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=48625.278677023554 pbc="F F T" Cm 0.31814346 0.16904341 -0.11360081 96 -67465.59184554 -49872.68092592 -37510.76141912 Cm 1.43475302 1.41118613 0.17522662 96 74744.88360283 120724.90242110 -97031.96005525 Cm 1.28392317 0.28422576 1.28964373 96 69903.71208076 -130309.41817921 106028.67251501 Cm 0.14688167 1.49220836 1.33496399 96 -77183.00383806 59457.19668403 28514.04895936