108 Lattice="12.499885722237194 0.0 0.0 0.0 12.499885722237194 0.0 0.0 0.0 12.499885722237194" Properties=species:S:1:pos:R:3:forces:R:3 energy=-202.50660932781568 stress="-0.003900205081467837 -0.0009210029272851781 -0.0009017987327722952 -0.0009210029272851781 -0.004045102584690641 0.00039018470202440813 -0.0009017987327722952 0.00039018470202440813 -0.003931087338200323" free_energy=-202.50660932781568 pbc="F F F" Ag 0.00258006 0.03128849 0.03081291 -0.14403985 -0.21743577 -0.18273776 Ag 2.08691578 2.08942533 0.02006688 0.51456659 0.31925752 -0.41155675 Ag 2.08148031 0.01746994 2.11694948 0.46154348 -0.34865387 0.24484777 Ag 0.03637474 2.11666233 2.04568198 -0.40401424 0.24608241 0.64099137 Ag 4.17902513 0.00085274 0.03771770 -0.11409857 -0.20866966 -0.24356741 Ag 6.23812246 2.08498264 0.00361326 0.10168869 0.36377869 -0.31252955 Ag 6.22135487 0.04140237 2.10340284 0.36108920 -0.30597763 0.37504192 Ag 4.18124354 2.10641189 2.10264155 -0.19276881 0.23338001 0.48763592 Ag 8.37356644 0.01925633 0.03019937 -0.47860356 -0.29712392 -0.30465127 Ag 10.41758509 2.10641659 0.00915080 0.39128573 0.21568265 -0.34301649 Ag 10.38573669 0.03103317 2.11588638 0.49152094 -0.46400755 0.10500948 Ag 8.36648786 2.10391450 2.06723871 -0.91829280 0.37774856 0.55742928 Ag 0.00039428 4.15730262 0.00849822 -0.18489953 0.20241607 -0.19249823 Ag 2.09625956 6.21824775 0.00900459 0.36129845 0.15177331 -0.30513736 Ag 2.12313072 4.19021605 2.09850600 0.09012729 -0.06252022 0.46271942 Ag 0.02951760 6.28259270 2.11136339 -0.30446953 -0.42035784 0.20933082 Ag 4.15990358 4.17811529 0.04088581 0.09360921 -0.06156947 -0.38669143 Ag 6.23801193 6.23250447 0.01387635 0.03292105 0.06798199 -0.13750121 Ag 6.21145865 4.13189778 2.10155539 0.34871065 0.22606315 0.38228430 Ag 4.16399507 6.26039324 2.10993912 0.11354452 0.14881727 0.21917727 Ag 8.34166115 4.17478055 0.01454207 -0.62336715 -0.01202660 -0.36786091 Ag 10.40525995 6.21726498 0.01074730 0.17572474 0.17632060 -0.24802151 Ag 10.37643819 4.17736851 2.06235232 0.53595238 -0.02602823 0.56299348 Ag 8.30701580 6.22181490 2.12339971 -0.40899123 0.17584919 0.06114347 Ag 0.01816979 8.29402616 0.03412525 -0.31375949 -0.09641951 -0.40826122 Ag 2.11479709 10.40717223 0.03407078 0.12529684 0.40520650 -0.47268554 Ag 2.08671515 8.35300645 2.04596654 0.49960177 -0.68558370 0.69819091 Ag 0.03640255 10.43228855 2.08214825 -0.45557899 0.21111290 0.20150662 Ag 4.17914794 8.36853744 0.00364551 -0.05543367 -0.74107245 -0.34084465 Ag 6.23624419 10.37855156 0.01767795 0.03429672 0.44971967 -0.21992840 Ag 6.24103981 8.33501588 2.08115138 0.12601313 -0.54726838 0.52776509 Ag 4.14494250 10.37841761 2.11310674 0.16204595 0.52205092 0.26884367 Ag 8.33139130 8.35719539 0.01938740 -0.27933579 -0.57132581 -0.21309378 Ag 10.40283463 10.40955055 0.02041169 0.14216926 0.14290303 -0.07321183 Ag 10.43431633 8.29762172 2.08886499 0.15402914 -0.11126203 0.25149344 Ag 8.31973835 10.45369970 2.11868245 -0.22468387 0.12577351 0.31787215 Ag 0.02076103 0.03732936 4.16825670 -0.35047644 -0.18151795 0.00534640 Ag 2.09744931 2.08847373 4.18771181 0.38272272 0.57543940 -0.22560286 Ag 2.11842602 0.01254928 6.20832011 0.21700562 -0.46218651 0.19006128 Ag 0.03215165 2.07094723 6.29495945 -0.51216815 0.50320431 -0.28463863 Ag 4.19075043 0.01680661 4.18317290 -0.00623160 -0.31149885 -0.15940661 Ag 6.27723892 2.09101711 4.19533574 -0.22661526 0.65329674 -0.32975688 Ag 6.29050585 0.03864604 6.20933071 -0.45034874 -0.58591232 0.25176820 Ag 4.15781660 2.07176192 6.20868745 0.26209269 0.69419372 0.31517798 Ag 8.37058790 0.03341461 4.19365819 -0.66944327 -0.53552828 -0.32192083 Ag 10.38983448 2.06251462 4.13637737 0.45337978 0.81444525 0.24634284 Ag 10.42285873 0.03187148 6.20830863 0.26640612 -0.29697164 0.16381933 Ag 8.27593011 2.06712459 6.22203929 0.21805000 0.85034297 0.25839177 Ag 0.00935524 4.13676830 4.15901553 -0.12635384 0.21414611 0.16580665 Ag 2.09137942 6.27956236 4.17726539 0.45699542 -0.28653600 0.20083980 Ag 2.08072879 4.12600600 6.27938711 0.53022723 0.45677965 -0.35829477 Ag 0.03520889 6.26142974 6.29112293 -0.16081424 -0.15870619 -0.28232020 Ag 4.16342780 4.20549953 4.14021776 0.09815954 -0.16698884 0.50126277 Ag 6.26895100 6.25029198 4.16095419 -0.33337397 -0.14209406 0.11445515 Ag 6.25077712 4.16495314 6.28178453 -0.07441586 0.11079090 -0.26427907 Ag 4.17648901 6.22503632 6.27235562 -0.03934879 0.23625000 -0.29458190 Ag 8.33456224 4.17799231 4.16776681 -0.51068774 -0.06461763 0.11006074 Ag 10.44348858 6.24783780 4.12724142 0.21292270 -0.08917320 0.21532471 Ag 10.39158480 4.19290694 6.22643462 0.21780725 -0.22339535 -0.14045203 Ag 8.33100028 6.29134262 6.22282558 -0.47241453 -0.30011501 0.25353935 Ag 0.03190956 8.29263801 4.15794642 -0.35988828 0.05751037 0.22090730 Ag 2.04605164 10.43542300 4.13644108 0.46225185 0.21439620 0.18592550 Ag 2.11276270 8.37485334 6.24794791 0.27697453 -0.83637909 -0.05390706 Ag 0.02879460 10.43829929 6.27993820 -0.24804046 0.17124583 -0.17743222 Ag 4.15621656 8.32970084 4.15248963 -0.00087598 -0.60295439 0.16439915 Ag 6.21157773 10.38620529 4.16192960 0.20437710 0.29437430 0.11253076 Ag 6.26682397 8.32098948 6.21149672 -0.34472922 -0.41233486 0.37990223 Ag 4.12958513 10.38078250 6.22615600 0.30686618 0.39553795 0.04825864 Ag 8.33948915 8.29550790 4.18027747 -0.43670557 -0.06589738 -0.33979214 Ag 10.41316604 10.38203847 4.19665494 0.21602182 0.32070362 -0.18985986 Ag 10.42313778 8.34766888 6.21348054 0.31528094 -0.57689206 0.31670450 Ag 8.33124828 10.38374287 6.26321540 -0.49212119 0.38190404 -0.17655242 Ag 0.03160920 0.03875445 8.31731991 -0.39038692 -0.48661630 -0.28621552 Ag 2.07628558 2.08815736 8.29797576 0.72421904 0.42999741 -0.14043527 Ag 2.04908367 0.02104116 10.37584523 0.24899204 -0.39823847 0.47320903 Ag 0.00965712 2.08934125 10.41805351 -0.32804755 0.30925808 0.22867475 Ag 4.13000713 0.00353542 8.37454644 0.29944624 -0.27540178 -0.66492031 Ag 6.23345685 2.05238311 8.31703931 -0.26332894 0.74084243 -0.24041635 Ag 6.25857454 0.03080055 10.44610292 -0.13069824 -0.36025039 0.16431772 Ag 4.12589000 2.05050172 10.45781992 0.19599043 0.57124407 0.09897019 Ag 8.32052744 0.02544783 8.31349857 -0.10893046 -0.44162951 -0.21363229 Ag 10.44033175 2.07233801 8.29324663 0.13925029 0.31620483 -0.26327966 Ag 10.44300202 0.00112640 10.43151376 -0.00311478 -0.00525529 -0.00261244 Ag 8.29548126 2.05766332 10.42037773 -0.06740117 0.56329871 0.20089819 Ag 0.03368188 4.20670814 8.36109267 -0.45874129 -0.16235465 -0.42958688 Ag 2.11173090 6.25165589 8.34462684 0.36685691 0.14867838 -0.61171322 Ag 2.08842693 4.13835830 10.38728541 0.29443963 0.09219794 0.42889217 Ag 0.02339610 6.28933916 10.38698805 -0.17368887 -0.03155120 0.35003139 Ag 4.15469554 4.20649944 8.33304560 0.06674850 -0.61743104 -0.41343489 Ag 6.21614073 6.21833652 8.36856198 0.23820029 0.30932975 -0.74480316 Ag 6.21021407 4.18013980 10.40793320 0.12870922 -0.25282053 0.20456061 Ag 4.12270104 6.22720599 10.43557508 0.17215375 0.18755550 0.32357310 Ag 8.35362389 4.16847080 8.31096869 -0.65199236 -0.12464739 -0.20498568 Ag 10.38842299 6.21891968 8.30968600 0.28373870 0.27403038 -0.11868675 Ag 10.44548647 4.09456775 10.41120115 0.00302772 0.20593801 0.15483725 Ag 8.29747378 6.28598812 10.41303590 0.04071453 -0.34910211 0.27000414 Ag 0.01293190 8.33551134 8.30637623 -0.35388008 -0.22798034 -0.17214204 Ag 2.10458699 10.38131323 8.33877088 0.36038045 0.61049478 -0.26878703 Ag 2.11684215 8.35713466 10.37723674 0.22212182 -0.40507367 0.53374486 Ag 0.04491463 10.43081563 10.42487892 -0.14936316 0.07928865 0.08136911 Ag 4.18296712 8.34322552 8.34717944 0.23254961 -0.53056854 -0.54015018 Ag 6.24173707 10.44171659 8.35280531 -0.08873576 0.21053466 -0.51849241 Ag 6.26021825 8.32838842 10.41284279 -0.33161407 -0.29544664 0.36050089 Ag 4.18827888 10.44162631 10.45304209 0.00250750 0.16300665 0.16718299 Ag 8.30574679 8.35544787 8.35500356 -0.27911615 -0.65145010 -0.60633200 Ag 10.37690047 10.41241432 8.33387451 0.31662872 0.28855136 -0.24390390 Ag 10.44071400 8.35500999 10.42053010 0.16405719 -0.39052713 0.14761095 Ag 8.31753120 10.40936029 10.45065331 -0.21887987 0.27641642 0.26364401