16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-23.6072465589 stress="-0.4456368934314633 0.05009173405711519 0.03071767203096624 0.05009173405711519 -0.2690725634144375 0.02088234199642109 0.03071767203096624 0.02088234199642109 -0.31664312479046575" pbc="F F F" As -0.14459490 -0.03685815 0.17374842 -0.54618572 0.02351181 0.58201233 As 1.70960170 1.31143450 1.33833517 -4.69907444 -0.98121156 0.76067540 As 2.78829595 -0.16490224 0.14041416 0.83816942 -1.91386657 -2.38412762 As 4.27812781 1.45624327 1.10681310 4.68520891 -0.36264694 0.28707010 As -0.12320595 2.95894820 0.19710819 -1.90171376 -0.57199116 -0.32093534 As 1.56504129 4.20865944 1.20677031 -5.23343274 6.77077081 -0.69096224 As 2.78802619 3.06417784 0.18584377 4.83405798 0.44214172 -6.80206240 As 4.50030947 4.61568315 1.64685009 0.84717296 -0.08707457 -0.13839957 As 0.26959405 -0.07977220 2.85402479 -1.10886538 -0.49534026 0.32126872 As 1.70996341 1.49207130 4.65300231 -0.79718859 -1.22618665 0.00320791 As 3.03848316 -0.04225341 2.91852158 1.30511562 -1.30106605 2.88453077 As 4.54863242 1.66045644 4.20422929 0.40655963 -0.48368511 0.43115075 As 0.19178619 3.31028438 3.29140871 -2.36416326 -0.63107966 1.30974400 As 1.61455359 4.53253581 4.64904689 -2.84174394 2.12069481 2.02539435 As 2.78091226 3.36587963 2.96603997 3.38262171 -1.85416780 -0.31949228 As 4.03190537 4.10662332 4.59704929 3.19346160 0.55119718 2.05092514