# generated using pymatgen data_Zr2CuSiP2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.87442400 _cell_length_b 2.87442400 _cell_length_c 14.78882400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr2CuSiP2 _chemical_formula_sum 'Zr2 Cu1 Si1 P2' _cell_volume 122.18989770 _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 Zr Zr0 1 0.50000000 0.50000000 0.18305000 1.0 Zr Zr1 1 0.50000000 0.50000000 0.81695000 1.0 Cu Cu2 1 0.50000000 0.50000000 0.50000000 1.0 Si Si3 1 0.50000000 0.50000000 0.00000000 1.0 P P4 1 0.50000000 0.50000000 0.64702400 1.0 P P5 1 0.50000000 0.50000000 0.35297600 1.0