# generated using pymatgen data_Nd4Al18GaIr5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.60623571 _cell_length_b 7.60623665 _cell_length_c 9.54312694 _cell_angle_alpha 89.83893287 _cell_angle_beta 89.83893336 _cell_angle_gamma 119.21553508 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd4Al18GaIr5 _chemical_formula_sum 'Nd4 Al18 Ga1 Ir5' _cell_volume 481.87373535 _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 0.99539439 0.67924132 0.24837001 1.0 Nd Nd1 1 0.00460561 0.32075868 0.75162999 1.0 Nd Nd2 1 0.67924132 0.99539439 0.24837001 1.0 Nd Nd3 1 0.32075868 0.00460561 0.75162999 1.0 Al Al4 1 0.14326583 0.14326583 0.26249882 1.0 Al Al5 1 0.85673417 0.85673417 0.73750118 1.0 Al Al6 1 0.00633614 0.35061217 0.07810432 1.0 Al Al7 1 0.99366386 0.64938783 0.92189568 1.0 Al Al8 1 0.99906870 0.66322080 0.56811963 1.0 Al Al9 1 0.33677920 0.00093130 0.43188037 1.0 Al Al10 1 0.00093130 0.33677920 0.43188037 1.0 Al Al11 1 0.66322080 0.99906870 0.56811963 1.0 Al Al12 1 0.64938783 0.99366386 0.92189568 1.0 Al Al13 1 0.35061217 0.00633614 0.07810432 1.0 Al Al14 1 0.33390999 0.33390999 0.54348001 1.0 Al Al15 1 0.66609001 0.66609001 0.45651999 1.0 Al Al16 1 0.65117907 0.65117907 0.05873082 1.0 Al Al17 1 0.34882093 0.34882093 0.94126918 1.0 Al Al18 1 0.33953605 0.55061356 0.25284231 1.0 Al Al19 1 0.66046395 0.44938644 0.74715769 1.0 Al Al20 1 0.55061356 0.33953605 0.25284231 1.0 Al Al21 1 0.44938644 0.66046395 0.74715769 1.0 Ga Ga22 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir23 1 0.67123873 0.32876127 1.00000000 1.0 Ir Ir24 1 0.32876127 0.67123873 0.00000000 1.0 Ir Ir25 1 0.32884189 0.67115811 0.50000000 1.0 Ir Ir26 1 0.67115811 0.32884189 0.50000000 1.0 Ir Ir27 1 0.00000000 0.00000000 0.50000000 1.0