# generated using pymatgen data_Ti3Mn4NbP4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.47706469 _cell_length_b 6.17382445 _cell_length_c 7.28141106 _cell_angle_alpha 89.79258589 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Mn4NbP4 _chemical_formula_sum 'Ti3 Mn4 Nb1 P4' _cell_volume 156.30747598 _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 Ti Ti0 1 0.25000000 0.53493429 0.67311317 1.0 Ti Ti1 1 0.75000000 0.46275704 0.32738971 1.0 Ti Ti2 1 0.25000000 0.03624843 0.82639121 1.0 Mn Mn3 1 0.75000000 0.86385369 0.56052941 1.0 Mn Mn4 1 0.25000000 0.13845428 0.44208663 1.0 Mn Mn5 1 0.75000000 0.36243917 0.93929416 1.0 Mn Mn6 1 0.25000000 0.63616909 0.05833782 1.0 Nb Nb7 1 0.75000000 0.96380391 0.17146975 1.0 P P8 1 0.25000000 0.26530231 0.13270624 1.0 P P9 1 0.75000000 0.73879408 0.86366059 1.0 P P10 1 0.25000000 0.75523243 0.37149353 1.0 P P11 1 0.75000000 0.24201027 0.63352678 1.0