108 Lattice="18.60007335112093 0.0 0.0 0.0 18.60007335112093 0.0 0.0 0.0 18.60007335112093" Properties=species:S:1:pos:R:3:forces:R:3 energy=-10.843765780342608 stress="-0.00018958466634655171 -2.6926095258310746e-07 -1.621003478981729e-05 -2.6926095258310746e-07 -0.0001992778611298502 3.8188959015873883e-07 -1.621003478981729e-05 3.8188959015873883e-07 -0.00021181206098462346" free_energy=-10.843765780342608 pbc="F F F" Xe 0.00266208 0.04260065 0.05634861 -0.01372646 -0.00803538 -0.01206807 Xe 3.13569650 3.04182761 0.02803364 -0.01331559 0.04032957 -0.01810095 Xe 3.08197237 0.01924180 3.05975865 0.02071985 -0.02157238 0.03584677 Xe 0.03226347 3.07526128 3.17776331 -0.01095062 0.02309530 -0.00864945 Xe 6.15699599 0.05364220 0.00824454 0.02195395 -0.02105734 -0.01532700 Xe 9.33907661 3.14308234 0.02984455 -0.01088437 -0.01257983 -0.02147288 Xe 9.27681193 0.01761635 3.09993401 0.00475927 -0.01388760 0.00953044 Xe 6.21077621 3.10331502 3.05023615 -0.00962347 0.00892908 0.03954581 Xe 12.40174895 0.05606478 0.03393635 -0.01568323 -0.01811130 -0.02180910 Xe 15.52420491 3.07488784 0.01366810 0.00889809 0.02196653 -0.01360371 Xe 15.45708810 0.05747141 3.04557851 0.02377972 -0.03178388 0.01913724 Xe 12.41726983 3.06200637 3.11505636 -0.02717472 0.03959837 0.01589114 Xe 0.03020774 6.19128416 0.06927019 -0.01478071 -0.01967262 -0.01369395 Xe 3.06143771 9.22844613 0.05456604 0.03272809 0.01972927 -0.03990686 Xe 3.13649835 6.24417384 3.09179481 0.01171699 -0.02058189 0.03519807 Xe 0.04955274 9.30068021 3.05163815 -0.02898830 -0.00304785 0.04254589 Xe 6.20649423 6.16541474 0.02017151 -0.00350152 0.01452395 -0.02316579 Xe 9.27412010 9.39291050 0.02796410 0.01083544 -0.01620802 -0.01304899 Xe 9.24612096 6.17414722 3.04696197 0.01804193 0.01339714 0.04052454 Xe 6.24402681 9.35085546 3.04913598 -0.01730185 -0.01617012 0.03875842 Xe 12.39883378 6.15418020 0.04171881 -0.00202657 0.01469371 -0.01471537 Xe 15.51494542 9.29617518 0.04563122 0.00843583 -0.00853392 -0.02679955 Xe 15.53680277 6.22901916 3.09196787 0.00930250 -0.01725308 0.01417378 Xe 12.44573591 9.25135050 3.07240244 -0.03687155 0.01684691 0.01781316 Xe 0.00997134 12.42365823 0.01334656 -0.00913130 -0.00804954 -0.01747841 Xe 3.09957931 15.55180757 0.04063831 0.00699250 0.00796318 -0.00600260 Xe 3.07301053 12.33820766 3.04108360 0.02230980 0.00968326 0.03699557 Xe 0.04689084 15.45220880 3.13640355 -0.01928296 0.01267541 0.00297381 Xe 6.15605166 12.46138547 0.03182536 0.00167541 -0.02193296 -0.02121068 Xe 9.28707399 15.46370005 0.03944008 0.00250922 0.01092125 -0.01660604 Xe 9.29370428 12.43665032 3.15903554 0.00955958 -0.03580258 0.00005345 Xe 6.23989464 15.45405840 3.12272808 -0.02180160 0.02741570 0.00509448 Xe 12.42200165 12.40432762 0.06187784 -0.01845894 -0.01254915 -0.01735501 Xe 15.43890068 15.49757651 0.01500772 0.00686488 0.00906933 -0.00262227 Xe 15.53661312 12.34499003 3.03803412 0.00454746 0.01117804 0.02844969 Xe 12.33005577 15.49544099 3.11456839 0.02432689 0.01101246 0.00589408 Xe 0.03625550 0.05359389 6.23529942 -0.01390179 -0.02518726 -0.00758021 Xe 3.12717075 3.08330196 6.22035146 0.01865065 0.01198800 -0.01957513 Xe 3.04069815 0.04911630 9.33293738 0.02103967 -0.02869056 -0.01368039 Xe 0.03713284 3.11205310 9.24333686 -0.02681648 0.00894672 0.02910527 Xe 6.21064137 0.04327141 6.23791743 -0.01511672 -0.01646113 -0.00569117 Xe 9.24503513 3.06470864 6.18944573 0.01857372 0.03681294 0.00707911 Xe 9.24930501 0.03012543 9.34966060 0.01132250 -0.00973301 -0.01283659 Xe 6.15460342 3.14488201 9.33007280 0.02555011 -0.00037829 -0.01061214 Xe 12.44522366 0.04538323 6.24477986 -0.03438182 -0.02993803 -0.00933569 Xe 15.45985074 3.05047554 6.15286655 0.02666212 0.03413232 0.01095668 Xe 15.50324138 0.03022579 9.31865835 0.00783952 -0.00490413 0.00970821 Xe 12.40044862 3.09631671 9.25773731 -0.02165760 0.02074819 0.01986912 Xe 0.04469019 6.14452179 6.22005191 -0.01326349 0.03039748 -0.01480470 Xe 3.10022356 9.33897612 6.27533079 0.01638557 -0.01043615 -0.02191312 Xe 3.05944252 6.16412140 9.26586853 0.01983104 0.02040145 0.01731923 Xe 0.03053853 9.31628703 9.35440128 -0.01998855 -0.00363645 -0.01010652 Xe 6.15083719 6.17599308 6.25305584 0.01699119 0.01822431 -0.02187361 Xe 9.32106445 9.24290426 6.16499153 -0.02092221 0.01863836 0.00992425 Xe 9.27020947 6.22338651 9.32454163 0.01212525 -0.01705020 -0.01301870 Xe 6.17621472 9.30895271 9.36026276 0.00483407 0.01435685 -0.03456340 Xe 12.41971632 6.25412842 6.17702509 -0.01867624 -0.03605205 -0.00332795 Xe 15.49117145 9.33839561 6.17651239 0.01859991 -0.01485284 -0.00043141 Xe 15.47823356 6.13205737 9.32956958 0.01229976 0.01626102 -0.01786388 Xe 12.44322928 9.26382220 9.22858137 -0.03105913 0.01272353 0.02841688 Xe 0.01871294 12.38557209 6.23740766 -0.01282958 -0.01257101 -0.00907010 Xe 3.07396740 15.49649487 6.18388102 0.01641935 0.00820565 0.00210588 Xe 3.06781917 12.44856446 9.33567285 0.03628741 -0.02432392 -0.01355331 Xe 0.03290376 15.45574363 9.33094912 -0.02039929 0.02104516 -0.00674291 Xe 6.15890020 12.45223097 6.16640989 0.01083873 -0.03160004 0.02535672 Xe 9.33677940 15.54457600 6.14422556 -0.01600760 0.00701069 0.03243906 Xe 9.27499295 12.44753050 9.30359640 -0.00097592 -0.02840011 -0.01211615 Xe 6.15706913 15.55088304 9.31256947 0.01186838 0.00401760 -0.01050896 Xe 12.38912511 12.39562699 6.21888132 -0.00625329 -0.00658751 -0.00825340 Xe 15.56023356 15.44446178 6.13862498 -0.00751831 0.00416751 0.00417280 Xe 15.54491534 12.36225317 9.24283199 -0.00374311 0.00545798 0.02105282 Xe 12.34062218 15.51135566 9.35265547 0.01210684 0.00150525 -0.00955806 Xe 0.00225301 0.06128907 12.45283645 -0.01619982 -0.01849862 -0.02655101 Xe 3.15081277 3.06236008 12.35091543 -0.02013759 0.04331378 0.01242700 Xe 3.10396985 0.01306594 15.45840222 0.01345358 -0.01310535 0.01654122 Xe 0.02257540 3.05701942 15.46421409 -0.00838163 0.02392357 0.01745040 Xe 6.12947166 0.03394749 12.34014812 0.02189818 -0.02207129 0.00961534 Xe 9.32535001 3.04728378 12.43320771 -0.02735578 0.04729951 -0.02770147 Xe 9.26532720 0.01959251 15.48481533 -0.01266449 -0.01603425 0.01181960 Xe 6.16852032 3.13474100 15.48985455 0.01807638 0.00575997 0.00254872 Xe 12.35701007 0.01290618 12.43287615 0.01076102 -0.01526991 -0.02651373 Xe 15.55745801 3.15716677 12.42502606 -0.00703975 -0.00469305 -0.00963261 Xe 15.44880688 0.07734203 15.48841895 0.01126632 -0.01074240 0.00823899 Xe 12.34399484 3.07232478 15.46251162 0.00764645 0.02853645 0.02203129 Xe 0.05175757 6.21074903 12.42077637 -0.00863057 -0.01255531 -0.01248458 Xe 3.08328933 9.33612736 12.35522001 0.02596062 -0.01019679 0.00921564 Xe 3.11600932 6.15134233 15.53245780 0.00255145 0.01776332 -0.00277425 Xe 0.03370526 9.33391325 15.44518276 -0.00896367 -0.00948707 0.01579273 Xe 6.14796456 6.24055149 12.33886068 0.00691064 -0.02238536 0.01703953 Xe 9.24129284 9.25202325 12.39871286 0.02613993 0.02405105 -0.02492198 Xe 9.35155993 6.25936167 15.49494486 -0.01883638 -0.02041375 0.00762690 Xe 6.23319794 9.28847228 15.44067761 -0.01751280 0.00942120 0.01465045 Xe 12.37759268 6.21963674 12.40757662 -0.00331433 -0.01224957 -0.01610494 Xe 15.45071150 9.27611591 12.42095231 0.02006307 0.00245835 -0.01649161 Xe 15.53649261 6.18023487 15.55146257 -0.00836627 0.00333593 0.00220291 Xe 12.39820059 9.33040281 15.45760189 -0.00801964 -0.01357329 0.02295321 Xe 0.06101852 12.44751005 12.45028172 -0.03913741 -0.01963545 -0.02219099 Xe 3.08720415 15.45706037 12.39657711 0.01786828 0.03542868 0.00063558 Xe 3.08298120 12.41775685 15.45462921 0.03049704 -0.01740617 0.02585803 Xe 0.01006587 15.48777348 15.52672491 -0.00529993 0.01032991 0.00702147 Xe 6.23868309 12.45282975 12.39256518 -0.01462971 -0.03196831 -0.01324331 Xe 9.25988924 15.51261096 12.45707248 0.00994295 0.01823178 -0.03396104 Xe 9.35550949 12.42148395 15.44488242 -0.02149890 -0.02515464 0.02399163 Xe 6.21109598 15.46845932 15.45546837 -0.00820142 0.01347414 0.02324850 Xe 12.36621464 12.34565477 12.40139769 -0.00109484 0.00195004 -0.03635098 Xe 15.47954137 15.45322635 12.44988392 0.00536393 0.00468116 -0.01962052 Xe 15.43829760 12.41180071 15.52664354 0.01064140 -0.00952153 0.00951185 Xe 12.34050028 15.49903415 15.46948490 0.00507544 0.01456596 0.01284389