data_[Y6Er4Sc2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Er  1.2400  1.7500  1.0300
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.1307]
_cell_length_b [7.0876]
_cell_length_c [8.6615]
_cell_angle_alpha [78.1879]
_cell_angle_beta [83.1435]
_cell_angle_gamma [89.9833]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Y3Er2Sc]
_chemical_formula_sum '[Y6 Er4 Sc2]'
_cell_volume [365.6465]
_cell_formula_units_Z [2]
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  2  0.1343  0.4596  0.6712  1
  Y  Y1  2  0.1450  0.9575  0.6654  1
  Y  Y2  2  0.2505  0.1280  0.0028  1
  Er  Er3  2  0.3593  0.7886  0.3315  1
  Er  Er4  2  0.3660  0.2967  0.3296  1
  Sc  Sc5  2  0.2525  0.6226  0.0004  1
]