data_Hg3Pt5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.9
_cell_length_b   7.9
_cell_length_c   7.9
_cell_angle_alpha   96.44
_cell_angle_beta   96.44
_cell_angle_gamma   140.87
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hg3Pt5
_chemical_formula_sum   'Hg6 Pt10'
_cell_volume   293.21
_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
  Hg  Hg0  1  0.31  0.96  0.0  1.0
  Hg  Hg1  1  0.0  0.0  0.32  1.0
  Hg  Hg2  1  0.31  0.04  0.65  1.0
  Hg  Hg3  1  0.96  0.22  0.0  1.0
  Hg  Hg4  1  0.0  0.0  0.97  1.0
  Hg  Hg5  1  0.96  0.31  0.65  1.0
  Pt  Pt6  1  0.89  0.65  0.0  1.0
  Pt  Pt7  1  0.65  0.64  0.0  1.0
  Pt  Pt8  1  0.26  0.0  0.32  1.0
  Pt  Pt9  1  0.91  0.62  0.0  1.0
  Pt  Pt10  1  0.62  0.62  0.0  1.0
  Pt  Pt11  1  0.64  0.65  0.65  1.0
  Pt  Pt12  1  0.35  0.64  0.65  1.0
  Pt  Pt13  1  0.0  0.26  0.32  1.0
  Pt  Pt14  1  0.62  0.62  0.65  1.0
  Pt  Pt15  1  0.38  0.62  0.65  1.0

data_Hg3Pt5
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.29
_cell_length_b   7.9
_cell_length_c   7.9
_cell_angle_alpha   83.56
_cell_angle_beta   70.44
_cell_angle_gamma   70.44
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hg3Pt5
_chemical_formula_sum   'Hg6 Pt10'
_cell_volume   293.21
_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
  Hg  Hg0  1  0.0  0.0  0.03  1.0
  Hg  Hg1  1  0.0  0.0  0.68  1.0
  Hg  Hg2  1  0.04  0.26  0.35  1.0
  Hg  Hg3  1  0.22  0.74  0.0  1.0
  Hg  Hg4  1  0.31  0.65  0.35  1.0
  Hg  Hg5  1  0.96  0.35  0.0  1.0
  Pt  Pt6  1  0.0  0.26  0.68  1.0
  Pt  Pt7  1  0.26  0.74  0.68  1.0
  Pt  Pt8  1  0.62  0.01  0.0  1.0
  Pt  Pt9  1  0.62  0.76  0.35  1.0
  Pt  Pt10  1  0.62  0.28  0.0  1.0
  Pt  Pt11  1  0.62  0.99  0.35  1.0
  Pt  Pt12  1  0.64  0.01  0.0  1.0
  Pt  Pt13  1  0.64  0.72  0.35  1.0
  Pt  Pt14  1  0.65  0.24  0.0  1.0
  Pt  Pt15  1  0.65  0.99  0.35  1.0

Hg Hg Hg Hg Hg Hg Pt Pt Pt Pt Pt Pt Pt Pt Pt Pt