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:Z:I:1:forces:R:3 energy=139.607870159 pbc="T F T" Sr 0.19724111 -0.03787426 -0.00548572 38 -15.19014098 -45.08414870 -2.45932750 Sr 1.34126820 1.34140700 -0.18331863 38 16.97328427 43.99638866 4.64240620 Sr 1.41986395 -0.05314731 1.38659309 38 13.78052517 -44.73085762 1.82711917 Sr 0.22029417 1.43381326 1.45316417 38 -15.56366845 45.81861766 -4.01019787