# generated using pymatgen data_HfNpCrB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.48718280 _cell_length_b 8.98685717 _cell_length_c 11.36194319 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfNpCrB6 _chemical_formula_sum 'Hf4 Np4 Cr4 B24' _cell_volume 356.06982159 _cell_formula_units_Z 4 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 Hf Hf0 1 0.00000000 0.44393390 0.12865297 1.0 Hf Hf1 1 0.00000000 0.55606610 0.87134703 1.0 Hf Hf2 1 0.00000000 0.94393390 0.37134703 1.0 Hf Hf3 1 0.00000000 0.05606610 0.62865297 1.0 Np Np4 1 0.00000000 0.82291066 0.08526272 1.0 Np Np5 1 0.00000000 0.17708934 0.91473728 1.0 Np Np6 1 0.00000000 0.32291066 0.41473728 1.0 Np Np7 1 0.00000000 0.67708934 0.58526272 1.0 Cr Cr8 1 0.00000000 0.14178678 0.18185782 1.0 Cr Cr9 1 0.00000000 0.85821322 0.81814218 1.0 Cr Cr10 1 0.00000000 0.64178678 0.31814218 1.0 Cr Cr11 1 0.00000000 0.35821322 0.68185782 1.0 B B12 1 0.50000000 0.05396547 0.06846640 1.0 B B13 1 0.50000000 0.94603453 0.93153360 1.0 B B14 1 0.50000000 0.55396547 0.43153360 1.0 B B15 1 0.50000000 0.44603453 0.56846640 1.0 B B16 1 0.50000000 0.25174990 0.08184155 1.0 B B17 1 0.50000000 0.74825010 0.91815845 1.0 B B18 1 0.50000000 0.75174990 0.41815845 1.0 B B19 1 0.50000000 0.24825010 0.58184155 1.0 B B20 1 0.50000000 0.29459390 0.23435336 1.0 B B21 1 0.50000000 0.70540610 0.76564664 1.0 B B22 1 0.50000000 0.79459390 0.26564664 1.0 B B23 1 0.50000000 0.20540610 0.73435336 1.0 B B24 1 0.50000000 0.13108724 0.31659106 1.0 B B25 1 0.50000000 0.86891276 0.68340894 1.0 B B26 1 0.50000000 0.63108724 0.18340894 1.0 B B27 1 0.50000000 0.36891276 0.81659106 1.0 B B28 1 0.50000000 0.48232618 0.28586627 1.0 B B29 1 0.50000000 0.51767382 0.71413373 1.0 B B30 1 0.50000000 0.98232618 0.21413373 1.0 B B31 1 0.50000000 0.01767382 0.78586627 1.0 B B32 1 0.50000000 0.09924101 0.47307311 1.0 B B33 1 0.50000000 0.90075899 0.52692689 1.0 B B34 1 0.50000000 0.59924101 0.02692689 1.0 B B35 1 0.50000000 0.40075899 0.97307311 1.0