# generated using pymatgen data_Nd(GaCu)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.61393402 _cell_length_b 6.61393345 _cell_length_c 6.61393381 _cell_angle_alpha 134.75731651 _cell_angle_beta 99.67596032 _cell_angle_gamma 97.34356465 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd(GaCu)6 _chemical_formula_sum 'Nd1 Ga6 Cu6' _cell_volume 189.58688382 _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 Nd Nd0 1 0.00000000 0.00000000 0.00000000 1.0 Ga Ga1 1 0.65149655 0.00000000 0.65149655 1.0 Ga Ga2 1 0.34850345 1.00000000 0.34850345 1.0 Ga Ga3 1 0.65016360 0.65016360 0.00000000 1.0 Ga Ga4 1 0.34983640 0.34983640 1.00000000 1.0 Ga Ga5 1 0.19992971 0.69992971 0.50000000 1.0 Ga Ga6 1 0.80007029 0.30007029 0.50000000 1.0 Cu Cu7 1 0.00000000 0.00000000 0.50000000 1.0 Cu Cu8 1 0.00000000 0.50000000 0.00000000 1.0 Cu Cu9 1 0.50000000 0.50000000 0.50000000 1.0 Cu Cu10 1 0.50000000 0.00000000 0.00000000 1.0 Cu Cu11 1 0.23646470 0.50000000 0.73646470 1.0 Cu Cu12 1 0.76353530 0.50000000 0.26353530 1.0