# generated using pymatgen data_Np(FeB3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.33875157 _cell_length_b 5.33875076 _cell_length_c 5.33875092 _cell_angle_alpha 145.88352714 _cell_angle_beta 110.25169148 _cell_angle_gamma 79.97697628 _symmetry_Int_Tables_number 1 _chemical_formula_structural Np(FeB3)2 _chemical_formula_sum 'Np1 Fe2 B6' _cell_volume 78.21833082 _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 0.50000000 0.00000000 0.50000000 1.0 Fe Fe1 1 0.84655479 0.84655479 0.00000000 1.0 Fe Fe2 1 0.15344521 0.15344521 1.00000000 1.0 B B3 1 0.85597796 0.50000000 0.35597796 1.0 B B4 1 0.14402204 0.50000000 0.64402204 1.0 B B5 1 0.95864295 0.69644295 0.26220000 1.0 B B6 1 0.04135705 0.30355705 0.73780000 1.0 B B7 1 0.56575705 0.30355705 0.26220000 1.0 B B8 1 0.43424295 0.69644295 0.73780000 1.0