data_[Y6Co18P12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Co  1.8800  1.3500  0.7683
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.8743]
_cell_length_b [3.6554]
_cell_length_c [9.1000]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0094]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [YCo3P2]
_chemical_formula_sum '[Y6 Co18 P12]'
_cell_volume [473.1366]
_cell_formula_units_Z [6]
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  4  0.1553  0.0000  0.6985  1
  Y  Y1  2  0.0000  0.0000  0.0000  1
  Co  Co2  4  0.0468  0.0000  0.3363  1
  Co  Co3  4  0.1269  0.5000  0.2116  1
  Co  Co4  4  0.1777  0.5000  0.9666  1
  Co  Co5  4  0.2177  0.0000  0.3946  1
  Co  Co6  2  0.0000  0.5000  0.5000  1
  P  P7  4  0.0331  0.5000  0.7767  1
  P  P8  4  0.1401  0.5000  0.4543  1
  P  P9  4  0.1982  0.0000  0.1316  1
]