data_Cu2HgPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   4.85
_cell_angle_alpha   133.88
_cell_angle_beta   131.4
_cell_angle_gamma   69.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu2HgPd
_chemical_formula_sum   'Cu2 Hg1 Pd1'
_cell_volume   60.51
_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
  Cu  Cu0  1  0.9  0.0  0.04  1.0
  Cu  Cu1  1  0.0  0.0  0.96  1.0
  Hg  Hg2  1  0.9  0.0  0.97  1.0
  Pd  Pd3  1  0.0  0.0  0.0  1.0

data_Cu2HgPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.8
_cell_length_b   3.99
_cell_length_c   4.85
_cell_angle_alpha   114.3
_cell_angle_beta   113.06
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu2HgPd
_chemical_formula_sum   'Cu2 Hg1 Pd1'
_cell_volume   60.51
_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
  Cu  Cu0  1  0.04  0.04  0.04  1.0
  Cu  Cu1  1  0.86  0.96  0.86  1.0
  Hg  Hg2  1  0.93  0.03  0.93  1.0
  Pd  Pd3  1  1.0  1.0  1.0  1.0

Cu Cu Hg Pd