108 Lattice="20.356196048279855 0.0 0.0 0.0 20.356196048279855 0.0 0.0 0.0 20.356196048279855" Properties=species:S:1:pos:R:3:forces:R:3 energy=-77.4090437033279 stress="-0.00014033970889652827 6.8970251229014816e-06 4.745869751691984e-06 6.8970251229014816e-06 -0.00011180710814950188 -5.17707990797491e-06 4.745869751691984e-06 -5.17707990797491e-06 -9.430773827734536e-05" free_energy=-77.4090437033279 pbc="F F F" Rb 0.03523389 0.02216036 0.02657077 0.03214229 0.02222417 0.03599112 Rb 3.35925042 3.40884962 0.06241240 0.04000762 0.01905562 -0.04692987 Rb 3.41525510 0.03866300 3.41602144 0.01565012 -0.03898616 0.02258736 Rb 0.05792467 3.41177655 3.32646344 -0.05061833 0.01191981 0.04393640 Rb 6.76807738 0.01727841 0.10638929 -0.01258967 -0.00148464 -0.00782818 Rb 10.19285300 3.38251308 0.01957102 0.01307516 0.03969899 -0.03492634 Rb 10.18416103 0.06329322 3.34775393 0.01104422 -0.05539643 0.02781490 Rb 6.81456797 3.40474257 3.40410585 -0.02186048 0.03597551 -0.00074359 Rb 13.57014274 0.09785956 0.10169005 -0.01855066 -0.02328596 -0.00983484 Rb 16.89853875 3.37011084 0.10845470 0.00819650 0.04011916 -0.01357781 Rb 17.00789209 0.02206425 3.39292281 -0.01314027 0.00221665 0.03892137 Rb 13.56333280 3.47372442 3.40602458 -0.00465719 0.00993783 0.03194524 Rb 0.00376322 6.78363778 0.01239404 0.00202723 0.01345527 0.00363316 Rb 3.41352814 10.23012626 0.05881966 0.00723139 -0.02256042 -0.05140463 Rb 3.37817511 6.79909863 3.44986165 0.01270904 -0.01449904 -0.01801521 Rb 0.04798530 10.21770451 3.44106780 -0.05083302 -0.01373551 0.00987391 Rb 6.82999777 6.79419979 0.01777771 -0.01202881 -0.00377289 -0.02934212 Rb 10.19376020 10.20083335 0.01320981 -0.00387407 -0.00986969 -0.03268429 Rb 10.19748814 6.83112351 3.42341481 0.00005594 -0.01145499 -0.01173791 Rb 6.71806736 10.12070877 3.40889805 0.02359870 0.02391857 0.01999016 Rb 13.60094762 6.87677317 0.01776072 -0.03477841 -0.01607059 -0.04177308 Rb 16.93923005 10.20184407 0.05813408 0.01158747 0.03304286 -0.00087473 Rb 16.99019212 6.85258327 3.34690360 0.03945617 -0.02083554 0.04277816 Rb 13.62529211 10.12569749 3.47308638 -0.02571376 0.02012222 0.00527899 Rb 0.03370906 13.57699617 0.05412881 -0.01595711 -0.02429252 -0.00972721 Rb 3.36268956 16.92148186 0.00876040 0.04499982 -0.00610059 0.00114362 Rb 3.35532410 13.51064283 3.32998993 0.03156982 0.02386097 0.06401394 Rb 0.07708808 16.95848409 3.44744509 -0.00035726 -0.00902725 0.03159174 Rb 6.79056877 13.54582914 0.05889520 0.00551916 -0.00670114 -0.03758104 Rb 10.13171340 17.01116294 0.02108354 0.00106789 -0.00913327 0.01986994 Rb 10.23954209 13.57997161 3.33521869 -0.00871381 -0.03481703 0.03694819 Rb 6.78767827 16.93235923 3.45223432 -0.03638193 0.03449698 0.00966569 Rb 13.53507299 13.50443445 0.03938607 0.00460364 0.00785795 -0.03183192 Rb 17.02773931 16.91288992 0.06137305 -0.02896817 -0.04635793 0.04482817 Rb 16.97828008 13.57673661 3.45764507 0.02132385 -0.02608182 -0.00483431 Rb 13.61081626 16.95395561 3.44605469 -0.01745282 0.03761480 -0.00790905 Rb 0.05168186 0.00162255 6.71805162 -0.01325911 0.00219827 -0.00970726 Rb 3.36415214 3.38255390 6.81862940 0.04037605 0.03149865 -0.01728034 Rb 3.43587465 0.01357620 10.11491920 0.02049727 -0.03963978 -0.00359237 Rb 0.05408656 3.37729226 10.14684803 -0.03816686 0.02756406 0.01577269 Rb 6.84766248 0.05591561 6.72443876 -0.00923682 -0.04759940 0.00923470 Rb 10.13922370 3.33627871 6.72096405 0.02972103 0.04938916 0.02279107 Rb 10.23847246 0.06210991 10.21771140 -0.02141411 -0.04547354 -0.01320411 Rb 6.82125266 3.44984444 10.19164087 -0.01743549 0.00592897 -0.02125075 Rb 13.57337341 0.03527450 6.84600503 -0.01181452 -0.03974943 -0.02365908 Rb 16.93179891 3.40759740 6.84510928 0.04515615 0.01676752 -0.03617501 Rb 17.01325167 0.06443181 10.25976526 0.00001520 -0.00809475 -0.00066094 Rb 13.62557258 3.37405937 10.17393866 -0.04016994 0.02920640 0.01166728 Rb 0.02506715 6.76390570 6.79806162 -0.04776689 -0.00604279 -0.00893264 Rb 3.39746954 10.11831814 6.74184583 0.01711107 0.01704837 0.01857018 Rb 3.42123035 6.83378848 10.22010814 0.01379835 -0.01410533 -0.01185939 Rb 0.00149306 10.11264210 10.18218156 -0.04063638 -0.00253113 0.00378828 Rb 6.80997161 6.77162279 6.72783573 -0.00016208 -0.01806721 0.01940639 Rb 10.18977234 10.11066187 6.81812881 -0.00389065 0.03388893 -0.01088487 Rb 10.23264587 6.78327596 10.22310718 0.00471077 -0.01717294 -0.00924694 Rb 6.83743888 10.16675160 10.11882841 -0.02821278 -0.00373268 0.03070773 Rb 13.52060123 6.80162841 6.80796264 0.01172721 -0.01512006 -0.00096719 Rb 17.01494504 10.22404213 6.72458807 0.03582574 -0.01097503 0.01112955 Rb 16.89753536 6.74531772 10.19584782 0.04003175 0.02050566 0.01692517 Rb 13.61756878 10.22209048 10.17919037 -0.02757385 -0.00672651 -0.00600541 Rb 0.03651898 13.55336651 6.84243276 -0.03886165 -0.01498226 -0.00986109 Rb 3.35155852 17.01676012 6.83530439 0.04337539 0.02482126 -0.01086270 Rb 3.33158828 13.58419559 10.18149280 0.05596103 -0.04000842 0.01494778 Rb 0.05456698 17.00037803 10.13576872 -0.01448014 0.00835673 0.01000962 Rb 6.82128723 13.56810056 6.80140919 -0.01820510 -0.02061739 -0.02855329 Rb 10.17168218 16.97468358 6.70105848 0.00892571 0.04101667 0.01105924 Rb 10.12289264 13.55799363 10.22910300 0.02432400 -0.00785216 -0.00834455 Rb 6.82774069 16.96130439 10.11576301 -0.01442976 0.03730243 -0.01085599 Rb 13.54748937 13.59344077 6.82045187 -0.02072987 -0.02657403 -0.00816366 Rb 17.00496458 16.92997602 6.73024322 0.00447157 -0.00599587 0.01139199 Rb 16.93371643 13.51799773 10.18757876 0.05106571 0.00678159 -0.00922215 Rb 13.55535333 16.92851189 10.14741831 -0.01679637 0.03095889 -0.00273163 Rb 0.06131044 0.00416734 13.53268641 0.00825843 0.01309465 -0.01213570 Rb 3.42880798 3.39072954 13.60779160 0.00196144 0.00851589 -0.02313445 Rb 3.35459510 0.02944399 17.00717954 0.04360241 -0.00181273 -0.00600214 Rb 0.02899674 3.41144167 17.01059331 0.00994392 0.02898725 -0.00728589 Rb 6.83449400 0.04757556 13.52185361 -0.02606607 -0.03816527 0.00182236 Rb 10.15377050 3.35463563 13.55811368 0.01714902 0.03882232 0.01689941 Rb 10.12069583 0.00187605 16.96152838 0.01589730 0.01671929 -0.00634149 Rb 6.76684879 3.40996489 16.98267275 -0.02204029 -0.00005355 0.03977155 Rb 13.53307007 0.02741849 13.51414022 -0.00378120 -0.03795866 0.01514404 Rb 17.00817912 3.34858930 13.57490974 0.02999140 0.02740987 -0.00986155 Rb 16.93717186 0.04687342 16.99592111 -0.02583516 0.02793665 -0.04202230 Rb 13.63742733 3.40965500 16.96761080 -0.04350179 -0.00102717 0.02342190 Rb 0.06664140 6.78127475 13.61298230 -0.05011715 -0.02295640 -0.03475409 Rb 3.36686025 10.12677756 13.63276172 0.04566949 0.02611608 -0.04499645 Rb 3.37696507 6.85029459 16.95947767 0.04173355 -0.02808591 0.05007248 Rb 0.03511427 10.12179375 16.91919018 -0.01491900 0.00815253 0.01793323 Rb 6.78998529 6.72292704 13.59221827 0.00148887 0.01601980 -0.00578143 Rb 10.18790256 10.16805814 13.56851120 -0.00974028 -0.00680199 -0.00675328 Rb 10.13707473 6.72560286 17.02130072 0.01045188 0.00422393 0.02553502 Rb 6.75919946 10.24252131 16.91229270 0.00808791 -0.00373067 0.04922100 Rb 13.57025317 6.82386761 13.62814540 -0.01441975 -0.01453936 -0.02438496 Rb 16.96982478 10.23488124 13.60736164 0.03738924 -0.00900571 -0.01287544 Rb 16.92379969 6.76026090 16.94603010 0.01122462 0.00142354 -0.00120621 Rb 13.52569773 10.20959777 16.94666549 -0.00379892 -0.01339074 0.04584280 Rb 0.04914540 13.51597812 13.57452445 -0.04432843 0.00773677 -0.02834962 Rb 3.45307416 16.96671494 13.53146759 0.00968496 0.04185529 -0.01753898 Rb 3.33280280 13.63244905 16.93312713 0.02618698 -0.02931660 0.03729350 Rb 0.03999602 16.97045827 16.98462446 0.03085614 -0.01759505 -0.03630678 Rb 6.81408005 13.61125222 13.62720652 -0.01625903 -0.01832136 -0.03113885 Rb 10.12222280 17.01906529 13.51323064 0.01067580 0.02912496 0.01391460 Rb 10.24015390 13.57499050 17.00797514 0.00280711 0.01224051 0.01936189 Rb 6.79733813 17.00470639 16.96944732 -0.00976787 -0.01315901 0.00696079 Rb 13.56212569 13.53460128 13.56941357 -0.01920354 0.02212997 -0.00890586 Rb 17.00403257 16.95301848 13.52269821 -0.00821550 -0.02126019 -0.02004576 Rb 16.96985026 13.56908482 16.94129158 -0.01541777 -0.01199718 -0.00434606 Rb 13.62472785 16.99710122 16.95817004 -0.02889065 -0.01455858 -0.02366348