# generated using pymatgen data_Nd3In5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.56556897 _cell_length_b 6.56557044 _cell_length_c 10.53012007 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 101.56476187 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3In5 _chemical_formula_sum 'Nd6 In10' _cell_volume 444.70365798 _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 0.63308146 0.63308146 0.25000000 1.0 Nd Nd1 1 0.36691854 0.36691854 0.75000000 1.0 Nd Nd2 1 0.79761686 0.20238214 0.50000000 1.0 Nd Nd3 1 0.79761686 0.20238314 -0.00000000 1.0 Nd Nd4 1 0.20238314 0.79761686 0.50000000 1.0 Nd Nd5 1 0.20238314 0.79761786 -0.00000000 1.0 In In6 1 0.01361568 0.01361668 0.25000000 1.0 In In7 1 0.98638432 0.98638332 0.75000000 1.0 In In8 1 0.30976709 0.30976709 0.05019227 1.0 In In9 1 0.69023291 0.69023291 0.94980773 1.0 In In10 1 0.30976709 0.30976709 0.44980773 1.0 In In11 1 0.69023291 0.69023291 0.55019227 1.0 In In12 1 0.07971646 0.50218165 0.25000000 1.0 In In13 1 0.49781835 0.92028354 0.75000000 1.0 In In14 1 0.92028354 0.49781835 0.75000000 1.0 In In15 1 0.50218165 0.07971646 0.25000000 1.0