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=553.3804922674681 stress="-0.03195285199492723 -0.018368177299618746 0.0071089484550760935 -0.018368177299618746 -0.03450345280744968 0.005199957945350656 0.0071089484550760935 0.005199957945350656 -0.04161610009732939" pbc="F F F" Md 21.24074778 20.73570086 21.20853895 -78.54340523 -124.21832037 -115.25724442 Md 22.21257762 22.43105158 22.59442596 429.83639809 571.76089805 -543.28411623 Md 24.14853880 20.88377526 21.15210898 14.25927744 -47.38964430 -16.45264886 Md 25.64653326 22.82163396 22.62190232 129.39143232 -37.91598716 -41.65700054 Md 21.26470812 24.40990447 20.87329112 -88.74674024 -54.09034887 -105.94264736 Md 22.31154456 25.78297923 22.59633461 94.88585230 141.50451052 6.45402570 Md 23.85635826 23.54555417 20.83669033 15.54250852 51.65853421 -65.96165086 Md 25.67211378 25.53579981 22.82569400 18.76354630 37.54685280 -102.43587823 Md 21.16509608 21.22615524 23.98235575 -544.77830403 -600.60081900 544.19267794 Md 22.64048332 22.59358670 25.35402001 -242.88823100 -156.77492522 482.08865507 Md 24.21597299 21.18121991 24.09540077 -49.07146573 -250.37007832 -155.18778414 Md 25.51222377 22.45374013 25.59143846 143.98553275 106.21393635 158.13658366 Md 20.93773820 24.50093129 24.24761565 -227.75608252 -124.97377283 -39.77378463 Md 22.67172852 25.62803686 25.39276332 111.62596159 154.32003470 159.05945684 Md 23.77191164 23.86201228 23.93340855 260.52023943 321.66283354 -264.82153088 Md 25.58424932 25.62691039 25.32041191 12.97348000 11.66629590 100.84288693