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=-84.9946937434 stress="0.2605502975056201 0.19195015839732907 0.10813970593381332 0.19195015839732907 0.1666509248942535 0.02494376160447419 0.10813970593381332 0.02494376160447419 0.11029795790369015" pbc="F F F" W -0.14459490 0.11115480 0.11044915 4.58559238 1.38107633 1.57827409 W 1.70960170 1.16342156 1.33833517 -8.55599164 4.47691556 1.87724771 W 2.78829595 -0.16490224 0.14041416 -0.58711901 -3.91743280 -3.45401549 W 4.27812781 1.49446427 1.32834452 3.23578730 0.52899138 1.55306226 W -0.12320595 2.95894820 0.20259391 3.95326137 -1.64313067 1.99429449 W 1.56504129 4.20865944 1.36550211 -8.18772271 8.06116369 4.11044702 W 2.78802619 3.22277084 0.18584377 3.53999340 -3.08569864 -7.73950286 W 4.68362810 4.69581920 1.64685009 -3.19860188 -2.45816709 2.12272543 W 0.26959405 0.17626233 2.85402479 0.53958840 1.97062357 -0.72398490 W 1.77326267 1.49207130 4.65300231 0.84434432 2.19544953 -1.78246599 W 3.03848316 -0.10479899 2.91852158 1.76806508 -0.06232420 2.87281781 W 4.45789336 1.38825682 4.27041603 -3.07236904 2.01594790 -2.40201779 W -0.02974524 3.17895518 3.28592299 2.92252606 -0.21874531 -0.07492393 W 1.61455359 4.53253581 4.64904689 0.79377290 -4.06443688 -3.79380014 W 2.78091226 3.10609294 2.96603997 4.53993833 -2.40278352 7.37952972 W 4.30598025 4.32157598 4.51361598 -3.12106528 -2.77744885 -3.51768744