data_[Hg10P2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.9825]
_cell_length_b [4.5904]
_cell_length_c [6.5040]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.0730]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Hg5P]
_chemical_formula_sum '[Hg10 P2]'
_cell_volume [324.0376]
_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  2  0.0130  0.0000  0.1724  1
  Hg  Hg1  2  0.1195  0.5000  0.5150  1
  Hg  Hg2  2  0.2563  0.5000  0.1462  1
  Hg  Hg3  2  0.3283  0.0000  0.7497  1
  Hg  Hg4  2  0.4486  0.5000  0.6088  1
  P  P5  2  0.1676  0.0000  0.9746  1
]