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=5.7981755706639015 stress="-0.00016518532896455217 -2.908491336311721e-05 1.4322826838506602e-05 -2.908491336311721e-05 -0.00017712429927353095 -2.7397014274245365e-05 1.4322826838506602e-05 -2.7397014274245365e-05 -0.00019625907656540162" free_energy=5.7981755706639015 pbc="F F F" O 21.13132919 21.25978669 20.72592512 -0.44506714 -0.49764725 -0.58379098 O 22.28504734 22.68365717 22.70288723 0.20649592 0.38117490 0.70776437 O 24.08343331 20.79585403 20.94809454 0.27210320 -0.50881488 -0.58150581 O 25.72094491 22.73171545 22.68190327 1.20280602 -0.55186523 -0.14381459 O 20.82183498 24.21219253 20.92485375 -0.60588823 0.38716109 -0.81355431 O 22.62990665 25.20222315 22.78278197 1.65955448 -0.46142295 1.35273071 O 24.26280203 23.83705818 20.82702941 -0.08644326 0.12472245 -1.35908582 O 25.57034430 25.54852473 22.45558665 0.72253511 0.96742942 -0.17345271 O 20.91561068 21.13661615 23.90273580 -0.75626812 -0.67452342 -0.03964462 O 22.65906743 22.29869006 25.61041876 -0.30236292 -0.31010894 1.54586241 O 23.76735611 20.83533445 23.74148635 0.53318920 -1.29341420 0.14359311 O 25.58611608 22.53369179 25.52598936 0.66729693 -0.56703706 0.71366446 O 20.72329650 23.97376628 23.89036882 -0.99148219 0.01760629 0.09161738 O 22.35729836 25.20178472 25.79874826 -0.20723079 0.70768723 0.87839593 O 23.77290972 23.88090187 23.86136659 -2.30221041 1.57371349 -2.22695213 O 25.55835534 25.24645637 25.48193431 0.43297221 0.70533903 0.48817260