32 Lattice="5.7761077880859375 0.0 0.0 0.0 5.7761077880859375 0.0 0.0 0.0 5.7761077880859375" Properties=species:S:1:pos:R:3:forces:R:3 energy=139.87932431045186 stress="-3995.767516286222 -474.33414039730224 893.7147563828244 -474.33414039730224 -3519.8101876354312 -807.4686317718446 893.7147563828244 -807.4686317718446 -3498.976998101538" pbc="F F F" S 0.17705214 0.11728626 -0.20403657 -30.01620813 -30.47757911 -20.39171102 S 1.46313692 1.48489631 0.09601440 -38.65658499 -47.00786041 -190.10200531 S 1.39773399 0.06012597 1.37356191 18.14732759 -54.65196650 37.58900605 S -0.04254391 1.31457641 1.40235759 -30.67552954 27.92251975 22.26225268 S 3.00274977 0.20413674 0.14053009 -947.66270050 -1549.47175096 -512.66532621 S 4.14209554 1.20916658 0.01519620 1132.88831611 916.21059029 -290.26018729 S 4.29205609 0.37535388 1.66127797 115.18884096 -274.28043013 -129.77694835 S 2.87331220 1.33436677 1.22408480 -228.97590666 698.02224054 804.53827268 S -0.08961797 3.04315046 0.09267031 -79.72972017 -65.66464604 -34.58936110 S 1.09408017 4.46762986 -0.02925220 340.49029850 37.05406805 -507.47962862 S 1.37031395 2.81154280 1.24543717 16.04686645 105.40708200 181.16222635 S 0.29927542 4.48267520 1.37976938 -288.10025488 22.72184656 529.32581582 S 2.97563965 2.92158444 0.24735911 -76.56404181 8.22605641 -163.62921406 S 4.38176163 4.52981772 0.07762352 82.88351369 -2.62282892 -70.13079356 S 4.41919107 2.75185751 1.27390715 100.04561687 -4.92131851 97.58356479 S 3.02801926 4.46815337 1.25681761 -93.89376876 40.74081236 122.00044378 S 0.24915418 -0.08992579 3.03663888 -19.47405110 -109.29331366 -137.98663109 S 1.31798680 1.65877693 3.26662325 872.83123400 -282.35241488 -378.93297576 S 1.49355374 0.00826913 4.43709894 16.94662786 -47.92725078 101.04812876 S 0.08145878 1.22424053 4.20824449 -509.69849280 -46.61882851 471.73529978 S 2.65656353 -0.08648390 3.00310633 15.77812658 5.39830342 -86.41064306 S 4.35608543 1.34347639 3.04912153 18.76105066 289.63783903 137.13356554 S 4.17932455 -0.01772802 4.17212961 20.80164340 -119.30254079 102.74224146 S 2.84048277 1.40110662 4.36269445 73.15449767 -12.76907452 26.71354127 S 0.08327395 2.65447068 2.96725774 -446.78984106 417.07404053 -142.98144781 S 1.69242398 4.32664005 2.90733480 -55.56711034 28.91266279 -105.03051418 S 1.77241853 2.90627369 4.45899197 -31.85227811 130.89263624 93.77872011 S 0.31669815 4.50313754 4.12318511 -46.67334778 -3.51885100 41.30838186 S 3.05814059 3.10488486 2.96066905 27.95253462 -191.15249941 -111.83359900 S 4.44226533 4.39631156 2.90706423 57.49776846 24.74649623 -44.31421830 S 4.44018408 3.05216461 4.45824129 5.39516969 -23.92928467 3.33845111 S 3.03546583 4.41860884 4.17338663 9.52040356 112.99524462 154.25529269