# generated using pymatgen data_Nd2Th(AlNi)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.07960598 _cell_length_b 7.01949526 _cell_length_c 4.04577863 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.28367689 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2Th(AlNi)3 _chemical_formula_sum 'Nd2 Th1 Al3 Ni3' _cell_volume 173.61976797 _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 0.99911991 0.41897871 0.50000000 1.0 Nd Nd1 1 0.58014020 0.58102129 0.50000000 1.0 Th Th2 1 0.42140302 1.00000000 0.50000000 1.0 Al Al3 1 0.99839683 0.77104555 0.00000000 1.0 Al Al4 1 0.22735128 0.22895445 0.00000000 1.0 Al Al5 1 0.77807758 1.00000000 0.00000000 1.0 Ni Ni6 1 0.33518412 0.68495186 0.00000000 1.0 Ni Ni7 1 0.65023326 0.31504814 0.00000000 1.0 Ni Ni8 1 0.01009481 1.00000000 0.50000000 1.0