# generated using pymatgen
data_Tb2ThBC3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.73790692
_cell_length_b   3.73790676
_cell_length_c   16.15464692
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.37978230
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb2ThBC3
_chemical_formula_sum   'Tb4 Th2 B2 C6'
_cell_volume   225.70692060
_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  1  0.58595559  0.41404241  0.09940438  1.0
  Tb  Tb1  1  0.58595559  0.41404241  0.40059562  1.0
  Tb  Tb2  1  0.41404241  0.58595559  0.59940438  1.0
  Tb  Tb3  1  0.41404241  0.58595559  0.90059562  1.0
  Th  Th4  1  0.08987539  0.91012261  0.25000000  1.0
  Th  Th5  1  0.91012261  0.08987539  0.75000000  1.0
  B  B6  1  0.00000000  0.00000000  0.00000000  1.0
  B  B7  1  0.00000000  0.00000000  0.50000000  1.0
  C  C8  1  0.08086869  0.91913031  0.08680468  1.0
  C  C9  1  0.59464627  0.40535173  0.25000000  1.0
  C  C10  1  0.08086869  0.91913031  0.41319532  1.0
  C  C11  1  0.91913031  0.08086869  0.58680468  1.0
  C  C12  1  0.40535173  0.59464627  0.75000000  1.0
  C  C13  1  0.91913031  0.08086869  0.91319432  1.0