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=170.97688048148143 stress="-0.0026656996897022017 -0.0006257589412371404 0.0011788848357737758 -0.0006257589412371404 -0.001776968547903041 -0.00033754013202265116 0.0011788848357737758 -0.00033754013202265116 -0.0016841673877041631" free_energy=170.97688048148143 pbc="F F F" C 35.65713333 34.72687250 34.90100464 -2.12624454 -2.20012139 -2.32016956 Si 36.01597877 35.99115352 36.04547597 2.74836999 2.98881844 2.30156093 C 37.41764139 37.68020424 35.24583276 -10.57510505 -8.98790102 -8.25046079 C 38.63713315 38.69168546 36.40393299 17.25693077 12.56761907 15.31679987 C 37.96599412 34.76401731 37.35635281 3.11364698 1.61761373 3.46821694 Si 38.69897931 36.59416742 39.35068505 26.03232565 -43.76806425 -52.53050887 C 35.11562849 37.39478963 38.01670454 2.97443378 0.33631004 -4.11906288 Si 36.65977124 39.28474408 38.63440634 -7.23535127 -0.65532512 4.84059515 C 39.91606293 34.75047804 34.97230072 3.96809545 0.85280086 2.62778386 Si 41.06043080 35.53661238 36.99723708 -4.51662979 -1.97130029 -6.33325067 C 43.10951887 37.95499362 35.23334632 -2.07593885 5.04966872 5.52635905 Si 43.47531878 39.27527596 36.56343692 9.07355789 -6.09408172 -6.37042167 Si 42.66755241 35.18524009 37.91983707 6.40990019 2.08375549 4.02834485 C 43.29383404 36.68698606 39.00900551 72.48006665 -50.35367227 -47.78518670 Si 40.34406186 38.08587080 37.50445878 -7.67172667 -2.68357333 -3.71348827 Si 41.47850385 38.91887631 38.76968276 -0.27839935 -2.80501976 10.79896064 C 35.35891114 40.08081012 34.68840845 -0.17681203 -0.07969499 -3.25358995 C 36.01969003 41.03922619 36.95142919 8.47985519 -3.66679413 1.07904568 Si 36.76989084 43.41522082 35.44460279 -5.93806210 -2.39775510 2.34861253 Si 39.11048830 43.90280184 36.58983341 -3.84426892 5.10523389 2.28469414 Si 36.75656806 39.34158712 36.99886995 -2.56957788 -1.29061933 -8.29417514 C 39.55791559 40.74844832 38.71090080 -4.36527605 1.23609331 -20.34593895 C 34.57529003 42.87701227 37.43779489 -3.93484435 4.91840030 -1.44300149 C 36.99437209 43.72841569 38.61985886 6.38378858 3.94034546 -3.82253996 Si 40.53835083 40.42609017 35.28181622 -4.21463566 -8.51104954 -4.58310929 Si 40.85964588 42.15384100 35.45406285 2.19196095 5.85012141 -3.56289663 Si 42.93802053 42.64571395 34.73999546 5.14507784 -9.07377953 -14.37396322 C 42.94064697 43.79794701 35.82761667 -4.34214453 7.90142615 12.79209627 Si 42.15012698 39.58892700 37.40457248 -0.22245246 -0.00739415 0.05578187 Si 43.22945992 41.26672337 39.32677999 5.45372530 -3.06605489 -1.18182007 Si 39.71170412 41.91562440 37.01593231 -6.36521835 -3.47142876 8.56332126 Si 41.94010085 43.98165455 38.96912199 0.13023738 3.87906552 -1.33223270 C 34.93297978 34.73372442 39.92018245 -1.68342035 -5.79651816 -3.34555353 C 35.78286236 36.24015829 41.57338949 55.23340978 -53.51876568 -72.06105268 C 38.07079952 37.41356273 40.33203449 -24.26759789 46.57178700 50.75020251 Si 38.96175363 39.09106615 40.95963678 -3.69803711 0.61057019 -2.26771598 Si 36.99131962 35.34550077 42.99399403 -4.23633673 4.43541950 -2.39391531 C 38.95016675 36.22534284 44.07812382 2.73141129 1.98006992 -3.72847552 C 35.06698366 37.00996911 42.70774368 -48.65040855 51.61735369 81.22480332 C 36.52552290 39.52032174 43.65388732 -395.77761618 28.89935965 260.66721243 Si 40.24088241 34.77919663 40.03239960 -0.21633219 -2.65299855 0.17724773 Si 41.13839785 36.08858488 41.70299319 9.30844118 -1.63781494 1.72111608 C 42.07401960 37.43972545 39.62809763 -91.99320927 46.21546056 26.08214410 C 43.28944406 38.00826383 41.20848190 2.04413557 18.98947865 2.19948737 C 42.91360975 35.06304833 42.49357987 -9.03075211 -17.67584579 -5.54151738 C 43.27164655 36.93167161 42.95606735 -2.78147862 15.11626087 16.77285443 Si 40.67609538 37.56806574 43.32663346 -4.82676634 -45.89966313 13.33918431 Si 40.80850764 38.68458018 43.06678315 4.63693381 40.29988366 -8.08240793 C 34.71836298 39.44165062 39.67052981 3.21041178 2.73880982 0.07946639 Si 36.38360109 41.22713023 40.93415617 -238.03951711 -231.60411956 149.21687016 C 37.18401673 42.03058845 40.42749086 239.24277275 230.82825931 -143.93934889 Si 38.88491493 43.00211673 40.95002304 -7.25288227 -0.23568940 -3.06311408 Si 37.53199780 39.43284211 42.98428289 364.36983078 -58.19076902 -270.02361522 C 38.43117732 40.51519805 43.53408209 35.72870687 27.81337719 8.42477002 C 34.83930891 41.89615456 42.49533058 -7.09818053 -6.06345181 -7.80265984 C 36.14154885 43.06667354 43.65978069 8.29158956 8.02114036 6.55414528 C 40.62585940 40.58444996 40.31536874 -150.12289508 -143.80767341 -36.84977552 Si 41.58279978 41.40463673 40.62549107 156.82260826 136.54087102 55.44291260 C 42.53402871 42.67789546 40.00034909 3.13011765 5.99779957 2.28991484 Si 43.71041967 43.66346027 41.52086927 -0.20171696 1.33848269 -0.82361185 Si 42.98644532 39.73836225 42.52223156 4.06983789 -7.63854777 -3.16566615 Si 43.27493526 41.49068058 43.92549972 0.53093361 2.56127457 3.54125835 Si 39.71651567 42.50260299 42.67168607 -1.51200477 0.85729721 6.10652425 C 40.99631686 43.51857977 43.66953666 0.64872652 -3.95474103 -3.91804050