data_CrSnPt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.71
_cell_length_b   4.71
_cell_length_c   5.08
_cell_angle_alpha   101.92
_cell_angle_beta   101.92
_cell_angle_gamma   36.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrSnPt2
_chemical_formula_sum   'Cr1 Sn1 Pt2'
_cell_volume   65.07
_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  0.51  0.0  0.01  1.0
  Sn  Sn3  1  0.86  0.0  0.52  1.0
  Pt  Pt1  1  0.04  0.0  0.16  1.0
  Pt  Pt2  1  0.36  0.0  0.75  1.0

data_CrSnPt2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.93
_cell_length_b   4.71
_cell_length_c   5.08
_cell_angle_alpha   101.92
_cell_angle_beta   90.0
_cell_angle_gamma   108.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrSnPt2
_chemical_formula_sum   'Cr1 Sn1 Pt2'
_cell_volume   65.07
_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  0.0  0.49  0.99  1.0
  Sn  Sn1  1  0.0  0.14  0.48  1.0
  Pt  Pt2  1  0.0  0.64  0.25  1.0
  Pt  Pt3  1  0.0  0.96  0.84  1.0

Cr Sn Pt Pt
Cr Sn Pt Pt 0 3 o o - 0 1 o o o 0 2 + o o 0 2 o o o 1 3 o o o 1 3 + o o 1 2 + o o 2 3 o o - 