# generated using pymatgen data_TmCrB6W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.32642153 _cell_length_b 8.85313646 _cell_length_c 11.14962553 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmCrB6W _chemical_formula_sum 'Tm4 Cr4 B24 W4' _cell_volume 328.34826340 _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 0.82243175 0.08558727 1.0 Tm Tm1 1 0.00000000 0.17756825 0.91441273 1.0 Tm Tm2 1 0.00000000 0.32243175 0.41441273 1.0 Tm Tm3 1 0.00000000 0.67756825 0.58558727 1.0 Cr Cr4 1 0.00000000 0.14465709 0.18415688 1.0 Cr Cr5 1 0.00000000 0.85534291 0.81584312 1.0 Cr Cr6 1 0.00000000 0.64465709 0.31584312 1.0 Cr Cr7 1 0.00000000 0.35534291 0.68415688 1.0 B B8 1 0.50000000 0.05464498 0.06679295 1.0 B B9 1 0.50000000 0.94535502 0.93320705 1.0 B B10 1 0.50000000 0.55464498 0.43320705 1.0 B B11 1 0.50000000 0.44535502 0.56679295 1.0 B B12 1 0.50000000 0.25538990 0.08146088 1.0 B B13 1 0.50000000 0.74461010 0.91853912 1.0 B B14 1 0.50000000 0.75538990 0.41853912 1.0 B B15 1 0.50000000 0.24461010 0.58146088 1.0 B B16 1 0.50000000 0.29930217 0.23684665 1.0 B B17 1 0.50000000 0.70069783 0.76315335 1.0 B B18 1 0.50000000 0.79930217 0.26315335 1.0 B B19 1 0.50000000 0.20069783 0.73684665 1.0 B B20 1 0.50000000 0.13046996 0.31930121 1.0 B B21 1 0.50000000 0.86953004 0.68069879 1.0 B B22 1 0.50000000 0.63046996 0.18069879 1.0 B B23 1 0.50000000 0.36953004 0.81930121 1.0 B B24 1 0.50000000 0.48163118 0.28625580 1.0 B B25 1 0.50000000 0.51836882 0.71374420 1.0 B B26 1 0.50000000 0.98163118 0.21374420 1.0 B B27 1 0.50000000 0.01836882 0.78625580 1.0 B B28 1 0.50000000 0.09986427 0.47394870 1.0 B B29 1 0.50000000 0.90013573 0.52605130 1.0 B B30 1 0.50000000 0.59986427 0.02605130 1.0 B B31 1 0.50000000 0.40013573 0.97394870 1.0 W W32 1 0.00000000 0.44567824 0.12686798 1.0 W W33 1 0.00000000 0.55432176 0.87313202 1.0 W W34 1 0.00000000 0.94567824 0.37313202 1.0 W W35 1 0.00000000 0.05432176 0.62686798 1.0