# generated using pymatgen
data_Tb2CoRuI2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.06822328
_cell_length_b   4.06822304
_cell_length_c   12.57183157
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999412
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb2CoRuI2
_chemical_formula_sum   'Tb2 Co1 Ru1 I2'
_cell_volume   180.19334466
_cell_formula_units_Z   1
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  0.00000000  0.00000000  0.15285751  1.0
  Tb  Tb1  1  0.00000000  0.00000000  0.84851252  1.0
  Co  Co2  1  0.33333300  0.66666600  0.99409416  1.0
  Ru  Ru3  1  0.66666600  0.33333400  0.00423712  1.0
  I  I4  1  0.33333300  0.66666600  0.32220598  1.0
  I  I5  1  0.66666600  0.33333400  0.67809271  1.0