data_[Er6Zn48Os3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Zn  1.6500  1.3500  0.8800
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [8.9506]
_cell_length_b [8.9506]
_cell_length_c [13.0855]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Er2Zn16Os]
_chemical_formula_sum '[Er6 Zn48 Os3]'
_cell_volume [907.8673]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.3391  1
  Er  Er1  3  0.0000  0.0000  0.6793  1
  Zn  Zn2  18  0.0455  0.3783  0.6642  1
  Zn  Zn3  9  0.0019  0.5009  0.1468  1
  Zn  Zn4  9  0.0061  0.5031  0.4990  1
  Zn  Zn5  9  0.1745  0.3489  0.1847  1
  Zn  Zn6  3  0.0000  0.0000  0.1034  1
  Os  Os7  3  0.0000  0.0000  0.9014  1
]