# generated using pymatgen data_Ti4TcB2P _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.05877260 _cell_length_b 7.05877292 _cell_length_c 7.05877233 _cell_angle_alpha 130.22890072 _cell_angle_beta 130.22889842 _cell_angle_gamma 73.04109369 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti4TcB2P _chemical_formula_sum 'Ti8 Tc2 B4 P2' _cell_volume 200.20596467 _cell_formula_units_Z 2 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 0.19031030 0.69031030 0.15191593 1.0 Ti Ti1 1 0.46160562 0.96160562 0.15191593 1.0 Ti Ti2 1 0.53839438 0.03839438 0.84808407 1.0 Ti Ti3 1 0.03839438 0.19031030 0.50000000 1.0 Ti Ti4 1 0.69031030 0.53839438 0.50000000 1.0 Ti Ti5 1 0.96160562 0.80968970 0.50000000 1.0 Ti Ti6 1 0.30968970 0.46160562 0.50000000 1.0 Ti Ti7 1 0.80968970 0.30968970 0.84808407 1.0 Tc Tc8 1 0.00000000 0.00000000 0.00000000 1.0 Tc Tc9 1 0.50000000 0.50000000 0.00000000 1.0 B B10 1 0.88872374 0.38872374 0.27744849 1.0 B B11 1 0.38872374 0.11127626 0.50000000 1.0 B B12 1 0.61127626 0.88872374 0.50000000 1.0 B B13 1 0.11127626 0.61127626 0.72255151 1.0 P P14 1 0.75000000 0.75000000 0.00000000 1.0 P P15 1 0.25000000 0.25000000 0.00000000 1.0