# generated using pymatgen
data_CrCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.89482795
_cell_length_b   6.89423045
_cell_length_c   6.89309483
_cell_angle_alpha   51.55805630
_cell_angle_beta   51.56375735
_cell_angle_gamma   51.55075270
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrCl3
_chemical_formula_sum   'Cr2 Cl6'
_cell_volume   185.64610736
_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  0.66653059  0.66664758  0.66654218  1.0
  Cr  Cr1  1  0.33346941  0.33335242  0.33345782  1.0
  Cl  Cl2  1  0.56934592  0.92574167  0.28101939  1.0
  Cl  Cl3  1  0.71901599  0.43061498  0.07432095  1.0
  Cl  Cl4  1  0.28098401  0.56938502  0.92567905  1.0
  Cl  Cl5  1  0.07435463  0.71896921  0.43061435  1.0
  Cl  Cl6  1  0.43065408  0.07425833  0.71898061  1.0
  Cl  Cl7  1  0.92564537  0.28103079  0.56938565  1.0