# generated using pymatgen data_CaEr7(B6Os)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.62518987 _cell_length_b 9.09613909 _cell_length_c 11.47920845 _cell_angle_alpha 89.89451461 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaEr7(B6Os)4 _chemical_formula_sum 'Ca1 Er7 B24 Os4' _cell_volume 378.52891202 _cell_formula_units_Z 1 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 Ca Ca0 1 0.00000000 0.32199648 0.41362325 1.0 Er Er1 1 0.00000000 0.67629375 0.58497339 1.0 Er Er2 1 0.00000000 0.82144937 0.08609984 1.0 Er Er3 1 0.00000000 0.17921301 0.91478080 1.0 Er Er4 1 0.00000000 0.94378888 0.37126642 1.0 Er Er5 1 0.00000000 0.05790309 0.62803530 1.0 Er Er6 1 0.00000000 0.44320954 0.12834678 1.0 Er Er7 1 0.00000000 0.55603970 0.87346975 1.0 B B8 1 0.50000000 0.55462676 0.43294218 1.0 B B9 1 0.50000000 0.44663826 0.56793922 1.0 B B10 1 0.50000000 0.05267998 0.06591372 1.0 B B11 1 0.50000000 0.94625526 0.93266672 1.0 B B12 1 0.50000000 0.74853240 0.41944345 1.0 B B13 1 0.50000000 0.25250854 0.58185468 1.0 B B14 1 0.50000000 0.24736747 0.07990295 1.0 B B15 1 0.50000000 0.75200647 0.91984739 1.0 B B16 1 0.50000000 0.79153498 0.26572662 1.0 B B17 1 0.50000000 0.20964229 0.73472733 1.0 B B18 1 0.50000000 0.28950064 0.23279078 1.0 B B19 1 0.50000000 0.70928443 0.76635101 1.0 B B20 1 0.50000000 0.63184435 0.18542752 1.0 B B21 1 0.50000000 0.36895484 0.81572311 1.0 B B22 1 0.50000000 0.12992848 0.31317466 1.0 B B23 1 0.50000000 0.86902843 0.68522728 1.0 B B24 1 0.50000000 0.98181374 0.21155829 1.0 B B25 1 0.50000000 0.01761122 0.78724150 1.0 B B26 1 0.50000000 0.48381681 0.28713423 1.0 B B27 1 0.50000000 0.51753826 0.71334496 1.0 B B28 1 0.50000000 0.60849270 0.03031492 1.0 B B29 1 0.50000000 0.39182480 0.97049147 1.0 B B30 1 0.50000000 0.10238137 0.47140060 1.0 B B31 1 0.50000000 0.89553826 0.52900768 1.0 Os Os32 1 0.00000000 0.64008100 0.32030089 1.0 Os Os33 1 0.00000000 0.36254730 0.68122440 1.0 Os Os34 1 0.00000000 0.13534536 0.17678319 1.0 Os Os35 1 0.00000000 0.86278178 0.82094473 1.0