# generated using pymatgen data_HfTaTiB4MoC4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.73308000 _cell_length_b 5.74000782 _cell_length_c 7.44502711 _cell_angle_alpha 90.03116168 _cell_angle_beta 89.98643992 _cell_angle_gamma 119.95546292 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfTaTiB4MoC4 _chemical_formula_sum 'Hf2 Ta2 Ti2 B8 Mo2 C8' _cell_volume 212.27168481 _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 Hf Hf0 1 0.50000000 0.00000000 0.00000000 1.0 Hf Hf1 1 0.00000000 0.00000000 0.50000000 1.0 Ta Ta2 1 0.00000000 0.00000000 0.00000000 1.0 Ta Ta3 1 0.00000000 0.50000000 0.50000000 1.0 Ti Ti4 1 0.00000000 0.50000000 0.00000000 1.0 Ti Ti5 1 0.50000000 0.50000000 0.50000000 1.0 B B6 1 0.33570200 0.16983700 0.74833100 1.0 B B7 1 0.33275200 0.66467400 0.74768500 1.0 B B8 1 0.83037200 0.66326200 0.75228200 1.0 B B9 1 0.83380800 0.16903900 0.75122000 1.0 B B10 1 0.16619200 0.83096100 0.24878000 1.0 B B11 1 0.16962800 0.33673800 0.24771800 1.0 B B12 1 0.66724800 0.33532600 0.25231500 1.0 B B13 1 0.66429800 0.83016300 0.25166900 1.0 Mo Mo14 1 0.50000000 0.50000000 0.00000000 1.0 Mo Mo15 1 0.50000000 0.00000000 0.50000000 1.0 C C16 1 0.33348200 0.16742600 0.25092600 1.0 C C17 1 0.33235900 0.66611500 0.25029000 1.0 C C18 1 0.83314400 0.66620000 0.24853100 1.0 C C19 1 0.83472700 0.16854100 0.24947500 1.0 C C20 1 0.16527300 0.83145900 0.75052500 1.0 C C21 1 0.16685600 0.33380000 0.75146900 1.0 C C22 1 0.66764100 0.33388500 0.74971000 1.0 C C23 1 0.66651800 0.83257400 0.74907400 1.0