data_[Tm4Si2Mo4C4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Si  1.9000  1.1000  0.5400
  Mo  2.1600  1.4500  0.7750
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.1254]
_cell_length_b [3.2408]
_cell_length_c [5.6393]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.4016]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tm2Si(MoC)2]
_chemical_formula_sum '[Tm4 Si2 Mo4 C4]'
_cell_volume [236.6555]
_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  4  0.1361  0.5000  0.3777  1
  Si  Si1  2  0.0000  0.0000  0.0000  1
  Mo  Mo2  4  0.1682  0.0000  0.8848  1
  C  C3  4  0.2471  0.5000  0.7618  1
]