data_KPt3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.52
_cell_length_b   7.85
_cell_length_c   5.99
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KPt3
_chemical_formula_sum   'K2 Pt6'
_cell_volume   212.43
_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
  K  K0  1  0.0  0.0  0.65  1.0
  K  K1  1  0.26  0.92  0.34  1.0
  Pt  Pt2  1  0.26  0.0  0.84  1.0
  Pt  Pt3  1  0.0  0.33  0.68  1.0
  Pt  Pt4  1  0.26  0.59  0.32  1.0
  Pt  Pt5  1  0.0  0.92  0.15  1.0
  Pt  Pt6  1  0.0  0.51  0.68  1.0
  Pt  Pt7  1  0.26  0.26  0.32  1.0

data_KPt3
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.52
_cell_length_b   5.99
_cell_length_c   7.85
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KPt3
_chemical_formula_sum   'K2 Pt6'
_cell_volume   212.43
_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
  K  K0  1  0.0  0.35  0.0  1.0
  K  K1  1  0.74  0.66  0.08  1.0
  Pt  Pt2  1  0.0  0.32  0.49  1.0
  Pt  Pt3  1  0.0  0.32  0.67  1.0
  Pt  Pt4  1  0.0  0.85  0.08  1.0
  Pt  Pt5  1  0.74  0.16  0.0  1.0
  Pt  Pt6  1  0.74  0.68  0.41  1.0
  Pt  Pt7  1  0.74  0.68  0.74  1.0

K K Pt Pt Pt Pt Pt Pt