# generated using pymatgen data_ErPaReB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.70136685 _cell_length_b 9.13191424 _cell_length_c 11.47272899 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErPaReB6 _chemical_formula_sum 'Er4 Pa4 Re4 B24' _cell_volume 387.78471812 _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 Er Er0 1 0.00000000 0.94500808 0.37469177 1.0 Er Er1 1 0.00000000 0.05499192 0.62530823 1.0 Er Er2 1 0.00000000 0.44500808 0.12530823 1.0 Er Er3 1 0.00000000 0.55499192 0.87469177 1.0 Pa Pa4 1 0.00000000 0.32289676 0.41332393 1.0 Pa Pa5 1 0.00000000 0.67710324 0.58667607 1.0 Pa Pa6 1 0.00000000 0.82289676 0.08667607 1.0 Pa Pa7 1 0.00000000 0.17710324 0.91332393 1.0 Re Re8 1 0.00000000 0.63861233 0.32154738 1.0 Re Re9 1 0.00000000 0.36138767 0.67845262 1.0 Re Re10 1 0.00000000 0.13861233 0.17845262 1.0 Re Re11 1 0.00000000 0.86138767 0.82154738 1.0 B B12 1 0.50000000 0.55325346 0.43318686 1.0 B B13 1 0.50000000 0.44674654 0.56681314 1.0 B B14 1 0.50000000 0.05325346 0.06681314 1.0 B B15 1 0.50000000 0.94674654 0.93318686 1.0 B B16 1 0.50000000 0.74856433 0.41983741 1.0 B B17 1 0.50000000 0.25143567 0.58016259 1.0 B B18 1 0.50000000 0.24856433 0.08016259 1.0 B B19 1 0.50000000 0.75143567 0.91983741 1.0 B B20 1 0.50000000 0.79350723 0.26623710 1.0 B B21 1 0.50000000 0.20649277 0.73376290 1.0 B B22 1 0.50000000 0.29350723 0.23376290 1.0 B B23 1 0.50000000 0.70649277 0.76623710 1.0 B B24 1 0.50000000 0.63318190 0.18518171 1.0 B B25 1 0.50000000 0.36681810 0.81481829 1.0 B B26 1 0.50000000 0.13318190 0.31481829 1.0 B B27 1 0.50000000 0.86681810 0.68518171 1.0 B B28 1 0.50000000 0.98281035 0.21396636 1.0 B B29 1 0.50000000 0.01718965 0.78603364 1.0 B B30 1 0.50000000 0.48281035 0.28603364 1.0 B B31 1 0.50000000 0.51718965 0.71396636 1.0 B B32 1 0.50000000 0.61110301 0.03082318 1.0 B B33 1 0.50000000 0.38889699 0.96917682 1.0 B B34 1 0.50000000 0.11110301 0.46917682 1.0 B B35 1 0.50000000 0.88889699 0.53082318 1.0