8 Lattice="4.104407572896589 -1.0019796749599648e-18 0.0 2.568113423885756e-18 3.247372605233355 0.0 0.0 0.0 19.71271661033327" Properties=species:S:1:pos:R:3 energy=-65.40670405905422 dipole="-1.9326921266181143 1.4599841975613835e-06 1.9874039829959846e-06" free_energy=-65.40670405905497 pbc="T T F" Zr 2.59243044 0.81182807 11.01660783 Zr 0.54012748 2.43554457 8.69610755 O 0.54019127 0.81185364 10.18367072 O 2.59236250 2.43551903 9.52904530 O 1.28384380 0.81186737 7.50000000 O 1.84872054 2.43550528 12.21271661 O -0.20377309 0.81186735 7.50019291 O 3.33632842 2.43550526 12.21252017