# generated using pymatgen data_Np2(B2Ir)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.74288008 _cell_length_b 5.96102860 _cell_length_c 5.96102838 _cell_angle_alpha 94.29693520 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Np2(B2Ir)3 _chemical_formula_sum 'Np2 B6 Ir3' _cell_volume 132.62513785 _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 Np Np0 1 0.00000000 0.27099014 0.72900986 1.0 Np Np1 1 0.00000000 0.72900986 0.27099014 1.0 B B2 1 0.50000000 0.91315342 0.61365611 1.0 B B3 1 0.50000000 0.08684658 0.38634389 1.0 B B4 1 0.50000000 0.61365611 0.91315342 1.0 B B5 1 0.50000000 0.38634389 0.08684658 1.0 B B6 1 0.50000000 0.60679201 0.60679201 1.0 B B7 1 0.50000000 0.39320799 0.39320799 1.0 Ir Ir8 1 0.50000000 0.00000000 0.00000000 1.0 Ir Ir9 1 0.00000000 0.76355331 0.76355331 1.0 Ir Ir10 1 0.00000000 0.23644669 0.23644669 1.0