32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=177.34809625980327 stress="-0.031877177875356585 0.0020237816190674237 -0.0014539223994729424 0.0020237816190674237 -0.03279394333391268 -0.0011461938229860484 -0.0014539223994729424 -0.0011461938229860484 -0.03240939485259385" free_energy=177.34809625980327 pbc="F F F" Ru 20.88909689 21.11115480 21.11044915 -17.23626586 -54.28959213 -56.86734100 Ru 22.70960170 22.33742386 20.83833517 -49.38817085 2.70528504 -78.97830008 Ru 22.01159245 20.83509776 22.60416852 22.03725072 -56.14974272 -25.18297436 Ru 20.77812781 22.42462428 22.08394168 -52.33752139 24.76011883 22.63736441 Ru 23.57857878 20.95894820 21.20259391 20.60861221 -88.58195252 -25.16176788 Ru 25.56504129 22.50740770 20.86550211 42.70308899 -19.71629151 -49.75307153 Ru 25.28802619 21.22277084 22.68584377 60.95013909 -121.93486677 -65.08032449 Ru 24.18362810 22.69581920 22.64685009 28.20766423 -181.27540419 -48.75878215 Ru 21.26959405 23.94917205 20.85402479 -41.86546636 0.76346525 -53.10016468 Ru 22.70996341 25.49207130 21.15300231 -38.76924163 61.98558085 -83.17295945 Ru 22.53848316 23.83864846 22.41852158 -142.22994653 25.12246234 -61.19500837 Ru 20.95789336 25.38825682 22.13178262 -40.06271310 37.42455342 -1.37544584 Ru 24.25014153 23.92541155 21.29140871 -10.06765979 29.72988216 -215.08518466 Ru 25.61455359 25.53253581 21.14904689 23.34011517 30.13408700 -25.50143577 Ru 25.28091226 24.10609294 22.44797428 213.00229335 70.66895522 6.75938001 Ru 23.80598025 25.32157598 22.43363463 31.77338183 151.48938520 2.90044005 Ru 20.85198705 21.17637744 23.76672885 -64.20520424 -14.24193132 37.74659325 Ru 22.43745442 22.27846858 23.99451428 -56.68219854 -54.05759690 60.10566096 Ru 22.24211986 20.84140700 25.31668137 -5.12623889 -22.18113415 19.78302129 Ru 20.91779942 22.52583785 25.60075098 -14.46895837 -0.51493634 15.07297021 Ru 24.25673302 20.93381326 24.13132919 -11.81070236 -65.49342880 45.47723227 Ru 25.75978669 22.32762633 23.78504734 98.46437220 0.45354779 74.85313476 Ru 25.56159082 20.92193109 25.58425933 12.79106889 -10.00972136 14.77743418 Ru 24.04209500 22.44809454 25.72094491 1.45939906 -26.35519831 59.74957849 Ru 21.23171545 24.32492729 23.82183498 -84.44005768 9.39070996 28.01034851 Ru 22.71219253 25.42485375 24.12990665 -43.00572307 102.14898653 19.93731820 Ru 22.13719344 24.28278197 25.56210000 51.95199346 -87.09531170 45.56160837 Ru 21.13362859 25.32702941 25.68077289 -94.84943521 94.38779539 20.31293535 Ru 24.04852473 24.05473499 23.91561068 28.06355142 67.29769038 149.27305171 Ru 25.63661615 25.40480033 24.08666628 52.70598989 61.61842123 5.89302546 Ru 25.29869006 23.96554727 25.26735611 73.84955423 -14.01507904 88.70507852 Ru 23.88814158 25.24148635 25.58611608 4.63702913 45.83126121 71.65658427