16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-88.59189607413647 stress="-0.001960505062458124 0.00018855595605814818 0.00020608833708821438 0.00018855595605814818 -0.0015962908798593967 -0.00018476640414240503 0.00020608833708821438 -0.00018476640414240503 -0.0017298173051270417" pbc="F F F" W 20.91870436 21.04860922 21.20118821 0.50388390 -1.23664561 1.33751589 W 22.70960170 22.31143450 22.33833517 -1.56013693 -1.67301232 -4.43816819 W 24.06049558 20.83509776 21.14041416 -0.38901298 -1.88424495 -2.48711683 W 25.27812781 22.45260211 22.45967371 11.42728481 7.52158005 -8.13753804 W 21.13658074 23.68487332 21.38625107 -11.02346925 -1.45775908 -6.34367841 W 22.56504129 25.20865944 22.36550211 -28.96674623 39.28708828 21.49721854 W 23.78802619 24.22277084 21.18584377 32.03667969 -20.53088177 -33.96089619 W 25.47948213 25.64391375 22.64685009 -0.14959107 -0.13904190 2.58153067 W 21.49053896 21.40797779 24.03592806 -8.04102622 -5.91977242 0.71745578 W 22.53179838 22.70426383 25.57785606 3.04018492 -3.26582592 8.94242798 W 24.16838981 21.24052856 23.91852158 -6.41232706 -16.47523679 7.88748285 W 25.51999336 22.52188541 25.09744544 7.52990790 3.26516742 6.97903461 W 21.26213048 24.22747991 24.34614370 -13.69701846 -1.98206573 -4.39195295 W 22.61455359 25.44814650 25.55384723 0.50692147 8.98185095 8.62427356 W 23.78091226 24.10609294 23.96603997 11.95785314 -6.49541419 2.24762457 W 25.18317529 25.12026604 25.51361598 3.23661238 2.00421398 -1.05521383