# generated using pymatgen data_Nd6Sn7Hg3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.61336841 _cell_length_b 6.61336762 _cell_length_c 10.31099751 _cell_angle_alpha 90.61607520 _cell_angle_beta 90.61608257 _cell_angle_gamma 103.20434379 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd6Sn7Hg3 _chemical_formula_sum 'Nd6 Sn7 Hg3' _cell_volume 438.97967113 _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 0.63287234 0.63287234 0.25311955 1.0 Nd Nd1 1 0.36828643 0.36828643 0.74512226 1.0 Nd Nd2 1 0.20196465 0.80153309 0.49768271 1.0 Nd Nd3 1 0.20377550 0.79324633 0.00141001 1.0 Nd Nd4 1 0.80153309 0.20196465 0.49768271 1.0 Nd Nd5 1 0.79324633 0.20377550 0.00141001 1.0 Sn Sn6 1 0.02058706 0.02058706 0.24528016 1.0 Sn Sn7 1 0.98114863 0.98114863 0.75321517 1.0 Sn Sn8 1 0.68833456 0.68833456 0.55248745 1.0 Sn Sn9 1 0.48847562 0.07149892 0.24729331 1.0 Sn Sn10 1 0.93195845 0.50986738 0.75255280 1.0 Sn Sn11 1 0.50986738 0.93195845 0.75255280 1.0 Sn Sn12 1 0.07149892 0.48847562 0.24729331 1.0 Hg Hg13 1 0.31159155 0.31159155 0.03968952 1.0 Hg Hg14 1 0.68803780 0.68803780 0.96054943 1.0 Hg Hg15 1 0.30682271 0.30682271 0.45265778 1.0