# generated using pymatgen data_NpPaReB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.67749845 _cell_length_b 9.32936276 _cell_length_c 11.40994686 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NpPaReB6 _chemical_formula_sum 'Np4 Pa4 Re4 B24' _cell_volume 391.46063885 _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 Np Np0 1 0.00000000 0.95874085 0.39294766 1.0 Np Np1 1 0.00000000 0.04125915 0.60705234 1.0 Np Np2 1 0.00000000 0.45874085 0.10705234 1.0 Np Np3 1 0.00000000 0.54125915 0.89294766 1.0 Pa Pa4 1 0.00000000 0.33536892 0.40697044 1.0 Pa Pa5 1 0.00000000 0.66463108 0.59302956 1.0 Pa Pa6 1 0.00000000 0.83536892 0.09302956 1.0 Pa Pa7 1 0.00000000 0.16463108 0.90697044 1.0 Re Re8 1 0.00000000 0.64582331 0.32019251 1.0 Re Re9 1 0.00000000 0.35417669 0.67980749 1.0 Re Re10 1 0.00000000 0.14582331 0.17980749 1.0 Re Re11 1 0.00000000 0.85417669 0.82019251 1.0 B B12 1 0.50000000 0.55087108 0.43120026 1.0 B B13 1 0.50000000 0.44912892 0.56879974 1.0 B B14 1 0.50000000 0.05087108 0.06879974 1.0 B B15 1 0.50000000 0.94912892 0.93120026 1.0 B B16 1 0.50000000 0.74330710 0.42350483 1.0 B B17 1 0.50000000 0.25669290 0.57649517 1.0 B B18 1 0.50000000 0.24330710 0.07649517 1.0 B B19 1 0.50000000 0.75669290 0.92350483 1.0 B B20 1 0.50000000 0.80362941 0.27471808 1.0 B B21 1 0.50000000 0.19637059 0.72528192 1.0 B B22 1 0.50000000 0.30362941 0.22528192 1.0 B B23 1 0.50000000 0.69637059 0.77471808 1.0 B B24 1 0.50000000 0.64654057 0.18895465 1.0 B B25 1 0.50000000 0.35345943 0.81104535 1.0 B B26 1 0.50000000 0.14654057 0.31104535 1.0 B B27 1 0.50000000 0.85345943 0.68895465 1.0 B B28 1 0.50000000 0.98811993 0.21916506 1.0 B B29 1 0.50000000 0.01188007 0.78083494 1.0 B B30 1 0.50000000 0.48811993 0.28083494 1.0 B B31 1 0.50000000 0.51188007 0.71916506 1.0 B B32 1 0.50000000 0.64505043 0.04043385 1.0 B B33 1 0.50000000 0.35494957 0.95956615 1.0 B B34 1 0.50000000 0.14505043 0.45956615 1.0 B B35 1 0.50000000 0.85494957 0.54043385 1.0