16 Lattice="21.0 0.0 0.0 0.0 21.0 0.0 0.0 0.0 21.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=286.6827023487288 stress="-0.07011077143346972 -0.0004233946411129981 -0.001476394775272382 -0.0004233946411129981 -0.07099819090784748 -0.007037662812484536 -0.001476394775272382 -0.007037662812484536 -0.060350585487389564" pbc="F F F" N 10.28504734 10.68365717 10.70288723 -58.17409590 -53.41638715 -26.45596998 N 11.33343331 11.04585403 11.09894620 -41.89210539 -38.61758203 0.24460933 N 12.22094491 10.73171545 10.68190327 54.88941601 -81.11642968 -101.01761678 N 12.57183498 11.46012800 11.45672613 199.57382995 -15.79098022 -95.19677847 N 10.62990665 11.78220450 10.78278197 -64.90217708 70.56523739 -38.09781568 N 11.31210000 12.88362859 11.08704133 -25.59516863 48.44948153 0.74464303 N 12.07034430 12.04852473 10.55473499 7.62315247 13.10571464 -93.69056730 N 12.66561068 12.88661615 11.13933373 47.47491176 53.60268926 -4.85910602 N 10.37719504 10.29869006 12.21211997 -53.51621006 -71.90343152 -4.86748003 N 11.01735611 11.08533445 12.49148635 41.90674823 -13.68606954 69.75353280 N 12.08611608 10.53369179 11.90392301 -3.47824236 -153.39352783 -14.84138854 N 12.47329650 10.93279822 12.65583543 77.05120764 -3.32252176 131.76724144 N 10.25559716 11.70178472 12.29957428 -82.66139612 58.07654562 -5.95004607 N 11.26915069 12.63090187 12.61136659 -30.24062307 38.15278845 39.90720049 N 12.05835534 11.74645637 11.98193431 -94.91076380 123.44348541 113.87499291 N 12.52500758 12.95070203 12.45342959 26.85151636 25.85098743 28.68454887