data_[Tm8Re4C8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Re  1.9000  1.3500  0.7125
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [6.5154]
_cell_length_b [5.0266]
_cell_length_c [9.7392]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Tm2ReC2]
_chemical_formula_sum '[Tm8 Re4 C8]'
_cell_volume [318.9618]
_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
[
  Tm  Tm0  4  0.0345  0.7500  0.7170  1.0
  Tm  Tm1  4  0.1770  0.7500  0.0575  1.0
  Re  Re2  4  0.2169  0.7500  0.3690  1.0
  C  C3  4  0.0505  0.2500  0.7409  1.0
  C  C4  4  0.1736  0.2500  0.0536  1.0
]