# generated using pymatgen
data_Th(CoAs)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.18977750
_cell_length_b   4.18977750
_cell_length_c   9.24333019
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th(CoAs)2
_chemical_formula_sum   'Th2 Co4 As4'
_cell_volume   162.25959495
_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  1  0.75000000  0.75000000  0.24453496  1.0
  Th  Th1  1  0.25000000  0.25000000  0.75546504  1.0
  Co  Co2  1  0.75000000  0.25000000  -0.00000000  1.0
  Co  Co3  1  0.25000000  0.75000000  -0.00000000  1.0
  Co  Co4  1  0.75000000  0.75000000  0.61158096  1.0
  Co  Co5  1  0.25000000  0.25000000  0.38841904  1.0
  As  As6  1  0.75000000  0.25000000  0.50000000  1.0
  As  As7  1  0.25000000  0.75000000  0.50000000  1.0
  As  As8  1  0.75000000  0.75000000  0.86829746  1.0
  As  As9  1  0.25000000  0.25000000  0.13170254  1.0