# generated using pymatgen data_YNp(B2Ir3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.61942997 _cell_length_b 5.61942969 _cell_length_c 8.62860475 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000161 _symmetry_Int_Tables_number 1 _chemical_formula_structural YNp(B2Ir3)3 _chemical_formula_sum 'Y1 Np1 B6 Ir9' _cell_volume 235.96940935 _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 Y Y0 1 0.00000000 0.00000000 0.29411026 1.0 Np Np1 1 0.00000000 0.00000000 0.69453698 1.0 B B2 1 0.66666700 0.33333300 0.00168252 1.0 B B3 1 0.33333300 0.66666700 0.00168252 1.0 B B4 1 0.66666700 0.33333300 0.66792041 1.0 B B5 1 0.33333300 0.66666700 0.66792041 1.0 B B6 1 0.33333300 0.66666700 0.33255684 1.0 B B7 1 0.66666700 0.33333300 0.33255684 1.0 Ir Ir8 1 0.50000000 0.50000000 0.83739672 1.0 Ir Ir9 1 0.50000000 0.00000000 0.83739672 1.0 Ir Ir10 1 0.00000000 0.50000000 0.83739672 1.0 Ir Ir11 1 0.50000000 0.50000000 0.16444740 1.0 Ir Ir12 1 0.50000000 0.00000000 0.16444740 1.0 Ir Ir13 1 0.00000000 0.50000000 0.16444740 1.0 Ir Ir14 1 0.50000000 0.50000000 0.50049994 1.0 Ir Ir15 1 0.50000000 0.00000000 0.50049994 1.0 Ir Ir16 1 0.00000000 0.50000000 0.50049994 1.0