data_[Co2Sn2B2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Sn  1.9600  1.4500  0.8300
  B  2.0400  0.8500  0.4100
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.2587]
_cell_length_b [3.0950]
_cell_length_c [5.4019]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.6764]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CoSnB]
_chemical_formula_sum '[Co2 Sn2 B2]'
_cell_volume [83.2901]
_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
[
  Co  Co0  2  0.1771  0.7500  0.9028  1
  Sn  Sn1  2  0.2234  0.7500  0.4070  1
  B  B2  2  0.4237  0.2500  0.9712  1
]