# generated using pymatgen data_TaTi2SnC2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.16832497 _cell_length_b 3.16832512 _cell_length_c 18.77603488 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99997771 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaTi2SnC2 _chemical_formula_sum 'Ta2 Ti4 Sn2 C4' _cell_volume 163.22777962 _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 0.00000000 0.00000000 0.00000000 1.0 Ta Ta1 1 0.00000000 0.00000000 0.50000000 1.0 Ti Ti2 1 0.33333300 0.66666700 0.12654301 1.0 Ti Ti3 1 0.33333300 0.66666700 0.37345699 1.0 Ti Ti4 1 0.66666700 0.33333300 0.62654301 1.0 Ti Ti5 1 0.66666700 0.33333300 0.87345699 1.0 Sn Sn6 1 0.00000000 0.00000000 0.25000000 1.0 Sn Sn7 1 0.00000000 0.00000000 0.75000000 1.0 C C8 1 0.33333300 0.66666700 0.92998922 1.0 C C9 1 0.66666700 0.33333300 0.07001078 1.0 C C10 1 0.66666700 0.33333300 0.42998922 1.0 C C11 1 0.33333300 0.66666700 0.57001078 1.0