data_[Tb4Mn6B10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Mn  1.5500  1.4000  0.6483
  B  2.0400  0.8500  0.4100
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [9.9748]
_cell_length_b [3.8426]
_cell_length_c [7.8687]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.6572]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [Tb2Mn3B5]
_chemical_formula_sum '[Tb4 Mn6 B10]'
_cell_volume [245.0569]
_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
[
  Tb  Tb0  4  0.1715  0.2161  0.7634  1.0
  Mn  Mn1  4  0.1351  0.7425  0.4045  1.0
  Mn  Mn2  2  0.0000  0.0207  0.0000  1.0
  B  B3  4  0.0152  0.5198  0.1159  1.0
  B  B4  4  0.1427  0.2333  0.3088  1.0
  B  B5  2  0.0000  0.7232  0.5000  1.0
]