# generated using pymatgen data_Zr5BeInPb2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.68916910 _cell_length_b 8.70690584 _cell_length_c 5.88883896 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.06754733 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr5BeInPb2 _chemical_formula_sum 'Zr10 Be2 In2 Pb4' _cell_volume 385.57281079 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Zr Zr0 1 0.66487754 0.33180876 0.49661786 1.0 Zr Zr1 1 0.33512246 0.66693223 0.49661786 1.0 Zr Zr2 1 0.33512246 0.66693223 0.00338214 1.0 Zr Zr3 1 0.66487754 0.33180876 0.00338214 1.0 Zr Zr4 1 0.74455139 0.74742975 0.25000000 1.0 Zr Zr5 1 0.25544861 0.00287836 0.25000000 1.0 Zr Zr6 1 1.00000000 0.25373307 0.25000000 1.0 Zr Zr7 1 0.23694825 0.23600410 0.75000000 1.0 Zr Zr8 1 0.76305175 0.99905685 0.75000000 1.0 Zr Zr9 1 1.00000000 0.76413201 0.75000000 1.0 Be Be10 1 0.00000000 0.00076052 0.47078246 1.0 Be Be11 1 0.00000000 0.00076052 0.02921754 1.0 In In12 1 0.38477475 0.38519502 0.25000000 1.0 In In13 1 0.61522525 0.00042027 0.25000000 1.0 Pb Pb14 1 0.00000000 0.61607480 0.25000000 1.0 Pb Pb15 1 0.60583888 0.60488703 0.75000000 1.0 Pb Pb16 1 0.39416112 0.99904814 0.75000000 1.0 Pb Pb17 1 0.00000000 0.39214058 0.75000000 1.0