data_KHgPt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.72
_cell_length_b   5.19
_cell_length_c   5.28
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KHgPt2
_chemical_formula_sum   'K1 Hg1 Pt2'
_cell_volume   101.82
_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
  K  K1  1  0.0  0.0  0.0  1.0
  Hg  Hg0  1  0.86  0.59  0.0  1.0
  Pt  Pt2  1  0.0  0.59  0.64  1.0
  Pt  Pt3  1  0.86  0.0  0.64  1.0

data_KHgPt2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.72
_cell_length_b   5.19
_cell_length_c   5.28
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KHgPt2
_chemical_formula_sum   'K1 Hg1 Pt2'
_cell_volume   101.82
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Hg  Hg1  1  0.86  0.59  0.0  1.0
  Pt  Pt2  1  0.0  0.59  0.64  1.0
  Pt  Pt3  1  0.86  0.0  0.64  1.0

K Hg Pt Pt
K Hg Pt Pt 0 1 - - o 0 3 - o - 1 2 + o - 2 3 - + o 