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=-4.310272132147262 stress="7.9278317642668075 -1.7157425508302264 -0.4161888595983365 -1.7157425508302264 8.771468977226505 -0.557693016022764 -0.4161888595983365 -0.557693016022764 7.896445415411092" pbc="F F F"
O       0.09798015       0.06085714      -0.17665654       1.38605753       2.20669070       2.52397676 
O       1.43383925       1.74459391       0.09954099      -2.70988659      -2.24782588       2.28035229 
O       1.37828759      -0.03867855       1.77058364      -3.67100747       3.92357710      -1.87453592 
O       0.17650386       1.24469609       1.48765941       4.99483652      -3.88244191      -2.92979312