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=-133.90405903638546 stress="0.0005287885336958564 0.00018683212854955292 7.074687816717464e-05 0.00018683212854955292 0.0005020132503100786 3.646292006363993e-05 7.074687816717464e-05 3.646292006363993e-05 0.0006394111159058627" free_energy=-133.90405903638546 pbc="F F F" C 34.75900849 34.98477095 35.64594072 2.36573385 1.43735089 0.35796523 C 36.39718813 35.93572417 35.98055861 -1.37197722 -1.61842244 1.00130526 C 37.14715992 37.22516294 35.23402360 0.67258479 1.23070000 2.13052017 C 37.96709764 38.78131475 35.96390753 -1.31246293 -1.27939186 1.25480627 C 36.84674196 34.93158033 37.83765651 7.15255413 5.13250663 1.97484683 C 38.85840215 35.76443239 38.52583685 -4.24543880 3.90164618 -4.44954058 C 34.87364502 37.47843907 38.02587658 0.00000000 0.00000000 0.00000000 C 36.55604684 39.07636534 38.99475015 -3.24600665 7.31144374 -3.45904528 C 40.44932342 35.29377055 34.75670798 0.02867417 0.01782571 0.03304820 C 41.96628114 36.23678549 36.50500385 6.06610350 3.00530201 -4.71202023 C 43.06376618 37.42957765 34.86420263 -3.95358696 -3.84471209 7.59529576 C 43.67982227 38.56376137 35.86736005 -4.28838741 4.42731051 4.27286816 C 43.12870706 35.29825864 37.91003023 -0.30840417 3.18313413 -0.00806945 C 43.94092265 36.42635864 39.33157354 -1.67348775 -1.88875516 -2.69917750 C 39.63485376 37.67682157 37.44339995 -1.98585890 -7.32207484 6.59736290 C 40.92663375 38.66864663 38.77269330 -3.75407242 0.35552518 0.46309711 C 34.75331176 39.74989001 35.10549878 1.84932088 1.58308423 1.57100580 C 36.14575737 40.88078096 36.24085714 1.71319886 9.13971595 -2.33115224 C 37.23544699 42.23567833 34.69446895 -4.81347337 -5.93568888 6.84119859 C 38.61643991 43.58528255 36.40123177 0.28662163 -0.28988468 0.00656389 C 37.56308014 39.88968876 37.52734200 -0.93917205 -0.59122199 -1.00668541 C 39.67911872 40.79320854 38.39174556 -1.76090698 4.15985483 -1.39073445 C 35.27732346 42.60590649 37.63905551 4.16877093 -4.02510357 -2.47583969 C 36.19458357 43.66349090 39.11824152 2.06819404 -5.71196240 -0.51913220 C 40.38619242 40.30317212 34.70305829 5.36595525 3.75438232 7.87421586 C 41.60365422 41.12475624 36.46651109 -2.60572202 1.81062911 -12.39383462 C 42.13700750 42.97130329 35.10350000 6.54489568 -4.73360763 11.16354065 C 43.97271432 43.46171569 36.36724050 -8.53618289 -2.23470209 -5.92294998 C 42.58087455 40.04141038 37.35935114 5.03685238 -2.02636567 -4.44943469 C 43.97769358 41.09133389 38.54532507 -1.89929665 -1.67908592 -1.53936425 C 39.66448343 42.68403127 37.11226018 5.00195866 -4.79560722 12.57897697 C 40.97555741 43.31914392 38.89352680 -3.37528238 -3.03107936 -5.98579835 C 35.05615299 35.04331559 39.53882749 2.94847523 1.76577122 0.41509375 C 36.18959060 36.09305905 40.84266193 0.56145846 2.65102629 -5.01055409 C 37.00297454 37.99791377 39.62151619 4.85955809 -9.17138672 11.89196792 C 38.55150311 38.51894432 41.34725891 -3.68320381 1.20042661 -5.47713613 C 36.58109925 34.96989052 41.89596251 0.11744905 0.77155365 -0.11288437 C 38.84352723 35.58766845 43.58475277 1.93081687 1.65117055 -1.21703241 C 34.99655912 37.96978731 42.51668654 2.43416503 0.82028401 1.71037333 C 36.66147796 38.66680361 43.54655608 -2.33082979 0.40860026 -2.74982680 C 39.53173977 35.00137669 40.76049087 -1.08544206 1.23359909 -3.61086334 C 41.84190222 36.00831489 41.43404765 -11.06807088 21.64191665 -15.09804260 C 42.84911873 37.25854751 40.08801189 0.41231217 1.76774108 4.86227114 C 43.52170955 38.98750272 41.29919491 -3.08880405 -1.21170331 -0.81796560 C 42.18789496 35.25286767 42.07479522 13.76131787 -16.68194769 23.94831296 C 43.34154035 35.71232769 43.98425097 -4.59771672 -2.21956593 -7.58030443 C 40.09980901 36.69481420 42.84678755 2.90100822 5.94611945 2.46686808 C 40.47462098 38.73073442 43.80462855 -5.32662869 -3.00221077 -4.15882220 C 34.83286624 39.78943560 39.93496123 2.41089377 -0.76047811 -1.56781822 C 35.88698845 41.93479805 40.86193449 2.06495053 2.02854438 -0.61458133 C 37.82350393 42.21827495 39.80335328 -10.54258280 -1.22443320 -1.81531585 C 38.31705875 43.28337470 40.48115157 3.30120902 4.53754115 2.95578889 C 37.36102597 40.03073993 42.87644269 2.94263531 -1.69785758 1.35850290 C 39.23985324 40.60085005 43.78505241 6.16454477 -1.58859242 -8.06751716 C 34.62935593 42.80367007 42.32271401 2.63227794 -0.92772915 -1.74052729 C 36.64289762 43.79233656 43.39702376 -0.79714057 -0.39084600 -0.42450946 C 39.83946121 39.74812168 40.36805486 1.23360841 0.88577239 -5.91763400 C 40.89974943 41.22892384 40.83595311 0.34126872 -3.21100883 0.69772688 C 42.34497277 43.04713195 39.86279442 -1.87004347 0.39864204 -1.29770454 C 43.89681505 43.43861604 42.04762001 0.00000000 0.00000000 0.00000000 C 42.51989586 40.42044581 42.44053329 6.45221190 3.42103628 4.78506198 C 43.82327501 41.37060237 44.08965562 -6.47111555 -4.60941681 -8.06244227 C 40.39757659 41.75878264 42.13716159 -4.86028221 -3.87531417 7.87567554 C 41.62358612 43.71616612 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