# generated using pymatgen data_Ca2Cu7P4Pd _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.31191537 _cell_length_b 7.33457994 _cell_length_c 3.76184550 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.30454979 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2Cu7P4Pd _chemical_formula_sum 'Ca2 Cu7 P4 Pd1' _cell_volume 201.74427643 _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 0.99751489 0.00142041 0.00000000 1.0 Ca Ca1 1 0.49781777 0.49975591 0.50000000 1.0 Cu Cu2 1 0.16356361 0.58301436 0.00000000 1.0 Cu Cu3 1 0.40973613 0.83661783 0.00000000 1.0 Cu Cu4 1 0.92502599 0.65623425 0.50000000 1.0 Cu Cu5 1 0.83572292 0.41780170 0.00000000 1.0 Cu Cu6 1 0.58375665 0.16717864 0.00000000 1.0 Cu Cu7 1 0.08450449 0.33485486 0.50000000 1.0 Cu Cu8 1 0.32949687 0.08582710 0.50000000 1.0 P P9 1 0.28096947 0.28228900 0.00000000 1.0 P P10 1 0.72334211 0.71221251 0.00000000 1.0 P P11 1 0.78242741 0.22854734 0.50000000 1.0 P P12 1 0.22153951 0.78247931 0.50000000 1.0 Pd Pd13 1 0.66458317 0.91176678 0.50000000 1.0