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=0.7861376502944477 stress="-0.4527543884538383 -0.16772393300181282 -0.0838973569553352 -0.16772393300181282 -0.4191779860500557 0.07282892052243764 -0.0838973569553352 0.07282892052243764 -0.340997253301621" pbc="T T F"
O      -0.13449789      -0.21197381       0.22277084       3.60206883       5.04128565      -4.24894284 
O       1.68584377       1.68362810       0.19581920      -5.29246340      -3.36989901      -2.66406829 
O       1.68533325       0.22734064       1.67626233      -0.12503594       0.34902180       1.95686314 
O      -0.14597521       1.70996341       1.49207130       1.81543051      -2.02040844       4.95614799