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=215.49260454820444 stress="-0.0016491577498863425 -0.00040704968345447226 -0.00018918643176746446 -0.00040704968345447226 -0.0014546977034768246 -0.00023598367264745173 -0.00018918643176746446 -0.00023598367264745173 -0.001494341789456911" pbc="F F F" P 34.99734341 34.83168652 35.22135030 -3.57930106 -5.25295976 -4.56772124 P 35.75203356 36.63688112 36.21205962 -1.11416021 2.84873874 -4.95748502 P 37.19645751 38.24831835 35.31841281 -15.16194081 -4.56153638 -9.80057132 P 38.69751650 38.67139371 35.88921942 4.20745758 -6.69812312 11.60643967 P 36.65668272 35.02048984 37.31765671 2.40849193 -8.64745933 2.66255402 P 37.97534466 36.65565462 38.35244733 -7.17440234 -12.27927790 -5.55065800 P 34.86230136 37.75156541 37.74673192 -9.98274300 -4.16637078 -1.74474438 P 35.85694090 38.99211558 38.81343399 18.02392521 -12.40224334 -21.70768056 P 40.12996245 35.44332522 35.29863537 -9.22586776 -5.34735675 -4.86436944 P 41.53637237 36.51987678 36.02701648 -2.27203527 3.77627206 2.86000460 P 42.86371177 37.73480535 35.11944526 -4.29321082 2.63849717 -23.36506082 P 43.62647937 37.96781635 36.53966064 13.89110178 3.46665502 18.04199713 P 42.03354682 34.92903594 37.36561299 1.22093599 -6.41395008 4.42756163 P 43.80534914 36.15095341 38.96823295 1.74685767 -2.03090743 0.01983027 P 39.64093810 37.36417178 38.25760200 12.48686558 -2.77870032 -5.96614886 P 41.19046025 38.78640482 39.00032572 16.32982841 -19.78148606 -14.03003307 P 35.22251000 40.24364830 35.39090109 -18.98200312 -17.58540835 -10.05232600 P 36.30800575 41.27752958 35.93842517 12.51746926 3.67151532 10.49387596 P 37.24120044 42.43450067 34.99880483 5.54171943 9.18123752 -11.23401750 P 39.14927955 43.29262288 36.09963249 -14.21829500 20.15886731 -27.32317581 P 37.92329988 39.95895876 37.84838244 -1.92807440 -5.87018359 -6.51862269 P 38.40983348 41.52109014 38.68124647 10.03562373 1.51027733 -4.79274505 P 35.06754574 42.05695144 37.40284988 -6.97507047 2.71013675 6.88091873 P 36.47926921 43.98515741 38.38512086 0.08568017 4.83731200 -1.28620548 P 39.92293429 39.53900512 35.19919299 15.32111259 9.60638361 -9.93839462 P 41.19635628 41.47405928 36.36196296 5.44102043 -5.55233391 -1.90112173 P 42.51423779 42.58470830 34.63213332 1.08454508 1.11018379 -3.65069062 P 43.83121217 43.45308757 36.89476691 1.05040037 2.64062678 -0.12597758 P 42.58683335 39.94774168 37.93579195 -2.48216279 -5.20919103 -6.51498911 P 43.76227964 41.25842636 38.30991366 11.59605060 5.95066110 -0.08708836 P 39.80832168 42.63920620 37.23960379 11.05931435 -10.63306496 26.43664325 P 41.30980333 43.67006226 38.70591358 1.56517571 3.50237282 2.78667839 P 35.03654620 34.79417610 39.83315810 -1.37792928 -0.34686725 -0.75755675 P 36.82149993 35.95214372 41.48093396 -1.71035370 6.55056553 -7.79856390 P 37.74267070 37.96366766 39.64764578 -7.80390378 0.52793974 8.68816001 P 39.04368674 38.90001107 40.76725030 -6.31831351 1.19103441 13.70263066 P 37.56538150 34.79482210 42.69533077 3.12140745 -8.80527981 6.86039301 P 39.62330847 36.04967805 43.74400789 1.00244180 0.53185397 2.59322459 P 35.10374949 37.24859303 42.92852013 -6.22265278 -7.95611959 -0.82293402 P 35.86643570 38.97060691 43.31574899 -7.04473667 5.10589183 6.31120831 P 40.02698724 34.67953345 40.06317802 -26.18558921 -21.94795808 -31.88585349 P 40.80658407 35.32765931 41.02847820 23.22706420 17.89870842 27.14263739 P 42.97041504 38.15803234 40.35037674 -10.18125614 -0.35730153 -9.47337522 P 44.24566835 38.14124431 41.37884593 16.79877912 0.30985660 13.13911260 P 42.63629877 34.67536678 42.50664034 -0.99754052 -7.20490130 -3.15982254 P 43.50553291 35.97962417 43.63363914 3.82916309 6.44236312 5.55186394 P 40.69997019 37.57186071 41.63332075 -0.13323713 -2.83317128 0.95545195 P 41.47185425 38.76239893 43.41958417 -9.78998667 -18.10617907 13.60930553 P 35.11824608 39.74564588 39.80882088 -23.50569985 17.61880650 26.61118966 P 36.20127958 41.50126359 40.85683667 -8.11391891 -3.72261667 10.71790270 P 37.44242952 42.23512663 39.89074034 1.17486145 11.58379337 5.12120251 P 39.06578688 43.51412584 41.46975669 -19.32726918 12.58632112 -15.65144742 P 37.46399076 39.57397525 42.66892430 10.08678318 4.12270288 -1.96683436 P 39.11868909 41.89846205 43.85182066 -4.29478446 -4.99056057 6.05341033 P 34.50053342 42.91237223 42.09173456 -4.28451622 0.47388485 -0.82809819 P 36.17255128 43.72916245 43.69081214 2.68894274 0.82691528 1.87141281 P 40.19207782 39.77111732 39.63839627 -13.47521167 24.58911232 2.69730638 P 41.62875023 40.88256366 40.82060998 -5.73006968 -1.11416062 3.84292295 P 42.89077222 42.10944294 40.31216136 5.38201168 0.89561692 -3.44538865 P 43.43505157 43.65595324 41.25342970 3.40172215 9.16833969 5.76898885 P 42.17596048 40.06943278 42.87937435 9.79451064 17.78172761 -4.71798792 P 43.71745909 41.46460634 44.09141686 2.91069933 2.13639979 1.64888386 P 40.21643940 42.95798776 42.33981730 20.98991606 -7.65762330 6.99244186 P 41.48706143 43.53730606 44.13762414 3.86435764 2.30172090 4.39153619