3 Lattice="4.0861693425397245 -2.0492092684227656e-18 0.0 -2.0954271830889827e-17 4.086169276783486 0.0 8.947609468902816e-18 0.0 18.88908729652601" Properties=species:S:1:pos:R:3 energy=-8.848349599345234 pbc="T T F" Pt 0.00000000 0.00000000 9.44454372 I -0.00000000 2.04308464 11.12000771 I 2.04308467 -0.00000000 7.76907963