data_[Tm2Mo2C6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Mo  2.1600  1.4500  0.7750
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.8962]
_cell_length_b [3.1914]
_cell_length_c [5.9411]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.1869]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [TmMoC3]
_chemical_formula_sum '[Tm2 Mo2 C6]'
_cell_volume [110.3604]
_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
[
  Tm  Tm0  2  0.1060  0.2500  0.7553  1
  Mo  Mo1  2  0.3853  0.2500  0.3072  1
  C  C2  2  0.2215  0.7500  0.0675  1
  C  C3  2  0.2702  0.7500  0.5089  1
  C  C4  2  0.4391  0.7500  0.0003  1
]