# generated using pymatgen
data_CoAs3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.28046106
_cell_length_b   8.28046106
_cell_length_c   8.28046106
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoAs3
_chemical_formula_sum   'Co8 As24'
_cell_volume   567.75838589
_cell_formula_units_Z   8
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
  Co  Co0  1  0.75000000  0.25000000  0.25000000  1
  Co  Co1  1  0.75000000  0.75000000  0.75000000  1
  Co  Co2  1  0.25000000  0.75000000  0.25000000  1
  Co  Co3  1  0.75000000  0.75000000  0.25000000  1
  Co  Co4  1  0.25000000  0.75000000  0.75000000  1
  Co  Co5  1  0.25000000  0.25000000  0.25000000  1
  Co  Co6  1  0.75000000  0.25000000  0.75000000  1
  Co  Co7  1  0.25000000  0.25000000  0.75000000  1
  As  As8  1  0.00000000  0.65873900  0.15205900  1
  As  As9  1  0.84794100  0.00000000  0.65873900  1
  As  As10  1  0.84794100  0.00000000  0.34126100  1
  As  As11  1  0.65873900  0.84794100  0.00000000  1
  As  As12  1  0.50000000  0.15873900  0.34794100  1
  As  As13  1  0.84126100  0.65205900  0.50000000  1
  As  As14  1  0.65205900  0.50000000  0.84126100  1
  As  As15  1  0.00000000  0.34126100  0.15205900  1
  As  As16  1  0.50000000  0.84126100  0.34794100  1
  As  As17  1  0.65205900  0.50000000  0.15873900  1
  As  As18  1  0.15873900  0.65205900  0.50000000  1
  As  As19  1  0.34126100  0.84794100  0.00000000  1
  As  As20  1  0.50000000  0.15873900  0.65205900  1
  As  As21  1  0.34794100  0.50000000  0.15873900  1
  As  As22  1  0.34794100  0.50000000  0.84126100  1
  As  As23  1  0.15873900  0.34794100  0.50000000  1
  As  As24  1  0.00000000  0.65873900  0.84794100  1
  As  As25  1  0.34126100  0.15205900  0.00000000  1
  As  As26  1  0.15205900  0.00000000  0.34126100  1
  As  As27  1  0.50000000  0.84126100  0.65205900  1
  As  As28  1  0.00000000  0.34126100  0.84794100  1
  As  As29  1  0.15205900  0.00000000  0.65873900  1
  As  As30  1  0.65873900  0.15205900  0.00000000  1
  As  As31  1  0.84126100  0.34794100  0.50000000  1
