# generated using pymatgen data_TaTi2(MoP)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.71788459 _cell_length_b 6.76836706 _cell_length_c 3.30575462 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.24889025 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaTi2(MoP)3 _chemical_formula_sum 'Ta1 Ti2 Mo3 P3' _cell_volume 129.84433633 _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 Ta Ta0 1 1.00000000 0.59605102 0.50000000 1.0 Ti Ti1 1 0.40139684 0.40398531 0.50000000 1.0 Ti Ti2 1 0.59860316 0.00258647 0.50000000 1.0 Mo Mo3 1 0.25720571 0.99887267 0.00000000 1.0 Mo Mo4 1 0.74279429 0.74166696 0.00000000 1.0 Mo Mo5 1 1.00000000 0.25712570 0.00000000 1.0 P P6 1 0.66237868 0.33044108 0.00000000 1.0 P P7 1 0.33762132 0.66806240 0.00000000 1.0 P P8 1 0.00000000 0.00120839 0.50000000 1.0