data_[Co24B4P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  B  2.0400  0.8500  0.4100
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [12.0340]
_cell_length_b [4.2512]
_cell_length_c [8.3810]
_cell_angle_alpha [90.0000]
_cell_angle_beta [131.9548]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [Co6BP]
_chemical_formula_sum '[Co24 B4 P4]'
_cell_volume [318.8616]
_cell_formula_units_Z [4]
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
[
  Co  Co0  4  0.0305  0.0015  0.3868  1.0
  Co  Co1  4  0.0732  0.7500  0.9566  1.0
  Co  Co2  4  0.0995  0.2302  0.1896  1.0
  Co  Co3  4  0.1345  0.5316  0.6512  1.0
  Co  Co4  4  0.1706  0.2471  0.9508  1.0
  Co  Co5  4  0.2131  0.7273  0.4072  1.0
  B  B6  4  0.0301  0.4912  0.3237  1.0
  P  P7  4  0.2127  0.0211  0.7502  1.0
]