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:Z:I:1:forces:R:3 energy=842543.9090476186 pbc="F F F" Sg 0.34822474 0.31019478 0.00665597 106 -1263.00409678 -3904.23129930 -2159.81084944 Sg 0.86969753 1.91297770 0.89477061 106 -608.13147137 2594.61125362 2695.93386228 Sg 2.48911029 2.53041901 -0.06049754 106 2200.75422305 794.91267312 -1359.47863049 Sg 4.06756624 4.11002331 0.98361208 106 -932385.54295906 -448404.32376593 669668.88949464 Sg 2.61141609 0.70956908 2.37135306 106 -8471.37345540 -27151.03182429 -25186.18276246 Sg 2.97484461 1.87219501 3.45136161 106 65181.94330682 -31584.32790176 -63777.53420307 Sg 0.02518293 2.93249062 2.55849341 106 -571.08159992 411.38772884 619.83073064 Sg 1.67771918 3.49508811 4.11201011 106 -1518252.86643148 2249066.29604566 -1090530.35717511 Sg 4.53989971 0.01869973 0.63411744 106 -572.95587161 -395.71956856 -318.73880123 Sg 6.16534758 1.14957937 1.51198814 106 5026.44761264 -9607.44470197 -11396.40270663 Sg 7.80318383 2.64122099 -0.30414862 106 -59.25354412 -52.65905185 -87.44322622 Sg 8.74126804 3.77421169 1.64255701 106 71.88155108 33.05595779 76.81536351 Sg 7.52821770 0.08837939 2.42593102 106 1575.41538623 -2376.31126196 1031.08754625 Sg 8.94050054 1.29334008 3.44913608 106 772.74904714 543.37577662 394.24835046 Sg 5.47921111 2.35241330 2.54881991 106 -6723.87256633 11809.00022385 10186.52461453 Sg 7.01000612 4.40464314 3.56936459 106 57144.43863587 -591480.98694775 569503.57488589 Sg -0.04160725 5.18892621 0.19515620 106 -17.56159198 -32.68094409 -24.89600395 Sg 1.43392054 6.33759424 1.94228694 106 -213.54073149 413.80876300 -358.64324097 Sg 2.12148952 7.23596372 -0.20107132 106 30.63245816 34.96457482 -117.52195407 Sg 4.10105961 8.83286415 0.72561977 106 -5.72309531 14.42497285 -6.17594504 Sg 2.15529988 4.58107886 2.96831435 106 9678.03413466 20725.65092745 -22113.52953965 Sg 4.41125402 6.30868404 3.70731514 106 -951.59041826 43.20598246 -1323.21902052 Sg 0.93001504 8.23798636 3.18832731 106 -1792874.36368060 -1822262.69061163 -399499.64649092 Sg 1.74697727 9.06885581 3.37031700 106 1791541.53534746 1824025.94603147 398468.49387221 Sg 5.01206891 4.56429943 0.30534388 106 931227.70641587 446985.88977634 -669959.58383115 Sg 6.28113920 6.10146985 0.68121030 106 -45788.45004344 -19251.00160725 21525.79247907 Sg 7.61258380 6.69358642 0.06661074 106 46244.60354305 19776.30046291 -22078.69427065 Sg 8.63113853 8.37433375 0.76594107 106 636.45962635 1062.70354601 458.79722193 Sg 6.92051864 5.32995751 2.67841093 106 -58112.49958555 590406.64836531 -569599.38838547 Sg 8.37131465 6.57697250 3.47371811 106 1030.35973062 929.01909837 559.61282346 Sg 5.49895876 7.57328358 2.53505975 106 -1285.04186681 -2791.03770568 -2680.55539895 Sg 6.37403354 9.11874743 3.20612981 106 2236.79197814 3976.87726202 1658.89713230 Sg 0.29374974 0.18097677 5.25439874 106 -137.44276474 -175.69411005 -157.00302067 Sg 1.55461933 1.70378493 6.46812975 106 1169.50476545 7828.63843154 -17151.95199064 Sg 2.27616237 2.59481712 4.55351668 106 1452897.55407453 -2211719.92170215 1201693.91789716 Sg 4.44258954 3.85987436 6.22663704 106 -4492.95927082 -25948.12826782 16083.77252500 Sg 2.01733885 0.82639227 7.86961183 106 3326.81933698 -10605.17116203 14331.06085633 Sg 3.59247637 1.71134256 8.74772978 106 -44479.07191730 -17018.89159372 38413.09278009 Sg -0.11463166 2.17649735 7.11186459 106 -6295.55923591 1743.98316234 2315.67937480 Sg 1.32903813 3.29047062 8.77125833 106 -44.64958446 -35.95366183 185.34166849 Sg 5.74112274 0.00292569 5.15826676 106 14.40536659 -2369.27117843 -1425.53069059 Sg 5.73341900 1.70347840 6.16918418 106 1318.08760918 1486.40819226 -1116.58223386 Sg 7.69202245 2.38003155 5.19764454 106 195.14717664 142.45586493 -40.77674110 Sg 8.32266914 4.17067778 7.01213872 106 125301.68489294 -135933.51816212 11147.18482317 Sg 7.41082421 0.44948662 7.96846700 106 -9655.19857394 -12371.74812922 -6127.10540878 Sg 8.40224522 1.72149452 8.59737233 106 9636.37360200 12391.48452467 6109.33725193 Sg 4.75912691 2.16581005 7.80322012 106 44648.10616572 18537.25626375 -34630.78358290 Sg 6.15567743 4.15614092 8.44313041 106 -332.33962491 -247.20908197 432.56528670 Sg -0.06426441 4.82579148 4.55718088 106 -489.01959632 180.43083663 -48.32456174 Sg 1.15211882 6.01407672 6.18173662 106 35.99603353 79.02299096 -109.11380149 Sg 2.60882909 7.46945976 4.32591576 106 779.78686325 -1581.29161181 960.99553778 Sg 3.18868932 8.76177277 6.07178008 106 112.17735557 241.50197505 348.46404442 Sg 2.63435958 4.64979881 7.31885395 106 -137.36132598 -82.38745681 77.73289009 Sg 3.54476547 6.21710685 8.81626943 106 21.36507743 37.16668407 150.60583912 Sg 0.28556994 7.87804283 7.29441218 106 -815.31172826 -99.28228352 -870.19108019 Sg 1.50583535 8.36811009 8.92415375 106 746.45217681 287.46077319 970.57481429 Sg 4.69463333 5.24008265 5.35343459 106 -1111.40663001 22518.28550972 -16007.25876701 Sg 6.39314743 5.80151019 5.83290359 106 -35440.86590138 26762.19332379 -45886.99576914 Sg 6.72423247 8.05064751 5.46997869 106 -935.25946448 7.67029468 -367.02086633 Sg 8.64423820 8.54646965 6.21210725 106 967.41562428 237.07806985 376.13948383 Sg 7.34597908 5.22972927 6.92435437 106 -85879.44586263 107824.35750021 30168.31054821 Sg 8.00845936 6.07050274 8.42677566 106 2566.65991892 3436.36380914 5947.81762012 Sg 4.82218165 8.24731601 8.40252701 106 -306.44014024 18.15042633 -69.15367507 Sg 7.03319308 8.72862893 8.61333164 106 371.89559392 74.92753784 24.50300681