# generated using pymatgen data_ErScCoB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.43822691 _cell_length_b 8.89844534 _cell_length_c 11.24968864 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErScCoB6 _chemical_formula_sum 'Er4 Sc4 Co4 B24' _cell_volume 344.18280961 _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 0.82301698 0.08526828 1.0 Er Er1 1 0.00000000 0.17698302 0.91473172 1.0 Er Er2 1 0.00000000 0.32301698 0.41473172 1.0 Er Er3 1 0.00000000 0.67698302 0.58526828 1.0 Sc Sc4 1 0.00000000 0.44426358 0.12915040 1.0 Sc Sc5 1 0.00000000 0.55573642 0.87084960 1.0 Sc Sc6 1 0.00000000 0.94426358 0.37084960 1.0 Sc Sc7 1 0.00000000 0.05573642 0.62915040 1.0 Co Co8 1 0.00000000 0.14197396 0.18194107 1.0 Co Co9 1 0.00000000 0.85802604 0.81805893 1.0 Co Co10 1 0.00000000 0.64197396 0.31805893 1.0 Co Co11 1 0.00000000 0.35802604 0.68194107 1.0 B B12 1 0.50000000 0.05454809 0.06755327 1.0 B B13 1 0.50000000 0.94545191 0.93244673 1.0 B B14 1 0.50000000 0.55454809 0.43244673 1.0 B B15 1 0.50000000 0.44545191 0.56755327 1.0 B B16 1 0.50000000 0.25093102 0.08264929 1.0 B B17 1 0.50000000 0.74906898 0.91735071 1.0 B B18 1 0.50000000 0.75093102 0.41735071 1.0 B B19 1 0.50000000 0.24906898 0.58264929 1.0 B B20 1 0.50000000 0.29419856 0.23584340 1.0 B B21 1 0.50000000 0.70580144 0.76415660 1.0 B B22 1 0.50000000 0.79419856 0.26415660 1.0 B B23 1 0.50000000 0.20580144 0.73584340 1.0 B B24 1 0.50000000 0.13173552 0.31695754 1.0 B B25 1 0.50000000 0.86826448 0.68304246 1.0 B B26 1 0.50000000 0.63173552 0.18304246 1.0 B B27 1 0.50000000 0.36826448 0.81695754 1.0 B B28 1 0.50000000 0.48470189 0.28700433 1.0 B B29 1 0.50000000 0.51529811 0.71299567 1.0 B B30 1 0.50000000 0.98470189 0.21299567 1.0 B B31 1 0.50000000 0.01529811 0.78700433 1.0 B B32 1 0.50000000 0.10031458 0.47311822 1.0 B B33 1 0.50000000 0.89968542 0.52688178 1.0 B B34 1 0.50000000 0.60031458 0.02688178 1.0 B B35 1 0.50000000 0.39968542 0.97311822 1.0