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=405.3349536219042 stress="-0.024432095107812225 -0.0075288361796022295 -0.003265605912201301 -0.0075288361796022295 -0.021136939278672613 -0.0021843490862384607 -0.003265605912201301 -0.0021843490862384607 -0.02679266290167071" pbc="F F F" No 21.37353861 20.99456648 20.94993411 -12.55658024 -42.17118661 -16.17470870 No 22.71828358 22.73372448 22.26519551 126.99680390 -145.20811923 191.10708944 No 24.13718505 21.27381375 21.26162420 -224.98385302 -339.70859111 -396.12327853 No 25.32425922 22.23797177 22.58804070 540.87528792 451.12639511 88.35582855 No 20.99216147 23.45757109 21.25934348 -233.18667678 107.52514721 -183.30457538 No 22.62016664 25.45175793 22.31029750 -17.74246985 50.99926558 -21.63845426 No 24.08775480 23.75965934 20.85903627 89.40174988 92.58556227 -128.29399298 No 25.45887292 25.51132225 22.36880427 81.09909646 81.33631518 -75.68348792 No 21.26942523 20.93533898 24.00849633 -126.04542323 -171.47481356 -166.65301080 No 22.24358210 22.24616570 25.37024753 127.95021676 150.78475781 193.75945987 No 24.23567729 21.02991755 23.85495372 -217.24589661 -258.99506407 243.35588979 No 25.54273487 22.24399858 25.60888368 16.40071679 12.86001959 23.29348691 No 21.22849440 23.73737112 23.61335896 -104.91461098 67.41173452 121.92094369 No 22.35346653 25.57735207 25.44341939 -1.30110599 5.29591288 6.35469020 No 24.23443831 24.23554616 23.74933540 -64.96935756 -81.50638218 93.44196932 No 25.54631810 25.49499963 25.40797402 20.22210254 19.13904660 26.28215078