# generated using pymatgen data_Ti8Si6Mo2C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.41760524 _cell_length_b 7.41760540 _cell_length_c 5.09122951 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999484 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti8Si6Mo2C _chemical_formula_sum 'Ti8 Si6 Mo2 C1' _cell_volume 242.59440062 _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 0.00000000 0.76164110 0.25626807 1.0 Ti Ti1 1 0.23835890 0.23835890 0.25626807 1.0 Ti Ti2 1 0.76164110 0.00000000 0.25626807 1.0 Ti Ti3 1 1.00000000 0.23835890 0.74373193 1.0 Ti Ti4 1 0.76164110 0.76164110 0.74373193 1.0 Ti Ti5 1 0.23835890 1.00000000 0.74373193 1.0 Ti Ti6 1 0.33333300 0.66666700 0.00000000 1.0 Ti Ti7 1 0.66666700 0.33333300 0.00000000 1.0 Si Si8 1 1.00000000 0.40168325 0.25029894 1.0 Si Si9 1 0.59831675 0.59831675 0.25029894 1.0 Si Si10 1 0.40168325 1.00000000 0.25029894 1.0 Si Si11 1 0.00000000 0.59831675 0.74970106 1.0 Si Si12 1 0.40168325 0.40168325 0.74970106 1.0 Si Si13 1 0.59831675 0.00000000 0.74970106 1.0 Mo Mo14 1 0.66666700 0.33333300 0.50000000 1.0 Mo Mo15 1 0.33333300 0.66666700 0.50000000 1.0 C C16 1 0.00000000 0.00000000 0.50000000 1.0