data_LiHg2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.3
_cell_length_b   5.3
_cell_length_c   5.3
_cell_angle_alpha   133.78
_cell_angle_beta   131.19
_cell_angle_gamma   69.49
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiHg2P
_chemical_formula_sum   'Li1 Hg2 P1'
_cell_volume   79.29
_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
  Li  Li2  1  0.0  0.0  0.0  1.0
  Hg  Hg0  1  0.0  0.19  0.02  1.0
  Hg  Hg1  1  0.08  0.0  0.34  1.0
  P  P3  1  0.0  0.0  0.35  1.0

data_LiHg2P
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.16
_cell_length_b   4.38
_cell_length_c   5.3
_cell_angle_alpha   114.41
_cell_angle_beta   113.11
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiHg2P
_chemical_formula_sum   'Li1 Hg2 P1'
_cell_volume   79.29
_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
  Li  Li0  1  0.0  0.0  0.0  1.0
  Hg  Hg1  1  0.74  0.66  0.74  1.0
  Hg  Hg2  1  0.98  0.17  0.17  1.0
  P  P3  1  0.65  0.65  0.65  1.0

Li Hg Hg P