# generated using pymatgen data_CeNpReB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.68797144 _cell_length_b 9.35913220 _cell_length_c 11.45049202 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CeNpReB6 _chemical_formula_sum 'Ce4 Np4 Re4 B24' _cell_volume 395.22761311 _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 Ce Ce0 1 0.00000000 0.33745209 0.40743122 1.0 Ce Ce1 1 0.00000000 0.66254791 0.59256878 1.0 Ce Ce2 1 0.00000000 0.83745209 0.09256878 1.0 Ce Ce3 1 0.00000000 0.16254791 0.90743122 1.0 Np Np4 1 0.00000000 0.95865299 0.39499104 1.0 Np Np5 1 0.00000000 0.04134701 0.60500896 1.0 Np Np6 1 0.00000000 0.45865299 0.10500896 1.0 Np Np7 1 0.00000000 0.54134701 0.89499104 1.0 Re Re8 1 0.00000000 0.64681401 0.31844692 1.0 Re Re9 1 0.00000000 0.35318599 0.68155308 1.0 Re Re10 1 0.00000000 0.14681401 0.18155308 1.0 Re Re11 1 0.00000000 0.85318599 0.81844692 1.0 B B12 1 0.50000000 0.55422151 0.42878127 1.0 B B13 1 0.50000000 0.44577849 0.57121873 1.0 B B14 1 0.50000000 0.05422151 0.07121873 1.0 B B15 1 0.50000000 0.94577849 0.92878127 1.0 B B16 1 0.50000000 0.74432695 0.42235876 1.0 B B17 1 0.50000000 0.25567305 0.57764124 1.0 B B18 1 0.50000000 0.24432695 0.07764124 1.0 B B19 1 0.50000000 0.75567305 0.92235876 1.0 B B20 1 0.50000000 0.80299891 0.27474570 1.0 B B21 1 0.50000000 0.19700109 0.72525430 1.0 B B22 1 0.50000000 0.30299891 0.22525430 1.0 B B23 1 0.50000000 0.69700109 0.77474570 1.0 B B24 1 0.50000000 0.64618158 0.18856944 1.0 B B25 1 0.50000000 0.35381842 0.81143056 1.0 B B26 1 0.50000000 0.14618158 0.31143056 1.0 B B27 1 0.50000000 0.85381842 0.68856944 1.0 B B28 1 0.50000000 0.99054720 0.21966087 1.0 B B29 1 0.50000000 0.00945280 0.78033913 1.0 B B30 1 0.50000000 0.49054720 0.28033913 1.0 B B31 1 0.50000000 0.50945280 0.71966087 1.0 B B32 1 0.50000000 0.64268900 0.03947338 1.0 B B33 1 0.50000000 0.35731100 0.96052662 1.0 B B34 1 0.50000000 0.14268900 0.46052662 1.0 B B35 1 0.50000000 0.85731100 0.53947338 1.0