64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=216059.19725963898 stress="-443970.5700764286 -688611.4738816973 -485401.77944018785 -688611.4738816973 -1490563.5017423462 -830142.7278547948 -485401.77944018785 -830142.7278547948 -668432.5721123936" pbc="F F F" Nh 0.24026229 0.33175390 0.59490151 -68.66301165 -40.22974253 -40.49136526 Nh 1.74055220 1.16480732 1.68301170 72.30134189 4.95201123 31.87312184 Nh 1.87401576 1.77096938 -0.24045689 13.51515952 33.93437042 -88.92300375 Nh 4.51774348 3.59907860 1.39733409 -22.67804633 35.92647892 -30.86306175 Nh 2.35152390 -0.00398391 3.24782742 23.23436172 -51.62721176 48.07558647 Nh 3.24232552 1.95959820 4.07841053 2200.60992381 -3523.48612270 -4968.31438590 Nh 0.67994176 2.46153324 2.86610046 -45.81702502 33.94348641 39.00312875 Nh 2.04466480 4.18081438 3.44903423 36518.24363478 -103054.11571120 78986.32159493 Nh 4.97204610 0.41845989 -0.39385138 -0.23961247 0.74205021 0.72733154 Nh 6.73365319 1.31813293 1.45963526 -231.25545767 314.77289632 -275.41172613 Nh 8.11752625 2.10950294 -0.26420807 4.90845001 2.05544374 -6.64663115 Nh 7.84707803 4.09465168 1.35398040 -4787.87051060 -54388.01336332 -53312.18903130 Nh 7.57773009 0.13866892 2.51041927 -3182.50253717 -1925.88147017 -1013.13067167 Nh 8.88461650 0.75601425 3.00731882 3409.57846041 1608.59467332 1294.49064331 Nh 4.74501910 2.15920379 2.83412764 99.34359586 -53.43203909 -46.30586764 Nh 5.96808209 3.52081208 4.07195922 -138.92558600 143.89631818 -12.29863905 Nh -0.03291310 4.52582613 -0.45504870 0.74776539 -0.18494978 0.75921599 Nh 1.86649497 6.61760113 1.73488668 37.27724268 220.84642396 -165.75897854 Nh 2.33375666 7.78481323 -0.42921610 -18.82282944 -10.43015767 -21.12930375 Nh 3.75664010 8.61380630 1.00034422 11.47660105 19.72276679 12.79249787 Nh 1.72854208 5.07328557 2.76508224 -36523.33038185 102829.96459257 -78840.29685178 Nh 3.89479132 6.23013341 3.57040896 -2889.26619273 5040.03735281 -6867.20446408 Nh 0.39423536 7.86484922 2.82055078 -1010496.48742454 -1841468.56827492 -1177650.68496391 Nh 0.78702991 8.58066987 3.27833179 1010482.70177206 1841480.04348535 1177663.17514687 Nh 5.54571290 4.85487246 -0.05321849 11.89127728 4.81317828 -32.43041971 Nh 5.92485214 6.40219001 1.52740453 13351.40446423 -10787.93212972 -9804.44465474 Nh 7.47385391 7.05122813 0.66109362 182.66829012 67.91415118 -111.05366767 Nh 8.46581065 8.90025531 1.57977634 5.13051486 10.32936741 6.26007179 Nh 7.92360111 4.96427746 2.20641417 4785.46794593 54380.91407766 53305.18766040 Nh 8.00833393 6.19612439 4.15779973 914.91967949 -1235.96501803 -231.50582568 Nh 5.00574040 7.13004807 2.20115611 -13463.05178021 10766.53496345 9849.60910224 Nh 5.81936700 9.04454744 3.97230879 -53.97252061 70.80955210 -22.62048408 Nh 0.77672617 -0.07198699 5.01779457 -3851.54377871 -6999.96095987 -4243.63843387 Nh 1.38729037 1.03947518 5.69183290 3820.70625333 7034.54704696 4180.62346195 Nh 2.72698136 2.74628740 5.21006025 -3526.90613130 2508.27252783 4782.42913373 Nh 3.97197664 3.77002382 5.48571898 1189.27730416 806.90559115 386.50643784 Nh 1.66027547 -0.12444968 7.32922576 13.38836847 -48.78474839 72.94961881 Nh 3.76507856 1.42397703 8.61983240 -34.29570209 -25.09179855 28.89451236 Nh -0.24033903 3.11407265 7.60828747 -2378.95073971 -854.30579429 -721.72243161 Nh 1.18730262 3.62652464 8.04071928 446.76103169 -1124.12262381 1972.79393328 Nh 5.74751864 -0.09735093 4.83034855 -20.12949769 -37.48324191 -31.51816461 Nh 6.53779524 1.43054023 6.02598766 -86.18856612 112.10714824 -23.24282498 Nh 7.42467501 2.30917353 4.28635139 169.59251667 -111.80077209 -7.64340530 Nh 8.62506823 4.13543706 6.30225555 219.12041419 -215.79916253 -206.51058891 Nh 7.80228579 0.24341706 6.89714988 -95.34460735 -359.72140743 -597.77112929 Nh 8.26464588 0.85429506 8.45247804 198.03313454 263.26724875 667.94029349 Nh 5.13143773 2.45808602 7.40547598 -24.30422964 -25.11218382 -51.49654762 Nh 6.22180957 3.94862259 8.25668206 -5.04442914 14.05948800 68.72898299 Nh 0.46167079 5.81950109 4.54718755 -90.59622197 -31.45786498 -115.95435092 Nh 1.51790412 6.27431077 6.11590910 2625.18164305 -1786.13391846 -1504.02149875 Nh 2.22614847 8.08604824 5.62749155 -258.57898464 5.26146539 -14.29789723 Nh 4.00050563 8.60097217 5.54356635 279.12083831 97.02661611 -30.30363418 Nh 2.18083319 4.64275099 7.39705376 1943.85194013 1955.84614032 -1236.50582950 Nh 4.20606315 6.62906937 9.02628603 -1.53814283 -1.55974440 1.69839874 Nh 0.38688941 7.04159356 6.83141631 -2620.84362148 1716.34507436 1596.63915174 Nh 1.47665374 8.17340365 8.18158258 34.08695916 33.93211765 41.21334268 Nh 4.34162339 5.42356397 4.67106263 2869.91485944 -4874.65470015 6844.69919931 Nh 6.71971503 6.58062373 5.98969204 -18.57747434 -133.95667770 161.71100944 Nh 7.04987188 7.50608958 4.40007085 -803.91068836 1299.91991581 18.50975511 Nh 8.75348548 8.64376073 6.01239692 -0.61440613 -0.43668947 0.04358497 Nh 7.53856108 5.19733409 7.31445918 -150.63630935 222.40431595 206.10501426 Nh 8.86033468 7.14261023 8.20706362 2.91907378 -0.27292768 -0.49543731 Nh 5.26627895 7.56828865 7.00345175 -44.30595285 28.90315026 56.37014316 Nh 6.81899118 8.36978605 8.93504413 -2.18241799 0.97591928 0.69509575