108 Lattice="15.005023860493715 0.0 0.0 0.0 15.005023860493715 0.0 0.0 0.0 15.005023860493715" Properties=species:S:1:pos:R:3:forces:R:3 energy=-372.08091687462996 stress="-0.0014420609639627935 4.141649563375345e-06 0.000125706241469574 4.141649563375345e-06 -0.0013191923055398856 -0.0002558490371409464 0.000125706241469574 -0.0002558490371409464 -0.001470258520811796" free_energy=-372.08091687462996 pbc="F F F" Tb 0.03388131 0.04349451 0.01686592 0.28537022 0.21646509 0.23995453 Tb 2.52561366 2.52796633 0.01038546 0.07848179 -0.09837131 -0.20642494 Tb 2.52629671 0.00073856 2.58855497 -0.02268003 -0.19030868 -0.16096713 Tb 0.04251898 2.47406860 2.46310658 -0.21356085 0.05823071 0.19672397 Tb 5.00021067 0.00543106 0.05321479 -0.08224016 0.03202278 -0.00862456 Tb 7.49385304 2.51145677 0.03997492 0.09200325 0.06192643 -0.32035215 Tb 7.45638823 0.00418498 2.48875983 0.17513162 -0.26088937 0.12922689 Tb 5.04610390 2.47590738 2.49655294 -0.11011110 0.14607824 0.06717350 Tb 10.01203208 0.02101833 0.03709703 -0.11034840 0.11333977 0.12296799 Tb 12.49867591 2.48371124 0.00635953 -0.13547602 0.14780187 0.16832604 Tb 12.50011060 0.03770715 2.51951868 -0.15855905 0.13826599 0.14388830 Tb 9.97083228 2.54321529 2.52453407 0.16975824 -0.15032146 -0.07138318 Tb 0.01649189 4.96264428 0.02918206 0.08764324 0.08533244 0.04143771 Tb 2.55080941 7.55690040 0.04075233 -0.08996296 -0.14389950 -0.33370350 Tb 2.53636117 4.96631886 2.46229533 -0.07695613 0.07809698 0.17378211 Tb 0.01642973 7.51426807 2.48959844 -0.22683022 -0.07664623 0.07377165 Tb 5.02344401 5.04144724 0.04188546 -0.02532157 -0.06592980 -0.32920063 Tb 7.49197994 7.54353755 0.04502746 0.07739347 -0.06475652 -0.33358768 Tb 7.53360578 5.03285317 2.47037855 -0.05444007 -0.05880089 0.15029016 Tb 4.93484603 7.54514896 2.50237769 0.14686151 -0.05768203 0.17761759 Tb 10.05060682 5.04396802 0.01556013 -0.09368493 -0.07009767 -0.24486868 Tb 12.55416189 7.51450312 0.00476985 -0.16704284 0.07261046 0.16544481 Tb 12.50054105 5.01778948 2.54437035 0.27126380 -0.08736166 -0.07335941 Tb 10.01552811 7.46205735 2.54419990 0.10635201 0.17877086 -0.16758270 Tb 0.02363745 9.92573613 0.01714805 0.09969467 0.10157854 0.08473152 Tb 2.53909079 12.53920428 0.00133319 -0.02727979 -0.21841263 0.14193761 Tb 2.45467931 10.00936749 2.53161524 0.17434088 0.11676756 -0.04449108 Tb 0.01521942 12.49924912 2.54164664 0.06318887 -0.06739322 -0.10505000 Tb 5.01448203 9.99873249 0.03319976 -0.05024078 0.09718697 -0.27466833 Tb 7.51489231 12.53938261 0.02894249 -0.01075921 -0.11179386 0.11560759 Tb 7.48343109 9.96855729 2.48718042 0.05713830 0.18566482 0.04110112 Tb 4.96446178 12.54795704 2.45257273 0.00620465 0.09036043 0.15802973 Tb 9.96844851 10.02884378 0.02282591 0.12246871 -0.08011891 -0.15642260 Tb 12.54634812 12.50491631 0.03147517 -0.31462685 -0.30617660 0.28461133 Tb 12.47153783 10.00940527 2.52901186 0.22646583 -0.08464096 -0.03270404 Tb 10.02667789 12.49752242 2.52493649 -0.05844558 0.22929990 -0.06189465 Tb 0.01944587 0.01357611 5.04692650 0.04852182 0.05836998 -0.08841118 Tb 2.53793929 2.50207887 4.99648871 -0.11110093 0.18911200 -0.10575211 Tb 2.56562957 0.02797526 7.46094733 -0.16841913 -0.32466643 0.17516986 Tb 0.03283523 2.49807836 7.45734445 -0.20454124 0.09747976 0.10863005 Tb 4.99009162 0.02220237 5.03003985 0.09417342 -0.38337666 -0.15999868 Tb 7.52430199 2.49038942 5.01489333 -0.04672696 0.19797161 -0.03992172 Tb 7.46818672 0.04351883 7.45368507 0.04447491 -0.34572187 0.20516875 Tb 4.95627611 2.46129163 7.46758051 0.13116342 0.31706743 0.18898753 Tb 9.95473649 0.03107725 5.04342094 0.12327197 -0.23952763 -0.14587462 Tb 12.52595752 2.53235803 5.03593714 0.18029402 -0.09024216 -0.09931259 Tb 12.49943715 0.01440897 7.51501246 -0.03676780 0.07710442 0.03589298 Tb 10.04789205 2.48052359 7.54553665 -0.15043970 0.10351586 -0.04702987 Tb 0.00368530 5.03975731 4.97817418 -0.21053344 -0.20759807 -0.05689027 Tb 2.45744236 7.46143227 5.02534638 0.26372060 0.16311837 -0.07601237 Tb 2.54815262 4.98212953 7.50602558 -0.07570635 0.01186364 0.03663955 Tb 0.02028441 7.52471079 7.42912752 -0.30995309 -0.05656104 0.18479684 Tb 5.06608421 5.04876334 4.95982728 -0.14300372 -0.13253711 0.05509565 Tb 7.55422661 7.52097998 4.96194502 -0.14755248 -0.06098767 0.12888496 Tb 7.47783732 5.01197571 7.53664445 0.06472160 -0.15068151 -0.18229008 Tb 5.03592866 7.48196213 7.53151991 -0.16664007 0.17997403 -0.13004544 Tb 10.03756272 4.97831105 5.04201422 -0.23021145 0.00381877 -0.06062680 Tb 12.51754697 7.47106148 5.01951601 0.19988726 0.13562873 -0.00779699 Tb 12.45690342 4.99824263 7.48389660 0.38241924 0.04368417 0.21299311 Tb 9.96594913 7.46400072 7.53513465 0.10795737 0.20692227 -0.08808121 Tb 0.00219339 10.05177982 4.96087456 -0.26657462 -0.13994503 0.09041493 Tb 2.46269747 12.54305198 4.95540768 0.27477562 0.16175855 0.14575769 Tb 2.45454635 10.02359170 7.50711991 0.30249863 0.01059417 -0.12662649 Tb 0.04497540 12.51502889 7.50953977 -0.04726210 0.00837508 -0.07902297 Tb 5.03522903 10.01148065 5.03824003 -0.27021455 -0.02524751 -0.11432113 Tb 7.46074857 12.49573604 4.92280052 0.07981451 0.29014557 0.07955537 Tb 7.50964810 10.02241826 7.47603184 0.03907991 -0.07841686 0.10526594 Tb 5.04487989 12.51846720 7.53601728 -0.17973339 0.20979756 -0.10653138 Tb 9.97582804 10.02043724 4.97309912 0.07457888 -0.11011737 0.07809669 Tb 12.48218912 12.48729863 5.02614801 0.00555002 -0.03015095 -0.07248098 Tb 12.50177471 9.98828523 7.46545799 0.22244972 -0.11648833 0.02851261 Tb 10.03631043 12.46757804 7.46910996 -0.21781999 0.30543844 0.04188104 Tb 0.03979472 0.03066262 10.04009479 0.05945762 0.08601851 -0.18490488 Tb 2.46335535 2.47066047 10.04541064 0.08232417 0.16655022 -0.16209589 Tb 2.52712265 0.01601068 12.46345036 0.03321345 0.02791435 0.04479470 Tb 0.03096748 2.53605610 12.54634852 0.06955236 0.04549986 -0.09551796 Tb 4.97738920 0.01275819 10.02718847 0.12506522 -0.27043432 -0.12168400 Tb 7.48329016 2.51763757 9.96503044 0.08313521 -0.08805845 0.19284746 Tb 7.51059142 0.00712294 12.55016399 0.07773040 0.19038361 -0.19348520 Tb 4.99925981 2.47058580 12.45706788 0.04145027 0.13725587 0.31978311 Tb 9.98414906 0.02125188 9.96693421 -0.03842771 -0.16021397 0.13528117 Tb 12.49194909 2.54714968 10.04604864 0.22401552 -0.04771049 -0.11963943 Tb 12.52307609 0.02398457 12.45938231 -0.30419885 0.26049175 -0.26816718 Tb 10.05202468 2.58337876 12.50287477 -0.15985015 -0.14256221 0.14374164 Tb 0.00299002 4.98652668 10.00314256 -0.15137762 0.04619085 -0.08621800 Tb 2.48223354 7.54147195 9.96167702 0.05141380 -0.14762193 0.12718261 Tb 2.50819896 4.97506697 12.52353587 0.07976885 0.12117911 0.11337593 Tb 0.03266803 7.51472022 12.51472281 0.09363926 0.00575310 -0.14094945 Tb 5.02800490 5.01266639 10.02839067 -0.20937543 -0.10255617 -0.02389680 Tb 7.47920060 7.48232772 9.99324673 0.14534813 0.18224633 0.11866064 Tb 7.48947164 5.02261786 12.55349852 0.00227911 -0.06671379 0.17283786 Tb 4.99738748 7.53322140 12.50229238 -0.10148964 -0.03574536 0.22672906 Tb 9.95768300 5.02170844 10.01033786 0.11641353 -0.03227036 0.04094638 Tb 12.52821014 7.53778627 10.03820585 0.16017769 -0.01410521 -0.18649292 Tb 12.54181674 5.06447625 12.44199938 -0.03623045 -0.05108406 0.00448289 Tb 10.03993202 7.47471008 12.53813794 -0.17030599 0.09611816 0.10604826 Tb 0.03418815 10.04317373 9.95697873 -0.29417513 -0.10443881 0.13268804 Tb 2.45244083 12.54142605 9.95671605 0.25025885 0.14427188 0.16004330 Tb 2.49252069 10.00788130 12.49129226 0.04596380 0.05791557 0.14070854 Tb 0.04002636 12.52988184 12.50804407 0.25606237 -0.28082656 -0.27648968 Tb 5.01931085 10.03028040 10.02241384 -0.16714662 -0.03815328 -0.11363105 Tb 7.48108086 12.47184975 10.01599649 0.17298731 0.25720389 -0.07997659 Tb 7.49657324 9.96720955 12.48053364 0.14186967 -0.04416852 0.23785434 Tb 5.05036390 12.49416050 12.53237286 -0.14153527 -0.09610834 -0.13777438 Tb 10.05675905 10.00959662 9.95819336 -0.20676635 -0.10064523 0.17894744 Tb 12.45590233 12.45974004 10.00350504 -0.00998567 -0.05661529 -0.06776044 Tb 12.45707571 10.00104289 12.55345367 -0.09813162 -0.06977101 -0.11242028 Tb 9.96481177 12.48479541 12.48781596 -0.09047648 -0.11086245 -0.09190482