data_[Ca2Nd12Sm6Ho4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Nd  1.1400  1.8500  1.2765
  Sm  1.1700  1.8500  1.2290
  Ho  1.2300  1.7500  1.0410
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.3705]
_cell_length_b [11.0123]
_cell_length_c [11.9330]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.1678]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CaNd6Sm3Ho2]
_chemical_formula_sum '[Ca2 Nd12 Sm6 Ho4]'
_cell_volume [824.0019]
_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
[
  Ca  Ca0  2  0.0000  0.0000  0.0000  1.0
  Nd  Nd1  8  0.2453  0.3294  0.7500  1.0
  Nd  Nd2  4  0.2430  0.5000  0.2509  1.0
  Sm  Sm3  4  0.0000  0.1663  0.5000  1.0
  Sm  Sm4  2  0.0000  0.5000  0.5000  1.0
  Ho  Ho5  4  0.0000  0.3335  0.0000  1.0
]