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=15.252589976238625 pbc="F T T" Ne 0.18365717 0.20288723 0.36621528 10 -31.27320055 -33.42486255 -14.07292070 Ne 1.29585403 1.44809454 0.22094491 10 28.02876689 35.85245049 -23.47968300 Ne 1.73171545 0.18190327 1.32183498 10 17.31565932 -15.55454715 18.26049074 Ne 0.21219253 1.42485375 1.62990665 10 -14.07122566 13.12695921 19.29211296