# generated using pymatgen
data_ThCo3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97016239
_cell_length_b   4.97016200
_cell_length_c   8.94755234
_cell_angle_alpha   73.87471418
_cell_angle_beta   73.87471568
_cell_angle_gamma   60.00000258
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThCo3
_chemical_formula_sum   'Th3 Co9'
_cell_volume   181.30431568
_cell_formula_units_Z   3
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  1  0.86331100  0.86331100  0.41006700  1.0
  Th  Th1  1  0.13668900  0.13668900  0.58993300  1.0
  Th  Th2  1  0.00000000  0.00000000  0.00000000  1.0
  Co  Co3  1  0.42117800  0.42117800  0.23963700  1.0
  Co  Co4  1  0.91800700  0.42117800  0.23963700  1.0
  Co  Co5  1  0.42117800  0.91800700  0.23963700  1.0
  Co  Co6  1  0.57882200  0.57882200  0.76036300  1.0
  Co  Co7  1  0.08199300  0.57882200  0.76036300  1.0
  Co  Co8  1  0.57882200  0.08199300  0.76036300  1.0
  Co  Co9  1  0.66739700  0.66739700  0.99780800  1.0
  Co  Co10  1  0.33260300  0.33260300  0.00219200  1.0
  Co  Co11  1  0.50000000  0.50000000  0.50000000  1.0