# generated using pymatgen
data_ThAlCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.33881968
_cell_length_b   7.33881968
_cell_length_c   3.47187300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   95.67735832
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThAlCo
_chemical_formula_sum   'Th3 Al3 Co3'
_cell_volume   186.07185813
_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  0.28223600  0.34769600  0.00000000  1.0
  Th  Th1  1  0.65230400  0.71776400  0.00000000  1.0
  Th  Th2  1  0.97290800  0.02709200  0.50000000  1.0
  Al  Al3  1  0.72877900  0.27122100  0.00000000  1.0
  Al  Al4  1  0.06046300  0.67668100  0.00000000  1.0
  Al  Al5  1  0.32331900  0.93953700  0.00000000  1.0
  Co  Co6  1  0.56001900  0.43998100  0.50000000  1.0
  Co  Co7  1  0.90744300  0.48737000  0.50000000  1.0
  Co  Co8  1  0.51263000  0.09255700  0.50000000  1.0