data_Hg2BPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56
_cell_length_b   3.56
_cell_length_c   7.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   124.45
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hg2BPt
_chemical_formula_sum   'Hg2 B1 Pt1'
_cell_volume   79.72
_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
  Hg  Hg1  1  0.66  0.0  0.36  1.0
  Hg  Hg2  1  0.0  0.0  0.58  1.0
  B  B0  1  0.0  0.0  0.21  1.0
  Pt  Pt3  1  0.66  0.0  0.3  1.0

data_Hg2BPt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.32
_cell_length_b   3.56
_cell_length_c   7.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   117.77
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hg2BPt
_chemical_formula_sum   'Hg2 B1 Pt1'
_cell_volume   79.72
_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
  Hg  Hg0  1  0.0  0.0  0.58  1.0
  Hg  Hg1  1  0.0  0.66  0.36  1.0
  B  B2  1  0.0  0.0  0.21  1.0
  Pt  Pt3  1  0.0  0.66  0.3  1.0

Hg Hg B Pt