32 Lattice="7.814117102519721 0.0 0.0 0.0 7.814117102519721 0.0 0.0 0.0 7.814117102519721" Properties=species:S:1:pos:R:3:forces:R:3 energy=-169.9983613044208 stress="-0.011375824972560646 0.0004844861067617061 -0.001191714620507004 0.0004844861067617061 -0.010756354909721856 -0.004291311278813473 -0.001191714620507004 -0.004291311278813473 -0.010414175228568337" free_energy=-169.9983613044208 pbc="F F F" Mo 0.02830696 0.03815433 0.01847909 -0.01502165 -0.04492829 -0.08580170 Mo 1.93097547 1.97945316 0.00392797 0.48833929 -0.32429855 -0.70644952 Mo 1.92887308 0.00586906 1.94484302 0.37599857 -0.71027255 -0.11678172 Mo 0.00700924 1.92174841 1.94410779 -0.75398884 0.55763211 0.24668729 Mo 3.92944887 0.02887318 0.02163310 -0.45319879 0.13148458 -0.06725940 Mo 5.85913863 1.98175162 0.03351952 -0.23488532 -0.00537931 -0.15431706 Mo 5.87355974 0.00903685 1.91855636 -0.29845376 0.25516277 0.76581153 Mo 3.87166593 1.93283169 1.99160657 0.60392751 0.29246802 -0.69882508 Mo 0.01467050 3.91306371 0.02595654 -0.24166878 -0.14137227 -0.11008835 Mo 1.92460603 5.86297861 0.03594833 0.27768590 0.07110437 -0.17937479 Mo 1.95095784 3.88033591 1.96421310 -0.19902520 0.62156762 0.12222695 Mo 0.01548549 5.86552956 1.92973493 -0.15318838 -0.27286059 0.68179087 Mo 3.88564800 3.93633233 0.02884340 0.36879171 -0.38469457 -0.72867739 Mo 5.86115732 5.86515834 0.02049414 -0.15668415 -0.48057799 0.23589274 Mo 5.89727597 3.86994634 1.93387887 0.21247796 0.63813555 0.26342064 Mo 3.93666380 5.82350834 1.91520283 -0.43475680 0.75505589 0.80438359 Mo 0.02513786 0.02176164 3.87665428 -0.09594715 -0.26360044 0.20867110 Mo 1.96878300 1.96776953 3.91750973 -0.31112162 -0.27377984 -0.19037569 Mo 1.97235851 0.01046048 5.83388919 -0.11022025 -0.18712059 0.15265202 Mo 0.02879160 1.92564040 5.82727476 -0.18597835 0.10452751 0.29548212 Mo 3.87826450 0.03152588 3.90600682 0.80541717 -0.94576540 -0.23582413 Mo 5.82672004 1.98887390 3.89003480 0.82779079 -0.65835071 0.23019375 Mo 5.84898135 0.02085101 5.85085382 -0.55685478 0.60459465 -0.60394540 Mo 3.89213313 1.97477346 5.82840898 0.34372854 -0.33710400 0.94731118 Mo 0.02539334 3.89048909 3.93356507 -0.85560042 0.27757530 -0.72208413 Mo 1.92211914 5.88552562 3.91790850 0.71596554 0.37850132 -0.49371903 Mo 1.96199540 3.89054802 5.82774855 -0.16600215 0.46029064 0.93526362 Mo 0.00982595 5.84435166 5.82571141 0.17371370 -0.23249670 0.00617063 Mo 3.91413074 3.93191706 3.93248338 0.23479631 0.39704918 -0.56412107 Mo 5.88862313 5.88115106 3.87063263 -0.39625352 -0.68874492 0.33339398 Mo 5.82644783 3.91683410 5.87060290 0.30914275 0.18014931 -0.28361723 Mo 3.92395211 5.84208311 5.85446641 -0.11892583 0.22604790 -0.28809032