64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=17.990625454786063 stress="-0.001012368923721197 -0.00044132362666129526 -3.5354662331898224e-05 -0.00044132362666129526 -0.0009005296493385245 -0.0001629464756900172 -3.5354662331898224e-05 -0.0001629464756900172 -0.0005860517942635217" free_energy=17.990625454786063 pbc="F F F" Si 35.46125327 34.75719783 34.59897866 -1.63889662 -2.50834786 -1.11279549 Si 36.47620212 36.34652551 35.34224340 -9.76551807 -9.91284441 0.98176906 Si 37.64169878 37.61005647 35.34049754 10.66820523 11.78898857 0.72859984 Si 39.02502922 39.12633463 36.13110533 -7.85354242 -6.50111084 10.84102649 Si 37.51686300 35.23019854 37.57132378 -7.71125272 5.13719370 0.25606929 Si 38.66386972 36.68300590 38.69445404 -65.53545695 -2.41139105 33.43223439 Si 35.91606586 36.98590141 37.67231423 6.33169030 -3.06366830 1.44226375 Si 36.66265278 38.93363838 38.91899002 -3.33616033 -6.03754393 -2.90000775 Si 39.79798175 35.04375631 34.70912019 0.00000000 0.00000000 0.00000000 Si 41.75938237 36.99569977 36.90228075 7.42805114 -1.21477126 -7.16262388 Si 42.44172459 37.51426011 34.81277780 -2.20597243 -0.73216110 -0.45459956 Si 43.96735612 37.94635882 36.18609784 2.49066420 0.78816011 1.55433253 Si 41.71154647 34.82461244 37.32688397 0.37163937 -0.59829380 -0.00909021 Si 43.89779506 36.02092114 38.74006651 -4.30734122 4.39873322 4.37145371 Si 39.79459957 36.73129353 37.97434521 49.70063678 5.42862962 -45.19074937 Si 40.83910862 38.36287416 38.37859478 2.21221447 12.29966400 7.66504695 Si 34.56691485 40.01153482 34.71238529 3.22777948 1.55358577 3.60343914 Si 36.12858880 40.76567701 36.44823237 -0.15317754 6.73565064 -8.57872902 Si 37.43754645 42.23142533 35.24273086 -5.21158054 -5.50097318 4.28730437 Si 39.62916908 43.90944481 36.10151413 0.00869778 -4.29996499 4.02065356 Si 37.70055288 40.29714913 37.85304818 -34.97511136 -26.00079782 -53.33665137 Si 38.40503041 40.80403308 38.87092295 36.07726457 28.21642225 53.01465979 Si 35.14766645 42.52097969 37.78185564 -20.59436714 -26.78374593 -14.89658157 Si 36.06053377 43.63146257 38.31634164 21.73969214 24.19373073 13.76480580 Si 39.92162521 39.74469792 34.78156831 9.16933535 6.61449248 -12.24160683 Si 41.06939718 41.32731518 36.94392738 34.77219452 -25.08140823 -14.51202564 Si 42.49116964 42.78748862 34.81882234 7.62082743 1.56771018 10.21141847 Si 43.91439302 43.08026547 36.72585012 -7.62082743 -1.56771018 -10.21141847 Si 42.96522721 39.75439459 37.80820902 -12.77942340 -33.01924528 -13.83850268 Si 43.46963622 41.05539633 38.35320685 11.88677017 34.53328301 14.93151339 Si 39.94151616 42.10433959 37.45003087 -32.79030374 31.01399497 8.72104898 Si 41.32550802 43.67010011 38.95988817 -27.34931781 20.22928996 -17.03988484 Si 34.68462472 34.83168652 40.11480767 -0.69815473 -0.98663755 -0.16249067 Si 35.75203356 36.63688112 40.44508176 -24.74281250 -18.09448601 0.42522621 Si 37.04355814 37.53298454 40.48941518 21.13622590 14.93896995 0.20736035 Si 38.69751650 38.67139371 40.88921942 -14.93379741 -9.69817496 9.72583546 Si 37.00121598 35.02048984 42.55959378 0.34648450 0.42186522 0.16473646 Si 38.40102920 36.65565462 43.03339806 -8.05473396 -7.79156425 2.30511411 Si 35.08205805 37.75156541 42.74673192 -6.05848024 -8.92977364 -6.82997886 Si 35.85694090 38.99211558 43.77742475 10.51520409 10.74072523 4.39131283 Si 40.12996245 35.44332522 40.01627639 3.96461710 -11.11999644 12.38477846 Si 41.12491845 36.55784401 41.54860697 0.50362243 -0.19743764 0.97758854 Si 42.65347622 37.31796343 40.11944526 5.14026314 -4.91958903 -6.88580255 Si 43.62647937 38.55183364 41.53966064 -1.12285820 5.35609919 6.02986579 Si 42.42035798 34.85158722 42.02864737 0.99328092 -1.28017894 0.94874001 Si 43.74616128 36.34303122 43.85512842 0.00000000 0.00000000 0.00000000 Si 39.73250976 37.93711901 42.72510277 1.44199403 -0.58495666 -3.15399079 Si 40.76107023 39.17717704 43.60976866 13.18870697 9.92821137 4.55907481 Si 35.22251000 40.24364830 40.39090109 -18.47732162 -18.44260478 -8.56986065 Si 36.30800575 41.30517182 40.93842517 9.84055741 10.45817807 16.60295342 Si 37.24120044 42.43450067 39.86365884 8.54474848 10.46927209 -6.54440725 Si 39.14927955 43.41172678 41.09963249 -3.92874117 1.54749703 -2.26522313 Si 37.74014761 39.95895876 43.01266081 -8.14160517 -6.89172782 1.49229743 Si 38.80881729 41.52109014 43.35720695 1.19330901 3.60584799 2.45490837 Si 35.13697853 42.43632579 42.37030898 -0.24755933 0.80615156 1.54994163 Si 36.76741980 43.95171837 44.03043446 0.00000000 0.00000000 0.00000000 Si 39.92293429 39.53900512 40.19919299 20.68679417 9.50189379 -15.01032409 Si 41.19635628 41.47405928 41.36196296 12.59624359 -25.92127915 -18.67270819 Si 42.40208399 42.87458466 39.63213332 28.24197104 -21.74332769 15.94687413 Si 44.04888630 43.57310531 41.56402100 0.00000000 0.00000000 0.00000000 Si 42.97445749 39.94774168 43.19979022 -17.64808680 -28.15487561 -11.58167390 Si 43.76227964 41.25842636 43.66771988 13.03580820 22.38524392 8.39937062 Si 40.67144972 42.63920620 42.23960379 -7.71320034 24.45882271 16.38015151 Si 40.95900493 43.32552900 44.18518579 0.52010729 0.87228100 2.38795709