# generated using pymatgen data_TaTi(SiTc)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.26307105 _cell_length_b 6.81289700 _cell_length_c 11.69786690 _cell_angle_alpha 89.68974049 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaTi(SiTc)2 _chemical_formula_sum 'Ta3 Ti3 Si6 Tc6' _cell_volume 260.05107996 _cell_formula_units_Z 3 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 0.50000000 0.40512832 0.00170103 1.0 Ta Ta1 1 0.50000000 0.89917667 0.49972625 1.0 Ta Ta2 1 0.50000000 0.79682052 0.80020278 1.0 Ti Ti3 1 0.50000000 0.29692950 0.29907084 1.0 Ti Ti4 1 0.50000000 0.29709497 0.69919216 1.0 Ti Ti5 1 0.50000000 0.79899298 0.20213026 1.0 Si Si6 1 0.50000000 0.00240302 0.00198330 1.0 Si Si7 1 0.50000000 0.49643432 0.49809928 1.0 Si Si8 1 0.00000000 0.00245749 0.66736223 1.0 Si Si9 1 0.00000000 0.50270177 0.16937062 1.0 Si Si10 1 0.00000000 0.49559334 0.83114813 1.0 Si Si11 1 0.00000000 0.00172183 0.33137898 1.0 Tc Tc12 1 0.00000000 0.24216773 0.49995089 1.0 Tc Tc13 1 0.00000000 0.74521869 0.99985736 1.0 Tc Tc14 1 0.00000000 0.62715940 0.62752897 1.0 Tc Tc15 1 0.00000000 0.13125262 0.12887093 1.0 Tc Tc16 1 0.00000000 0.12886419 0.87118022 1.0 Tc Tc17 1 0.00000000 0.63008064 0.37124477 1.0