# generated using pymatgen data_Ti(BeTc)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.09468086 _cell_length_b 6.09468086 _cell_length_c 3.16648710 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti(BeTc)2 _chemical_formula_sum 'Ti2 Be4 Tc4' _cell_volume 117.61958994 _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 0.00000000 0.00000000 0.00000000 1.0 Ti Ti1 1 0.50000000 0.50000000 0.00000000 1.0 Be Be2 1 0.88306349 0.38306349 0.00000000 1.0 Be Be3 1 0.38306349 0.11693651 0.00000000 1.0 Be Be4 1 0.61693651 0.88306349 0.00000000 1.0 Be Be5 1 0.11693651 0.61693651 0.00000000 1.0 Tc Tc6 1 0.67652756 0.17652756 0.50000000 1.0 Tc Tc7 1 0.17652756 0.32347244 0.50000000 1.0 Tc Tc8 1 0.82347244 0.67652756 0.50000000 1.0 Tc Tc9 1 0.32347244 0.82347244 0.50000000 1.0