# generated using pymatgen data_Ce3Sm(TcB6)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.75530746 _cell_length_b 9.40428677 _cell_length_c 11.51913148 _cell_angle_alpha 89.92044927 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce3Sm(TcB6)2 _chemical_formula_sum 'Ce6 Sm2 Tc4 B24' _cell_volume 406.80912060 _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 Ce Ce0 1 0.00000000 0.83583625 0.09194587 1.0 Ce Ce1 1 0.00000000 0.16416375 0.90805413 1.0 Ce Ce2 1 0.00000000 0.95301212 0.38802349 1.0 Ce Ce3 1 0.00000000 0.04698788 0.61197651 1.0 Ce Ce4 1 0.00000000 0.45378517 0.11132420 1.0 Ce Ce5 1 0.00000000 0.54621483 0.88867580 1.0 Sm Sm6 1 0.00000000 0.33780177 0.40878457 1.0 Sm Sm7 1 0.00000000 0.66219823 0.59121543 1.0 Tc Tc8 1 0.00000000 0.64695427 0.31801717 1.0 Tc Tc9 1 0.00000000 0.35304573 0.68198283 1.0 Tc Tc10 1 0.00000000 0.14276973 0.17818914 1.0 Tc Tc11 1 0.00000000 0.85723027 0.82181086 1.0 B B12 1 0.50000000 0.55479354 0.43000875 1.0 B B13 1 0.50000000 0.44520646 0.56999125 1.0 B B14 1 0.50000000 0.05359482 0.07010698 1.0 B B15 1 0.50000000 0.94640518 0.92989302 1.0 B B16 1 0.50000000 0.74362115 0.42211689 1.0 B B17 1 0.50000000 0.25637885 0.57788311 1.0 B B18 1 0.50000000 0.24189947 0.07793169 1.0 B B19 1 0.50000000 0.75810053 0.92206831 1.0 B B20 1 0.50000000 0.79906115 0.27418646 1.0 B B21 1 0.50000000 0.20093885 0.72581354 1.0 B B22 1 0.50000000 0.29806422 0.22609448 1.0 B B23 1 0.50000000 0.70193578 0.77390552 1.0 B B24 1 0.50000000 0.64467988 0.18946815 1.0 B B25 1 0.50000000 0.35532012 0.81053185 1.0 B B26 1 0.50000000 0.14292433 0.31070790 1.0 B B27 1 0.50000000 0.85707567 0.68929210 1.0 B B28 1 0.50000000 0.99147720 0.21740312 1.0 B B29 1 0.50000000 0.00852280 0.78259688 1.0 B B30 1 0.50000000 0.49247132 0.28237923 1.0 B B31 1 0.50000000 0.50752868 0.71762077 1.0 B B32 1 0.50000000 0.64632446 0.04035971 1.0 B B33 1 0.50000000 0.35367554 0.95964029 1.0 B B34 1 0.50000000 0.14129562 0.46041896 1.0 B B35 1 0.50000000 0.85870438 0.53958104 1.0