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=178.33718288563438 stress="-0.10115939468836196 0.04392399167931448 0.06058944051647114 0.04392399167931448 -0.06868000584512303 -0.06065756290698944 0.06058944051647114 -0.06065756290698944 -0.07348400849368587" pbc="F F F" user01 10.41870436 10.54860922 10.70118821 0.20292385 0.62577540 1.85236945 user01 11.73180132 10.99524776 11.21966436 -638.32619614 919.74783269 726.97229558 user01 12.04808264 10.51875493 10.84330139 473.77828268 -1041.12898610 -768.34283762 user01 12.61156112 11.06464288 11.02643906 159.97796606 128.26341706 41.29152983 user01 10.59773896 12.19066365 10.88449718 -183.57498264 -69.76250498 -60.77837844 user01 11.31504129 12.45865944 11.11550211 -806.31263534 582.20838769 889.71435555 user01 11.78802619 12.22277084 10.68584377 958.32717986 -481.37495299 -869.64670398 user01 12.75546308 12.87067295 11.52675675 -2.47513679 -0.63367513 3.65488542 user01 10.55179855 10.95904430 11.91612479 0.18662968 2.44387871 -0.48742504 user01 11.59359200 11.06910071 12.81861299 2.97009762 0.37688522 -2.08720356 user01 12.17509931 10.36254692 11.79571662 5.56429595 1.02895959 6.31894366 user01 12.50658342 11.24867558 12.28777214 -6.39180248 -1.81859688 -4.23598686 user01 10.52712063 11.92044154 12.37752479 1.79062004 -1.38211232 -1.05164324 user01 11.39824538 12.80852517 12.62234339 -64.84906924 -7.95755096 4.00589684 user01 11.74466662 12.01192837 11.72163713 34.21437761 -33.93816928 43.95046361 user01 12.25776497 12.87032424 12.53652570 64.91744926 3.30141231 -11.13056118