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=5.39126316651 stress="-1.8932870977000915 -0.3939836023618662 -0.14111906563717158 -0.3939836023618662 -1.3448136914136244 0.16538934578795828 -0.14111906563717158 0.16538934578795828 -1.9014586892539953" pbc="F F F"
O       0.27219963      -0.06618674       0.13132919      -4.89477038      -4.11861356      -2.89958377 
O       1.75978669       1.22592512      -0.21495266       3.34825655       4.01143638      -3.63049545 
O       1.68365717       0.20288723       1.58343331       3.53163449      -1.93121070       4.93935721 
O      -0.20414597       1.44809454       1.72094491      -1.98512066       2.03838788       1.59072201