# generated using pymatgen data_YTaReB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.55178143 _cell_length_b 8.91276888 _cell_length_c 11.26920088 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YTaReB6 _chemical_formula_sum 'Y4 Ta4 Re4 B24' _cell_volume 356.74015539 _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 Y Y0 1 0.00000000 0.32315901 0.41401778 1.0 Y Y1 1 0.00000000 0.67684099 0.58598222 1.0 Y Y2 1 0.00000000 0.82315901 0.08598222 1.0 Y Y3 1 0.00000000 0.17684099 0.91401778 1.0 Ta Ta4 1 0.00000000 0.94634053 0.37581995 1.0 Ta Ta5 1 0.00000000 0.05365947 0.62418005 1.0 Ta Ta6 1 0.00000000 0.44634053 0.12418005 1.0 Ta Ta7 1 0.00000000 0.55365947 0.87581995 1.0 Re Re8 1 0.00000000 0.64491955 0.31665092 1.0 Re Re9 1 0.00000000 0.35508045 0.68334908 1.0 Re Re10 1 0.00000000 0.14491955 0.18334908 1.0 Re Re11 1 0.00000000 0.85508045 0.81665092 1.0 B B12 1 0.50000000 0.55535767 0.43326416 1.0 B B13 1 0.50000000 0.44464233 0.56673584 1.0 B B14 1 0.50000000 0.05535767 0.06673584 1.0 B B15 1 0.50000000 0.94464233 0.93326416 1.0 B B16 1 0.50000000 0.75520311 0.41799928 1.0 B B17 1 0.50000000 0.24479689 0.58200072 1.0 B B18 1 0.50000000 0.25520311 0.08200072 1.0 B B19 1 0.50000000 0.74479689 0.91799928 1.0 B B20 1 0.50000000 0.79811522 0.26293402 1.0 B B21 1 0.50000000 0.20188478 0.73706598 1.0 B B22 1 0.50000000 0.29811522 0.23706598 1.0 B B23 1 0.50000000 0.70188478 0.76293402 1.0 B B24 1 0.50000000 0.62990616 0.18119096 1.0 B B25 1 0.50000000 0.37009384 0.81880904 1.0 B B26 1 0.50000000 0.12990616 0.31880904 1.0 B B27 1 0.50000000 0.87009384 0.68119096 1.0 B B28 1 0.50000000 0.98232146 0.21362312 1.0 B B29 1 0.50000000 0.01767854 0.78637688 1.0 B B30 1 0.50000000 0.48232146 0.28637688 1.0 B B31 1 0.50000000 0.51767854 0.71362312 1.0 B B32 1 0.50000000 0.59914257 0.02630129 1.0 B B33 1 0.50000000 0.40085743 0.97369871 1.0 B B34 1 0.50000000 0.09914257 0.47369871 1.0 B B35 1 0.50000000 0.90085743 0.52630129 1.0