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=920.0766341952276 stress="-0.002766007440677425 -0.00011108995776116886 -4.187602334556586e-05 -0.00011108995776116886 -0.0027184165176465103 -5.7189061538631786e-05 -4.187602334556586e-05 -5.7189061538631786e-05 -0.002705816266316662" free_energy=920.0766341952276 pbc="F F F" Si 34.73334514 34.83168652 34.86354409 -3.79981196 -4.73188311 -3.86036086 Si 35.75203356 36.63688112 35.83824509 -6.27825781 -4.57056896 -4.75494284 Si 37.10112862 37.79785791 35.31841281 -2.08747416 -1.89362448 -10.52605644 Si 38.69751650 38.67139371 35.88921942 -1.37961260 -2.10681467 -6.62393429 Si 37.26521424 35.02048984 37.24380690 -1.13499667 -9.76972798 -2.39197918 Si 38.40102920 36.65565462 38.62707843 -0.96060965 -9.57081726 -1.36866832 Si 34.86230136 37.75156541 37.74673192 -11.55503034 -4.10648182 -2.27515704 Si 35.85694090 38.99211558 38.81343399 -4.28618775 -3.56660002 -4.99778658 Si 40.12996245 35.44332522 35.29863537 -1.65947771 -8.21391150 -8.13610861 Si 41.34929664 36.51987678 36.24182058 4.12814030 -4.81560309 -5.46853097 Si 42.55165555 38.19124454 35.11944526 3.50447657 -0.62123316 -11.73834823 Si 43.62647937 38.36571675 36.53966064 11.40919285 -1.24612954 -2.75397527 Si 42.34018430 34.92903594 37.73799713 3.14722452 -9.76302370 -2.24394785 Si 43.80534914 36.15095341 38.73947784 9.47606846 -4.70071126 -0.52589099 Si 40.09411349 37.55836878 37.78301330 1.32391932 -4.62893908 -3.68975538 Si 41.19046025 38.78640482 39.00032572 6.34338586 -4.15661945 -2.49253162 Si 35.22251000 40.24364830 35.39090109 -10.76752650 -2.94140030 -8.70089800 Si 36.30800575 41.30517182 35.93842517 -2.06928146 4.32011739 -3.40909223 Si 37.31505025 42.43450067 34.99880483 -0.59975398 6.78510460 -10.05718681 Si 39.14927955 43.29262288 36.09963249 -5.11362846 11.26267500 -7.91992673 Si 37.74014761 39.53327421 37.84838244 -1.40095399 1.94042775 -3.68149525 Si 38.49300859 41.52109014 38.68124647 0.16705041 5.48723973 -0.85185522 Si 35.06754574 42.05695144 37.58992561 -9.59075765 5.49307664 -0.63644460 Si 36.55281345 43.98515741 38.59919096 -3.08858803 10.16171484 -1.22992701 Si 39.92293429 39.53900512 35.19919299 4.47877598 3.22649705 -11.96837529 Si 41.19635628 41.78611550 36.36196296 11.44614659 -5.80469230 -10.47396433 Si 42.40208399 42.87458466 34.63213332 3.33095470 3.54766024 -7.84310760 Si 44.20906900 43.33604388 36.71914856 6.05725685 4.88168743 -1.91778200 Si 42.58683335 39.86511703 37.93579195 5.97392214 0.61483005 -3.82136153 Si 43.76227964 41.25842636 38.30991366 11.42943100 3.58321061 -1.32890025 Si 40.29763519 42.63920620 36.93703229 -3.30371125 11.46593800 4.69639449 Si 40.86367604 43.67006226 38.87854831 1.69368781 10.45671874 1.24446909 Si 35.37054360 34.96545013 39.61386143 -6.19383194 -7.08956731 -0.35693450 Si 36.57894161 35.95214372 41.36515582 -3.48102983 -4.63775843 1.87211503 Si 37.49942435 37.96366766 39.64764578 -4.66321550 -3.44831976 3.58032417 Si 39.04368674 38.51708099 40.76725030 -2.05203686 -0.34186496 6.26306263 Si 37.37118449 34.79482210 42.69533077 -0.84089421 -8.10671381 6.32922921 Si 39.68593347 36.41611730 43.74400789 -2.11957216 -4.44651677 10.46556229 Si 35.10374949 37.24859303 42.46763961 -8.45519949 -3.43395799 4.45492451 Si 35.86643570 38.94296466 43.31574899 -5.05515041 -0.93056068 9.66439391 Si 40.21013950 34.67953345 40.06317802 -1.33128191 -11.70311094 -2.49411959 Si 40.80658407 35.77745244 41.37488659 1.91526265 -6.64118203 3.30076931 Si 42.71948410 37.88826415 40.10373963 6.78449174 -2.68813613 1.46991756 Si 44.24566835 37.96382356 41.37884593 10.76308060 -0.52376113 3.73064095 Si 42.63629877 34.67536678 42.13986266 4.87139485 -7.93271475 2.61249070 Si 43.49044499 36.27333546 44.03717801 4.37530613 -1.81457759 6.01773987 Si 40.32314527 37.57186071 42.07750744 -0.02028505 -1.53944953 5.21845141 Si 41.18197790 38.76239893 43.41958417 0.06408693 -1.14750379 11.53311660 Si 35.11824608 39.74564588 39.80882088 -15.64774203 4.53787060 7.64446528 Si 36.20127958 41.50126359 40.85683667 -20.10200684 -6.99850866 11.41726846 Si 37.06457269 42.23512663 40.28804605 11.46805880 18.81043952 -7.31791904 Si 39.06578688 43.51412584 41.64537504 -7.52320681 11.70221805 -1.83742396 Si 36.97467726 40.16376831 42.27562181 -0.83413432 -0.07989743 6.00343416 Si 38.30869502 41.22278898 43.85182066 0.42848813 1.23039399 9.50259182 Si 34.50053342 42.78144579 42.58017368 -8.34526352 2.45704429 1.47430395 Si 36.00127724 43.49111067 43.69081214 -0.37238362 5.48951279 6.22466803 Si 40.19207782 39.77111732 39.63839627 -2.85542674 7.20953397 3.16337272 Si 41.62875023 41.19208948 40.82060998 0.32000860 1.98298122 4.18573891 Si 42.89077222 42.10944294 40.16222698 9.04174033 7.23699264 0.38595354 Si 43.86910390 43.91427837 41.89154213 5.08870553 5.81317778 1.25923675 Si 42.17596048 40.06943278 42.87937435 5.27266985 2.56547262 5.64292606 Si 43.71745909 41.46460634 43.71656096 6.69915305 1.56028402 5.89490016 Si 40.21643940 42.95798776 42.33981730 6.53740681 2.11003903 7.55388027 Si 41.48706143 43.59487244 44.13762414 1.42883385 4.78002479 6.88834656