# generated using pymatgen data_Zr4Ti3MoP4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.53757416 _cell_length_b 6.77154183 _cell_length_c 8.18116689 _cell_angle_alpha 90.09933515 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4Ti3MoP4 _chemical_formula_sum 'Zr4 Ti3 Mo1 P4' _cell_volume 195.97817918 _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 0.03564595 0.82987689 1.0 Zr Zr1 1 0.75000000 0.96530414 0.16952467 1.0 Zr Zr2 1 0.25000000 0.53529508 0.66938809 1.0 Zr Zr3 1 0.75000000 0.45943604 0.33118403 1.0 Ti Ti4 1 0.75000000 0.36399170 0.93898162 1.0 Ti Ti5 1 0.25000000 0.63471736 0.06106412 1.0 Ti Ti6 1 0.75000000 0.86910127 0.55835308 1.0 Mo Mo7 1 0.25000000 0.13655473 0.44155983 1.0 P P8 1 0.25000000 0.76160717 0.36044641 1.0 P P9 1 0.75000000 0.23806512 0.64085105 1.0 P P10 1 0.25000000 0.26230256 0.13643331 1.0 P P11 1 0.75000000 0.73797790 0.86233890 1.0