# generated using pymatgen data_Hf6Si6Mo4C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.65541894 _cell_length_b 7.65541862 _cell_length_c 5.22005749 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000141 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6Si6Mo4C _chemical_formula_sum 'Hf6 Si6 Mo4 C1' _cell_volume 264.93773435 _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 Hf Hf0 1 1.00000000 0.75776464 0.25367595 1.0 Hf Hf1 1 0.24223536 0.24223536 0.25367595 1.0 Hf Hf2 1 0.75776464 0.00000000 0.25367595 1.0 Hf Hf3 1 0.00000000 0.24223536 0.74632405 1.0 Hf Hf4 1 0.75776464 0.75776464 0.74632405 1.0 Hf Hf5 1 0.24223536 0.00000000 0.74632405 1.0 Si Si6 1 0.00000000 0.40355300 0.24102537 1.0 Si Si7 1 0.59644700 0.59644700 0.24102537 1.0 Si Si8 1 0.40355300 0.00000000 0.24102537 1.0 Si Si9 1 1.00000000 0.59644700 0.75897463 1.0 Si Si10 1 0.40355300 0.40355300 0.75897463 1.0 Si Si11 1 0.59644700 0.00000000 0.75897463 1.0 Mo Mo12 1 0.33333300 0.66666700 0.00000000 1.0 Mo Mo13 1 0.66666700 0.33333300 0.00000000 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