108 Lattice="11.83968869064114 0.0 0.0 0.0 11.83968869064114 0.0 0.0 0.0 11.83968869064114" Properties=species:S:1:pos:R:3:forces:R:3 energy=-360.053975653281 stress="-0.009562225441592794 1.4491186669618259e-05 0.0003062767300593684 1.4491186669618259e-05 -0.009603838808115868 0.00018653873814819625 0.0003062767300593684 0.00018653873814819625 -0.009149752488776806" free_energy=-360.053975653281 pbc="F F F" Au 0.02586329 0.00148567 0.03583299 0.87363363 0.89267231 0.88951473 Au 1.92679504 2.00454106 0.00009042 0.31435172 -1.07726637 -0.40299792 Au 1.97206881 0.02344028 1.99832711 -0.11503740 -0.34974619 -0.67505204 Au 0.03386296 1.96505401 1.98371350 -0.47128850 -0.31718380 -0.31944306 Au 3.98330825 0.00523113 0.00611399 -0.28343583 0.64424243 0.53562465 Au 5.90095615 2.01033971 0.00053608 0.23507921 -0.58557558 -0.29161506 Au 5.91105938 0.03269105 1.95746080 0.26912497 -0.63615338 -0.57427571 Au 3.95459947 1.95917578 2.00213666 -0.08491827 -0.17807963 -0.89847591 Au 7.95931481 0.00707933 0.00659224 -0.09591808 0.83108390 0.74580627 Au 9.88201119 1.95530547 0.02661107 -0.80040448 0.00783855 0.65793746 Au 9.85698362 0.03136191 1.96651884 -0.55191213 0.53525002 -0.14711726 Au 7.87476080 1.99237108 2.00225163 0.97359790 -0.43738733 -1.11014051 Au 0.06862159 3.91837744 0.01674443 -0.39623349 0.15803296 0.10591531 Au 1.90210497 5.91131172 0.02564343 0.39797168 0.27105249 -0.53332370 Au 1.98418180 3.93007307 1.89903471 -0.21911493 0.14978184 0.57435548 Au 0.00134142 5.95104235 1.96982359 -0.51670401 -0.14645378 -0.17363556 Au 3.95812688 3.96394716 0.01415633 -0.11892845 -0.06007064 -0.55034193 Au 5.88673344 5.94569970 0.00244658 0.26250426 -0.10910279 -0.69649720 Au 5.93510072 3.96946690 1.97718948 -0.28145016 -0.30924419 -0.33908165 Au 3.98305165 5.93172339 2.00721307 -0.70124599 -0.33993445 -0.71784703 Au 7.85736255 3.97981478 0.01045410 0.66121152 -0.22754991 -0.35958990 Au 9.88546917 5.88699428 0.02776890 -0.59757426 0.15705992 0.39798710 Au 9.88040791 3.95005506 1.95324296 0.08764663 -0.06436628 -0.12653480 Au 7.85857598 5.95119037 1.95239727 0.88296682 -0.08524993 -0.27760481 Au 0.00523400 7.85387840 0.01884744 0.40517277 0.49692498 0.48742281 Au 1.92634226 9.83198857 0.01013416 0.00128469 -0.55540439 0.46883131 Au 1.97631622 7.91652688 1.97554874 -0.65145150 0.28962295 -0.42990713 Au 0.00304228 9.88859879 1.91477808 0.67657033 -0.76774470 0.06434498 Au 3.95232722 7.87033944 0.03688317 -0.35844237 0.60414013 -0.64745855 Au 5.90514418 9.90315371 0.01214227 0.02400788 -0.66634330 0.57804609 Au 5.88874765 7.89400850 1.95174129 0.34074917 0.82427772 0.01059972 Au 3.90850210 9.85714823 1.97518439 0.24453296 0.50121992 -0.31549892 Au 7.88486356 7.90557140 0.00714055 0.51541385 0.44876152 -0.26519893 Au 9.84650754 9.89971701 0.01206957 -1.01876910 -1.07074679 1.02978235 Au 9.90342624 7.87077025 1.94333147 -0.01106990 0.62155320 -0.42312410 Au 7.87037308 9.83162714 1.97410084 0.63697362 0.28939488 -0.41797597 Au 0.02866441 0.02842157 3.91208336 0.37198735 0.24508320 0.16768900 Au 2.00737334 1.97210823 3.96890049 -0.96766977 -0.44903971 -0.35984844 Au 1.99077724 0.00078209 5.96804380 -0.52838750 -0.53782979 -0.29630601 Au 0.03922362 1.94510704 5.88306558 -0.54043431 -0.21572403 0.30499473 Au 3.98191004 0.03352432 3.96248231 -0.33675209 -0.95628551 -0.27121667 Au 5.97529353 1.94152001 3.92018939 -0.55375568 0.30228265 0.30397612 Au 5.89574437 0.00143761 5.88960499 0.25091135 -0.58248249 0.37422361 Au 3.93469040 1.94820493 5.89037168 0.23358787 -0.16425963 0.57846109 Au 7.89014430 0.02676844 3.93133534 0.57733207 -0.77738204 0.04494985 Au 9.88077848 1.94206212 3.95783066 0.23306486 -0.05923824 -0.20979892 Au 9.87960705 0.02170744 5.90100077 -0.61027882 0.50119976 0.22650727 Au 7.87172111 1.96238512 5.91335633 0.81032717 -0.36499036 0.04239604 Au 0.01752967 3.97456051 3.91403521 -0.44701202 -0.33648790 0.06208306 Au 1.96343404 5.88390552 3.91488065 -0.25709208 0.32496238 0.26527377 Au 1.96358534 3.91654305 5.95263818 -0.34387834 0.23306052 -0.18668339 Au 0.01548540 5.90734295 5.91607424 -0.46671001 0.21318901 -0.03616553 Au 3.90931998 3.91089146 3.98263554 0.37607008 0.24607067 -0.44432509 Au 5.88305217 5.88044342 3.95252565 0.44862614 0.48025161 0.24484502 Au 5.90732397 3.91678570 5.94435679 0.33418302 0.15603914 -0.43587888 Au 3.97428578 5.89308641 5.94242064 -0.43818424 0.40646112 -0.23704528 Au 7.90320656 3.98586727 3.94066554 0.60480693 -0.19608072 0.04319803 Au 9.89339675 5.96544002 3.94217172 0.36431309 -0.24303385 -0.05634636 Au 9.87209098 3.90728306 5.89653206 0.36060555 0.22925328 0.11965184 Au 7.91401201 5.93226634 5.91636316 0.24127329 -0.27940793 0.06735392 Au 0.01369656 7.92634509 3.92312522 -0.23480238 0.31439173 0.14786976 Au 1.97755401 9.87894596 3.97237930 -0.50769496 0.25137563 -0.14055058 Au 1.96918214 7.86524479 5.94998226 -0.30120064 0.48008558 -0.34248778 Au 0.02653145 9.87801716 5.94371506 0.34415128 -0.49315564 -0.15748124 Au 3.92156045 7.88196510 3.92851209 0.22601082 0.65710614 0.53981684 Au 5.95290216 9.88942505 3.97775446 -0.25166991 0.13836882 -0.18079179 Au 5.95374118 7.90382577 5.93588013 -0.32688366 0.11818131 -0.46107541 Au 3.91791953 9.88465458 5.92455958 0.13469929 0.26322297 -0.05184924 Au 7.91878977 7.88115469 3.92473794 0.14341865 0.50616285 0.01061932 Au 9.89031658 9.82707005 3.95281530 -0.58392915 -0.47745530 -0.18313025 Au 9.84446693 7.92680458 5.94690604 0.78015690 0.26976377 -0.16347531 Au 7.91125950 9.83137793 5.94178399 0.48727977 0.74566709 -0.14817767 Au 0.03239468 0.00036710 7.92277714 0.53215971 0.68622891 0.15648013 Au 1.97608354 1.95623648 7.91771289 -0.62347050 -0.09795315 0.32840033 Au 2.00545542 0.03723089 9.84292440 -0.44410530 0.25797244 -0.26556677 Au 0.01006820 1.95387268 9.89738142 0.69393401 -0.09916203 -0.81113567 Au 3.92964222 0.03430337 7.89991335 0.32227168 -0.60192309 0.32032744 Au 5.90729097 1.99143718 7.88532885 -0.09075567 -0.75480961 0.65531244 Au 5.88224399 0.03772367 9.86784580 0.16278877 0.38077608 -0.47827521 Au 3.92270794 1.95538420 9.88905786 0.20812435 0.13919107 0.29972823 Au 7.85804851 0.03024199 7.87227126 0.64947059 -0.21234533 0.58715756 Au 9.87107931 1.99967626 7.90543966 0.06559153 -0.79363458 0.34417834 Au 9.84814373 0.00544158 9.87655352 -1.09203523 1.10986302 -1.10229270 Au 7.85605869 1.98555771 9.87060935 0.65302670 -0.65521113 0.18681025 Au 0.03470013 3.97662349 7.89102634 -0.80035578 -0.54437244 0.32047894 Au 1.98076070 5.88499906 7.91719471 -0.34168646 0.66786796 0.19520675 Au 1.93941289 3.95615023 9.83996988 0.05402797 -0.30551087 0.67209417 Au 0.02202936 5.88530827 9.85668481 0.29714468 0.35772913 -0.36115966 Au 3.96937985 3.95572035 7.88514667 -0.37946347 -0.45782574 0.79145041 Au 5.90228401 5.90334866 7.91601488 0.57251316 0.25372040 0.09830916 Au 5.94935680 3.96369109 9.86646474 -0.26100122 -0.13146419 0.58474120 Au 3.95441614 5.95797117 9.83623636 -0.15766516 -0.19167613 0.74560992 Au 7.88733748 3.91598658 7.89140548 0.72577830 0.38231311 0.30540483 Au 9.89912786 5.94576231 7.85646189 0.20937768 -0.31211199 0.58572525 Au 9.84947807 3.91324168 9.85187135 -0.46136235 0.15344529 -0.46324638 Au 7.91704804 5.92005782 9.83317278 0.38020496 0.02795553 0.34412659 Au 0.03051717 7.92112453 7.89306539 -0.38436494 -0.00856412 0.47943550 Au 1.92992619 9.87384577 7.87781240 0.14406719 0.20068042 0.64281672 Au 1.97317052 7.89502653 9.88623974 -0.31337670 0.44493170 -0.05040834 Au 0.01938724 9.85059447 9.83283835 0.82060636 -0.81191196 -0.76809819 Au 3.97642243 7.91355914 7.87723917 -0.59051234 0.42370441 0.47901535 Au 5.93644331 9.83197588 7.86185643 0.05393628 0.72718315 0.63193073 Au 5.91127530 7.90664663 9.82782076 0.38175379 0.32163365 0.56128903 Au 3.97460660 9.84675555 9.87713418 -0.21265878 -0.47890867 -0.65278608 Au 7.92785851 7.88406690 7.87478100 0.36826276 0.54681177 0.99842212 Au 9.90131239 9.90463821 7.91674207 -0.86141056 -0.90696736 0.25397195 Au 9.83492720 7.89023342 9.90512314 -0.53920660 0.22738006 -0.86156791 Au 7.93002726 9.83859064 9.86830670 0.10302588 -0.63366810 -0.78859246