32 Lattice="8.116068470229674 0.0 0.0 0.0 8.116068470229674 0.0 0.0 0.0 8.116068470229674" Properties=species:S:1:pos:R:3:forces:R:3 energy=-107.30616481201605 stress="-0.014489160771967552 -0.0023388626533881194 -0.00272782421943982 -0.0023388626533881194 -0.014324715327415957 -0.0005270676787767735 -0.00272782421943982 -0.0005270676787767735 -0.014044839798600032" free_energy=-107.30616481201605 pbc="F F F" Mo 0.02554236 0.02503691 0.04606820 -0.27414328 -0.25079653 -0.12401079 Mo 2.04696673 1.99985195 0.03992699 0.11652496 0.96944123 -0.89173954 Mo 2.05251096 0.02183918 2.05284460 0.48794722 -0.85133215 0.50218178 Mo 0.00918814 2.04820578 2.06597804 -0.53143117 0.59258519 0.47563150 Mo 4.07391508 0.02704141 0.00539771 -0.92254875 -0.91074689 -0.61097813 Mo 6.05040940 2.01040307 0.01045158 0.76761161 1.07189584 -0.83817993 Mo 6.07965120 0.02414086 1.99238522 0.46806088 -0.58523363 1.12479242 Mo 4.06381776 2.02256223 2.00141876 -0.70529208 0.82837306 1.87233173 Mo 0.03739752 4.09546489 0.02015178 -0.27522314 -1.06646896 -0.34056062 Mo 2.03863123 6.09577601 0.04040827 0.65802670 0.39809317 -0.56790567 Mo 2.05647733 4.00597762 2.04185794 0.44718327 0.10185483 1.18077573 Mo 0.04489448 6.09056759 2.03366759 -0.33812232 0.23758000 0.91289225 Mo 4.01617260 4.03744110 0.00686093 -0.07709342 -0.14838237 -0.65533504 Mo 6.09598887 6.10149150 0.03218197 -0.13512179 -0.17904768 -0.02158364 Mo 6.05451889 4.03089371 2.02074021 0.65465403 -0.29692795 0.34002895 Mo 4.04246779 6.09377789 2.02278066 -0.48585813 0.34048915 0.85993400 Mo 0.03466990 0.01340912 4.08364976 -0.55707080 -0.55176140 -0.86560951 Mo 2.05844894 2.00357633 4.04989725 0.46845353 1.77448199 -0.93688550 Mo 2.06187816 0.03171256 6.05233796 0.26418697 -0.80127345 0.87055025 Mo 0.00313412 2.01462038 6.08128755 -0.32562453 0.62128815 0.32191876 Mo 4.05982506 0.00904096 4.06037791 0.14922493 -0.58377392 -0.79378826 Mo 6.09573830 2.03576652 4.05157053 0.17243749 0.60623172 -0.58019902 Mo 6.12006000 0.06123559 6.11060331 -0.17930328 0.01398105 -0.00218445 Mo 4.01663213 2.04022351 6.05434399 0.33606714 0.86521084 0.59657997 Mo 0.00870852 4.07440198 4.08571157 -0.43384060 -1.02093769 -1.10627764 Mo 2.03008465 6.06651555 4.09501766 1.03028345 0.45939363 -1.06572288 Mo 2.01262095 4.02208846 6.07528457 0.97533162 -0.29130972 0.49340950 Mo 0.01556810 6.08177339 6.07433768 -0.24432876 0.24608252 0.42177990 Mo 4.09260339 4.09020025 4.03826996 -1.32777690 -1.46187664 -0.47351217 Mo 6.12202911 6.07589916 4.02914136 0.21347102 0.24343431 -0.39322079 Mo 6.07858570 4.05468465 6.11347767 0.43111313 -0.83282977 0.07338911 Mo 4.09262798 6.04465005 6.09972753 -0.82779900 0.46228205 0.22149774