16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=40.80144392328384 stress="-69.49480939274166 -2.972242939749208 -3.755533087361659 -2.972242939749208 -63.06810732159107 -5.606598900191866 -3.755533087361659 -5.606598900191866 -66.72480660634011" pbc="F F F" Na -0.14459490 0.11115480 0.11044915 -2.71510198 -1.98059907 -2.29175876 Na 1.70960170 1.16342156 1.33833517 -1.57413132 0.18820250 -0.91686383 Na 2.78829595 -0.16490224 0.14041416 1.67402048 -3.85251818 -3.98147435 Na 4.27812781 1.49446427 1.32834452 5.23220858 -0.37937015 -1.51863909 Na -0.12320595 2.95894820 0.20259391 -3.37846384 0.98186975 -2.44315548 Na 1.56504129 4.20865944 1.42880138 -2.11751373 5.56293632 -0.75661531 Na 2.78802619 3.22277084 0.18584377 2.10277813 0.94693673 -5.58289001 Na 4.68362810 4.69581920 1.64685009 2.56163749 2.23592303 -0.97567141 Na 0.26959405 0.17626233 2.85402479 -3.62904619 -2.82535110 1.95987421 Na 1.70996341 1.49207130 4.65300231 -1.17258099 -1.41451055 4.62572457 Na 3.03848316 -0.04225341 2.91852158 1.41308585 -4.93710463 1.73355585 Na 4.45789336 1.38825682 4.27041603 3.49988574 -0.89703328 2.66461924 Na 0.19178619 3.17895518 3.29140871 -4.99722330 0.59785741 1.01468197 Na 1.61455359 4.53253581 4.64904689 -1.11883015 3.27153984 3.16820603 Na 2.78091226 3.10609294 2.96603997 1.66326625 0.62607520 0.98182247 Na 4.30598025 4.32157598 4.51361598 2.55600899 1.87514619 2.31858390