data_[Th4Ga2Ni2C2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Ga  1.8100  1.3000  0.7600
  Ni  1.9100  1.3500  0.7400
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.5259]
_cell_length_b [3.8810]
_cell_length_c [8.4787]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.4112]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Th2GaNiC]
_chemical_formula_sum '[Th4 Ga2 Ni2 C2]'
_cell_volume [205.9935]
_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
[
  Th  Th0  2  0.2144  0.7500  0.3798  1
  Th  Th1  2  0.2199  0.7500  0.9571  1
  Ga  Ga2  2  0.3008  0.2500  0.6802  1
  Ni  Ni3  2  0.4680  0.2500  0.2408  1
  C  C4  2  0.1631  0.2500  0.1577  1
]