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=431.0008515243755 pbc="F T F" In -0.16561133 0.26867345 0.11475044 49 -469.14466290 -763.30577402 -886.42264620 In 1.42349385 1.42756670 0.11112704 49 537.88065265 555.47947588 -652.44992133 In 1.24831061 0.25431947 1.58006198 49 478.37206330 -626.04023739 719.54726768 In -0.14503361 1.58099246 1.39709891 49 -547.10805304 833.86653553 819.32529985