[CIF]
data_CaCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87455618
_cell_length_b   5.87455618
_cell_length_c   5.87455618
_cell_angle_alpha   140.90448765
_cell_angle_beta   71.94559233
_cell_angle_gamma   122.26420459
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaCl3
_chemical_formula_sum   'Ca1 Cl3'
_cell_volume   106.01530296
_cell_formula_units_Z   1
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
  Ca  Ca0  1  1.96558207  -0.00000000  0.27592786  1
  Cl  Cl1  1  0.00000000  0.00000000  2.22385985  1
  Cl  Cl2  1  1.96558207  -3.06303272  2.05899158  1
  Cl  Cl3  1  1.96558207  3.06303272  2.05899158  1
[/CIF]
