# generated using pymatgen data_Ca3Pr6HoPb6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.33899354 _cell_length_b 9.33899356 _cell_length_c 6.92149529 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000340 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca3Pr6HoPb6 _chemical_formula_sum 'Ca3 Pr6 Ho1 Pb6' _cell_volume 522.79412143 _cell_formula_units_Z 1 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 Ca Ca0 1 0.33333300 0.66666700 0.00000000 1.0 Ca Ca1 1 0.66666700 0.33333300 0.50000000 1.0 Ca Ca2 1 0.66666700 0.33333300 0.00000000 1.0 Pr Pr3 1 0.25144186 0.00155654 0.25419884 1.0 Pr Pr4 1 0.25144186 0.24988632 0.74580116 1.0 Pr Pr5 1 0.99844346 0.74855814 0.74580116 1.0 Pr Pr6 1 0.99844346 0.24988632 0.25419884 1.0 Pr Pr7 1 0.75011368 0.74855814 0.25419884 1.0 Pr Pr8 1 0.75011368 0.00155654 0.74580116 1.0 Ho Ho9 1 0.33333300 0.66666700 0.50000000 1.0 Pb Pb10 1 0.60543824 0.99524958 0.25590490 1.0 Pb Pb11 1 0.60543824 0.61018866 0.74409510 1.0 Pb Pb12 1 0.00475042 0.39456176 0.74409510 1.0 Pb Pb13 1 0.00475042 0.61018866 0.25590490 1.0 Pb Pb14 1 0.38981134 0.39456176 0.25590490 1.0 Pb Pb15 1 0.38981134 0.99524958 0.74409510 1.0