# generated using pymatgen data_Tm2ReB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.63528400 _cell_length_b 9.10042200 _cell_length_c 11.46922200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm2ReB6 _chemical_formula_sum 'Tm8 Re4 B24' _cell_volume 379.43189580 _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 Tm Tm0 1 0.00000000 0.32393200 0.41384700 1.0 Tm Tm1 1 0.00000000 0.67606800 0.58615300 1.0 Tm Tm2 1 0.00000000 0.82393200 0.08615300 1.0 Tm Tm3 1 0.00000000 0.17606800 0.91384700 1.0 Tm Tm4 1 0.00000000 0.94383700 0.37025300 1.0 Tm Tm5 1 0.00000000 0.05616300 0.62974700 1.0 Tm Tm6 1 0.00000000 0.44383700 0.12974700 1.0 Tm Tm7 1 0.00000000 0.55616300 0.87025300 1.0 Re Re8 1 0.00000000 0.63894300 0.32087300 1.0 Re Re9 1 0.00000000 0.36105700 0.67912700 1.0 Re Re10 1 0.00000000 0.13894300 0.17912700 1.0 Re Re11 1 0.00000000 0.86105700 0.82087300 1.0 B B12 1 0.50000000 0.55337700 0.43332900 1.0 B B13 1 0.50000000 0.44662300 0.56667100 1.0 B B14 1 0.50000000 0.05337700 0.06667100 1.0 B B15 1 0.50000000 0.94662300 0.93332900 1.0 B B16 1 0.50000000 0.75065700 0.41986100 1.0 B B17 1 0.50000000 0.24934300 0.58013900 1.0 B B18 1 0.50000000 0.25065700 0.08013900 1.0 B B19 1 0.50000000 0.74934300 0.91986100 1.0 B B20 1 0.50000000 0.79348200 0.26558300 1.0 B B21 1 0.50000000 0.20651800 0.73441700 1.0 B B22 1 0.50000000 0.29348200 0.23441700 1.0 B B23 1 0.50000000 0.70651800 0.76558300 1.0 B B24 1 0.50000000 0.63156700 0.18515400 1.0 B B25 1 0.50000000 0.36843300 0.81484600 1.0 B B26 1 0.50000000 0.13156700 0.31484600 1.0 B B27 1 0.50000000 0.86843300 0.68515400 1.0 B B28 1 0.50000000 0.98220800 0.21228900 1.0 B B29 1 0.50000000 0.01779200 0.78771100 1.0 B B30 1 0.50000000 0.48220800 0.28771100 1.0 B B31 1 0.50000000 0.51779200 0.71228900 1.0 B B32 1 0.50000000 0.59984200 0.02789400 1.0 B B33 1 0.50000000 0.40015800 0.97210600 1.0 B B34 1 0.50000000 0.09984200 0.47210600 1.0 B B35 1 0.50000000 0.90015800 0.52789400 1.0