# generated using pymatgen data_NdAl3NiHg _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.15295639 _cell_length_b 6.64093234 _cell_length_c 8.22779615 _cell_angle_alpha 90.00000000 _cell_angle_beta 104.61799928 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdAl3NiHg _chemical_formula_sum 'Nd2 Al6 Ni2 Hg2' _cell_volume 219.57315644 _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 Nd Nd0 1 0.87939734 0.75000000 0.75879467 1.0 Nd Nd1 1 0.12060266 0.25000000 0.24120533 1.0 Al Al2 1 0.07963149 0.75000000 0.15926099 1.0 Al Al3 1 0.92036851 0.25000000 0.84073901 1.0 Al Al4 1 0.69363651 0.55454206 0.38727402 1.0 Al Al5 1 0.30636349 0.44545794 0.61272598 1.0 Al Al6 1 0.69363651 0.94545794 0.38727402 1.0 Al Al7 1 0.30636349 0.05454206 0.61272598 1.0 Ni Ni8 1 0.22406489 0.75000000 0.44813078 1.0 Ni Ni9 1 0.77593511 0.25000000 0.55186922 1.0 Hg Hg10 1 0.50000000 0.50000000 0.00000000 1.0 Hg Hg11 1 0.50000000 0.00000000 0.00000000 1.0