4
Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-3.00692126762 stress="0.3800227484199838 -0.4524455747135582 0.15609930887705456 -0.4524455747135582 1.188711500391054 0.13557353300844416 0.15609930887705456 0.13557353300844416 0.8921132266148328" pbc="F F F"
O      -0.21770305       0.02031036       0.18745344       0.29401611       0.93768111       2.04869681 
O       1.52015752       1.37970777       0.27711528       0.29726075      -0.57317239       1.12803608 
O       1.37871118      -0.24786923       1.23125112      -1.17160266       1.58314481      -1.64724420 
O      -0.28175649       1.63616082       1.26429260       0.58032579      -1.94765353      -1.52948868