4 Lattice="4.607096427342821 -9.031482175823309e-20 0.0 2.8244078853743154e-16 4.607096427342821 0.0 -1.344905858196934e-16 0.0 19.03050865276332" Properties=species:S:1:pos:R:3 energy=-11.261587921128676 pbc="T T F" I 0.00000000 0.00000000 12.11502996 I 2.30354821 2.30354821 6.91546953 Pb 2.30354821 0.00000000 9.51524984 Pb 0.00000000 2.30354821 9.51524984