data_[Ce6In1Pt1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  In  1.7800  1.5500  0.9400
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.8311]
_cell_length_b [6.0622]
_cell_length_c [6.3681]
_cell_angle_alpha [95.3428]
_cell_angle_beta [94.6541]
_cell_angle_gamma [116.1955]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Ce6InPt]
_chemical_formula_sum '[Ce6 In1 Pt1]'
_cell_volume [199.2183]
_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
[
  Ce  Ce0  2  0.0802  0.6466  0.2495  1
  Ce  Ce1  2  0.2456  0.3160  0.4323  1
  Ce  Ce2  2  0.4223  0.9679  0.7690  1
  In  In3  1  0.5000  0.5000  0.0000  1
  Pt  Pt4  1  0.0000  0.0000  0.0000  1
]