# generated using pymatgen data_YAlCu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.65405169 _cell_length_b 4.69068752 _cell_length_c 4.64849004 _cell_angle_alpha 60.05517989 _cell_angle_beta 60.80815357 _cell_angle_gamma 60.41493700 _symmetry_Int_Tables_number 1 _chemical_formula_structural YAlCu2 _chemical_formula_sum 'Y1 Al1 Cu2' _cell_volume 72.44219701 _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 Al Al0 1 0.63645923 0.61490691 0.14770362 1 Y Y1 1 0.12743574 0.11073618 0.60549760 1 Cu Cu2 1 0.86502546 0.89196205 0.38900864 1 Cu Cu3 1 0.37107956 0.38239485 0.85779011 1