# generated using pymatgen data_Nd3Sc3ReSb2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.99476349 _cell_length_b 7.99476303 _cell_length_c 4.33726426 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000606 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3Sc3ReSb2 _chemical_formula_sum 'Nd3 Sc3 Re1 Sb2' _cell_volume 240.08095235 _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 0.60046149 1.00000000 0.50000000 1.0 Nd Nd1 1 0.39953851 0.39953851 0.50000000 1.0 Nd Nd2 1 1.00000000 0.60046149 0.50000000 1.0 Sc Sc3 1 0.22145569 0.00000000 0.00000000 1.0 Sc Sc4 1 0.77854431 0.77854431 0.00000000 1.0 Sc Sc5 1 0.00000000 0.22145569 0.00000000 1.0 Re Re6 1 0.00000000 0.00000000 0.50000000 1.0 Sb Sb7 1 0.33333300 0.66666700 0.00000000 1.0 Sb Sb8 1 0.66666700 0.33333300 0.00000000 1.0