# generated using pymatgen data_Ti10BSb6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.00299465 _cell_length_b 8.00299489 _cell_length_c 5.44466524 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000310 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti10BSb6 _chemical_formula_sum 'Ti10 B1 Sb6' _cell_volume 301.99994715 _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 0.66666700 0.33333300 0.50000000 1.0 Ti Ti1 1 0.33333300 0.66666700 0.50000000 1.0 Ti Ti2 1 0.33333300 0.66666700 0.00000000 1.0 Ti Ti3 1 0.66666700 0.33333300 0.00000000 1.0 Ti Ti4 1 0.76645620 0.76645620 0.26010845 1.0 Ti Ti5 1 0.23354380 0.00000000 0.26010845 1.0 Ti Ti6 1 0.00000000 0.23354380 0.26010845 1.0 Ti Ti7 1 0.23354380 0.23354380 0.73989155 1.0 Ti Ti8 1 0.76645620 1.00000000 0.73989155 1.0 Ti Ti9 1 1.00000000 0.76645620 0.73989155 1.0 B B10 1 0.00000000 0.00000000 0.50000000 1.0 Sb Sb11 1 0.39362285 0.39362285 0.24572345 1.0 Sb Sb12 1 0.60637715 1.00000000 0.24572345 1.0 Sb Sb13 1 1.00000000 0.60637715 0.24572345 1.0 Sb Sb14 1 0.60637715 0.60637715 0.75427655 1.0 Sb Sb15 1 0.39362285 0.00000000 0.75427655 1.0 Sb Sb16 1 0.00000000 0.39362285 0.75427655 1.0