# generated using pymatgen data_Zr4Ti3MnP4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.58603031 _cell_length_b 6.69499323 _cell_length_c 8.06407692 _cell_angle_alpha 89.76354913 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4Ti3MnP4 _chemical_formula_sum 'Zr4 Ti3 Mn1 P4' _cell_volume 193.60432796 _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 0.25000000 0.53921721 0.67309967 1.0 Zr Zr1 1 0.25000000 0.03450191 0.83245449 1.0 Zr Zr2 1 0.75000000 0.96132093 0.16836050 1.0 Zr Zr3 1 0.75000000 0.46491188 0.32782728 1.0 Ti Ti4 1 0.75000000 0.36828050 0.94135198 1.0 Ti Ti5 1 0.25000000 0.13278006 0.43816319 1.0 Ti Ti6 1 0.75000000 0.86133450 0.55907698 1.0 Mn Mn7 1 0.25000000 0.63720725 0.05811150 1.0 P P8 1 0.25000000 0.26439712 0.13731648 1.0 P P9 1 0.25000000 0.76006084 0.35838608 1.0 P P10 1 0.75000000 0.73748623 0.86938426 1.0 P P11 1 0.75000000 0.23850256 0.63646758 1.0