114043 0.00581206 5.81834829 -0.19900541 0.30509989 -0.37813722 Mo 0.03422826 1.89938815 5.83982482 0.50046529 -0.15806416 -0.50847716 Mo 3.87536273 0.03684302 3.83978163 0.48471181 -1.30789109 0.65610911 Mo 5.79183263 1.96888164 3.86168183 1.26923315 -0.68056936 0.61569154 Mo 5.78273409 0.01868578 5.77510134 -0.81440536 0.88376519 -0.81769564 Mo 3.84755787 1.97337586 5.76970797 0.48062885 -0.87698248 1.31053181 Mo 0.03202369 3.89790014 3.87810884 -1.08124003 0.26037370 0.61792505 Mo 1.93893865 5.82874357 3.83793766 -0.46576467 1.00267024 0.71098119 Mo 1.94878399 3.90494295 5.79070679 -0.55475265 0.55162777 0.97105976 Mo 0.01724409 5.83639888 5.79687154 0.81914283 -0.76978044 -0.86603783 Mo 3.87780263 3.86834816 3.86628939 0.25087982 0.83140816 0.51306310 Mo 5.84227316 5.78403130 3.85050125 -0.37640845 -0.26552092 0.47728494 Mo 5.76084228 3.83862303 5.80927892 -0.14981368 0.55642808 -0.22489710 Mo 3.90490751 5.84015437 5.77432970 0.27300444 -0.43984039 -0.47241732