data_CrPtCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.83
_cell_length_b   3.96
_cell_length_c   5.13
_cell_angle_alpha   90.0
_cell_angle_beta   111.74
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrPtCl2
_chemical_formula_sum   'Cr1 Pt1 Cl2'
_cell_volume   72.29
_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
  Cr  Cr2  1  0.06  0.0  0.45  1.0
  Pt  Pt3  1  0.43  0.98  0.47  1.0
  Cl  Cl0  1  0.76  0.0  0.61  1.0
  Cl  Cl1  1  0.67  0.98  0.39  1.0

data_CrPtCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.83
_cell_length_b   3.96
_cell_length_c   5.13
_cell_angle_alpha   90.0
_cell_angle_beta   111.74
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrPtCl2
_chemical_formula_sum   'Cr1 Pt1 Cl2'
_cell_volume   72.29
_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
  Cr  Cr0  1  0.06  0.0  0.45  1.0
  Pt  Pt1  1  0.43  0.98  0.47  1.0
  Cl  Cl2  1  0.67  0.98  0.39  1.0
  Cl  Cl3  1  0.76  0.0  0.61  1.0

Cr Pt Cl Cl