# generated using pymatgen data_Ti2Nb8Ge6C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.67435272 _cell_length_b 7.67435449 _cell_length_c 5.25742385 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999665 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti2Nb8Ge6C _chemical_formula_sum 'Ti2 Nb8 Ge6 C1' _cell_volume 268.15583396 _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 Nb Nb2 1 0.00000000 0.76261429 0.25390364 1.0 Nb Nb3 1 0.23738571 0.23738571 0.25390364 1.0 Nb Nb4 1 0.76261429 1.00000000 0.25390364 1.0 Nb Nb5 1 1.00000000 0.23738571 0.74609636 1.0 Nb Nb6 1 0.76261429 0.76261429 0.74609636 1.0 Nb Nb7 1 0.23738571 0.00000000 0.74609636 1.0 Nb Nb8 1 0.33333300 0.66666700 0.00000000 1.0 Nb Nb9 1 0.66666700 0.33333300 0.00000000 1.0 Ge Ge10 1 1.00000000 0.40105679 0.25122937 1.0 Ge Ge11 1 0.59894321 0.59894321 0.25122937 1.0 Ge Ge12 1 0.40105679 0.00000000 0.25122937 1.0 Ge Ge13 1 0.00000000 0.59894321 0.74877063 1.0 Ge Ge14 1 0.40105679 0.40105679 0.74877063 1.0 Ge Ge15 1 0.59894321 1.00000000 0.74877063 1.0 C C16 1 0.00000000 0.00000000 0.50000000 1.0