# generated using pymatgen data_TmNp3(ReB6)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.62819001 _cell_length_b 9.29333511 _cell_length_c 11.35392247 _cell_angle_alpha 89.89325143 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmNp3(ReB6)2 _chemical_formula_sum 'Tm2 Np6 Re4 B24' _cell_volume 382.83072985 _cell_formula_units_Z 2 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 Tm Tm0 1 0.00000000 0.33941446 0.40792878 1.0 Tm Tm1 1 0.00000000 0.66058554 0.59207122 1.0 Np Np2 1 0.00000000 0.83785412 0.09372755 1.0 Np Np3 1 0.00000000 0.16214588 0.90627245 1.0 Np Np4 1 0.00000000 0.95813463 0.39650077 1.0 Np Np5 1 0.00000000 0.04186537 0.60349923 1.0 Np Np6 1 0.00000000 0.45863168 0.10009580 1.0 Np Np7 1 0.00000000 0.54136832 0.89990420 1.0 Re Re8 1 0.00000000 0.64428724 0.31854949 1.0 Re Re9 1 0.00000000 0.35571276 0.68145051 1.0 Re Re10 1 0.00000000 0.14607033 0.18107897 1.0 Re Re11 1 0.00000000 0.85392967 0.81892103 1.0 B B12 1 0.50000000 0.55076476 0.43121559 1.0 B B13 1 0.50000000 0.44923524 0.56878441 1.0 B B14 1 0.50000000 0.05287799 0.07002131 1.0 B B15 1 0.50000000 0.94712201 0.92997869 1.0 B B16 1 0.50000000 0.74107894 0.42422064 1.0 B B17 1 0.50000000 0.25892106 0.57577936 1.0 B B18 1 0.50000000 0.24360748 0.07666549 1.0 B B19 1 0.50000000 0.75639252 0.92333451 1.0 B B20 1 0.50000000 0.80313056 0.27563077 1.0 B B21 1 0.50000000 0.19686944 0.72436923 1.0 B B22 1 0.50000000 0.30426845 0.22490213 1.0 B B23 1 0.50000000 0.69573155 0.77509787 1.0 B B24 1 0.50000000 0.64528666 0.18939096 1.0 B B25 1 0.50000000 0.35471334 0.81060904 1.0 B B26 1 0.50000000 0.14750389 0.31236228 1.0 B B27 1 0.50000000 0.85249611 0.68763772 1.0 B B28 1 0.50000000 0.99040821 0.22105127 1.0 B B29 1 0.50000000 0.00959179 0.77894873 1.0 B B30 1 0.50000000 0.48853133 0.28081387 1.0 B B31 1 0.50000000 0.51146867 0.71918613 1.0 B B32 1 0.50000000 0.64279768 0.03994788 1.0 B B33 1 0.50000000 0.35720232 0.96005212 1.0 B B34 1 0.50000000 0.14526543 0.46052247 1.0 B B35 1 0.50000000 0.85473457 0.53947753 1.0