# generated using pymatgen data_Hf3Al2CuC _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.51049738 _cell_length_b 8.51047360 _cell_length_c 8.51048131 _cell_angle_alpha 60.00008917 _cell_angle_beta 60.00004158 _cell_angle_gamma 60.00000972 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Al2CuC _chemical_formula_sum 'Hf12 Al8 Cu4 C4' _cell_volume 435.86124611 _cell_formula_units_Z 4 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 0.43778995 0.43778995 0.06221005 1.0 Hf Hf1 1 0.06221005 0.43778995 0.06221005 1.0 Hf Hf2 1 0.43778995 0.06221005 0.06221005 1.0 Hf Hf3 1 0.06221005 0.06221005 0.43778995 1.0 Hf Hf4 1 0.43778995 0.06221005 0.43778995 1.0 Hf Hf5 1 0.06221005 0.43778995 0.43778995 1.0 Hf Hf6 1 0.81221005 0.81221005 0.18778995 1.0 Hf Hf7 1 0.18778995 0.81221005 0.18778995 1.0 Hf Hf8 1 0.81221005 0.18778995 0.18778995 1.0 Hf Hf9 1 0.18778995 0.18778995 0.81221005 1.0 Hf Hf10 1 0.81221005 0.18778995 0.81221005 1.0 Hf Hf11 1 0.18778995 0.81221005 0.81221005 1.0 Al Al12 1 0.83083270 0.83083270 0.50750190 1.0 Al Al13 1 0.83083270 0.50750190 0.83083270 1.0 Al Al14 1 0.50750190 0.83083270 0.83083270 1.0 Al Al15 1 0.83083270 0.83083270 0.83083270 1.0 Al Al16 1 0.41916730 0.41916730 0.74249810 1.0 Al Al17 1 0.41916730 0.74249810 0.41916730 1.0 Al Al18 1 0.74249810 0.41916730 0.41916730 1.0 Al Al19 1 0.41916730 0.41916730 0.41916730 1.0 Cu Cu20 1 0.62500000 0.62500000 0.12500000 1.0 Cu Cu21 1 0.62500000 0.12500000 0.62500000 1.0 Cu Cu22 1 0.12500000 0.62500000 0.62500000 1.0 Cu Cu23 1 0.62500000 0.62500000 0.62500000 1.0 C C24 1 0.12500000 0.12500000 0.62500000 1.0 C C25 1 0.12500000 0.62500000 0.12500000 1.0 C C26 1 0.62500000 0.12500000 0.12500000 1.0 C C27 1 0.12500000 0.12500000 0.12500000 1.0