data_[Y6Mn48Cr3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Mn  1.5500  1.4000  0.6483
  Cr  1.6600  1.4000  0.9400
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [8.4988]
_cell_length_b [8.4988]
_cell_length_c [12.0166]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Y2Mn16Cr]
_chemical_formula_sum '[Y6 Mn48 Cr3]'
_cell_volume [751.6690]
_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
[
  Y  Y0  3  0.0000  0.0000  0.3453  1
  Y  Y1  3  0.0000  0.0000  0.6562  1
  Mn  Mn2  18  0.0003  0.2737  0.9996  1
  Mn  Mn3  9  0.1668  0.3335  0.1861  1
  Mn  Mn4  9  0.1670  0.3340  0.8325  1
  Mn  Mn5  9  0.1672  0.3344  0.4820  1
  Mn  Mn6  3  0.0000  0.0000  0.9019  1
  Cr  Cr7  3  0.0000  0.0000  0.0973  1
]