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=20257891.913922206 stress="-304.9689894432529 154.69996988126317 205.35213081744072 154.69996988126317 -130.85992186156628 -116.32340415199968 205.35213081744072 -116.32340415199968 -273.74423779980515" pbc="F F F" Hf 35.09668754 34.61415367 35.01662236 -11174.36619323 -19427.40132097 -9497.61110112 Hf 35.98648749 36.16070464 35.77281857 15412.08341679 -3878.86231534 -14006.62053859 Hf 37.90737581 37.40526927 34.92080204 -248449.59149215 -1488700.89452843 -1434639.38143904 Hf 38.07247091 38.39138043 35.87048416 249440.29090108 1489253.95440871 1434061.10413104 Hf 38.26778408 34.69667147 37.89519944 -3573.82393372 -68681.74854746 -10900.20090832 Hf 38.35630689 36.46142434 38.17647535 -25725.98409007 64314.53897360 21994.93050990 Hf 35.69631352 37.44945407 37.12734138 -5284.46484928 22424.89297583 23678.73900352 Hf 35.80234018 39.33742170 38.95269962 423.42506095 -2463.11176053 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35.52990663 22100.84383046 15716.75787976 12490.82702127 Hf 37.58106181 40.28072843 37.88385313 -68574.87744153 -76339.17241246 -15415.64940235 Hf 38.73831184 41.54881734 38.11699957 36101.50441005 33657.55039607 21462.77740372 Hf 34.73502212 42.69620678 38.18462074 -25422.74393647 -20696.59237696 -9665.52792363 Hf 36.13867773 43.84110693 38.71948232 24006.87532813 23057.52610510 7084.63867835 Hf 40.20676357 40.33774323 34.87996620 -614485.51705869 -1847781.71426169 -1747430.50621097 Hf 40.52500922 41.29471098 35.78495737 614155.53455596 1847366.66171916 1747246.04183198 Hf 42.41213637 42.63609966 34.65477136 -4074.81033932 -6584.06611007 -6116.38269366 Hf 43.32814903 44.04514857 35.86571414 4452.99148753 6852.90824312 5905.25674359 Hf 41.84863854 40.19549496 37.82480807 13003.12980065 56673.34219862 5430.24654500 Hf 43.76064973 41.30039077 38.46168753 6552.31772929 -2865.51679803 -5631.91906701 Hf 39.85575473 42.96367465 37.88390727 32847.80800577 42478.17120389 -8024.12210109 Hf 41.47112209 44.14652117 38.97826602 1339.37491672 2205.68606321 765.14956067 Hf 35.23953096 35.17220051 40.66063898 -17808.24027406 -17900.57757520 -3639.88962275 Hf 36.58669663 36.52883040 40.93461041 -1547111.22273733 -3653197.77436557 2530749.44038730 Hf 37.01566320 37.53517008 40.24177414 1565001.77261607 3670691.97919423 -2526942.73812944 Hf 39.07405600 39.30724014 41.11310625 -9481807.35719468 -1237522.91522240 27548239.95816492 Hf 37.33467717 34.52535518 42.72368837 -3074.22303713 -5508.19897946 -1564.22967471 Hf 38.37976925 36.30842883 43.28529920 69.53772854 2319.47533932 2473.74109882 Hf 35.46826920 37.54064503 43.22457916 -13021.58535940 -83510.20015718 -21650.13062289 Hf 35.72794973 39.22322438 43.66406352 -6297.09653833 77177.28735373 27841.49431498 Hf 40.41541155 34.65788489 40.42657497 -7390.07126235 -29552.69713973 -3801.71576708 Hf 40.87312835 36.49112424 40.66135682 7365.71752071 29437.69756004 3652.58481176 Hf 43.15728644 38.23510256 40.14966329 -437941.75462637 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35.18076865 42.11247688 42.12591397 -127957156.66940224 77006731.36479801 96353849.55400340 Hf 36.16302659 44.01771611 43.94684065 56.90002726 94.85887058 90.82501951 Hf 39.44008613 39.35494547 40.04951246 9480066.68229556 1235056.83897772 -27551278.85698590 Hf 41.06276809 40.89618627 40.85718979 112.17248762 401.78718368 176.84373593 Hf 42.75951130 42.30852333 39.99118288 -66273.64590651 -206992.98113480 -200493.02794447 Hf 43.09525367 43.42614475 41.08406319 63705.83115157 211605.79282582 207110.32341614 Hf 42.40120303 40.02426784 42.80426881 -21975.53828955 -22587.82882375 -18213.39542942 Hf 43.44014652 41.17577130 43.85575662 21037.74332876 23264.07381211 21266.49711867 Hf 39.83144652 42.43187173 42.52723298 7908.70221719 3954.86843673 6112.96484247 Hf 41.70650781 43.66508599 43.94296173 206.15266476 186.64799508 189.66033248