# generated using pymatgen
data_CrCoCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.69136600
_cell_length_b   6.57425762
_cell_length_c   6.57425762
_cell_angle_alpha   119.99999617
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrCoCl3
_chemical_formula_sum   'Cr2 Co2 Cl6'
_cell_volume   213.02991807
_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
  Cr  Cr0  1  0.25000000  0.66666700  0.33333300  1.0
  Cr  Cr1  1  0.75000000  0.33333300  0.66666700  1.0
  Co  Co2  1  0.00000000  0.00000000  0.00000000  1.0
  Co  Co3  1  0.50000000  0.00000000  0.00000000  1.0
  Cl  Cl4  1  0.75000000  0.83102700  0.16897300  1.0
  Cl  Cl5  1  0.25000000  0.16897300  0.83102700  1.0
  Cl  Cl6  1  0.75000000  0.33794700  0.16897300  1.0
  Cl  Cl7  1  0.25000000  0.66205300  0.83102700  1.0
  Cl  Cl8  1  0.75000000  0.83102700  0.66205300  1.0
  Cl  Cl9  1  0.25000000  0.16897300  0.33794700  1.0