# generated using pymatgen data_TaTiMnB2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.80650663 _cell_length_b 5.80437263 _cell_length_c 3.18387572 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaTiMnB2 _chemical_formula_sum 'Ta2 Ti2 Mn2 B4' _cell_volume 107.30657160 _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 Ta Ta0 1 0.81880846 0.67920191 0.50000000 1.0 Ta Ta1 1 0.31880846 0.82079809 0.50000000 1.0 Ti Ti2 1 0.18072757 0.31760654 0.50000000 1.0 Ti Ti3 1 0.68072757 0.18239346 0.50000000 1.0 Mn Mn4 1 0.49891314 0.49692802 0.00000000 1.0 Mn Mn5 1 0.99891314 0.00307198 0.00000000 1.0 B B6 1 0.11175764 0.60637663 0.00000000 1.0 B B7 1 0.61175764 0.89362337 0.00000000 1.0 B B8 1 0.38979218 0.11501146 0.00000000 1.0 B B9 1 0.88979218 0.38498854 0.00000000 1.0