data_[Tm4Co2Hg5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Co  1.8800  1.3500  0.7683
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.5055]
_cell_length_b [3.5734]
_cell_length_c [9.1422]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.7272]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Tm4Co2Hg5]
_chemical_formula_sum '[Tm4 Co2 Hg5]'
_cell_volume [244.3639]
_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
[
  Tm  Tm0  2  0.1776  0.5000  0.8328  1.0
  Tm  Tm1  2  0.2158  0.5000  0.4331  1.0
  Co  Co2  2  0.0646  0.0000  0.6246  1.0
  Hg  Hg3  2  0.1595  0.0000  0.1395  1.0
  Hg  Hg4  2  0.4454  0.0000  0.6639  1.0
  Hg  Hg5  1  0.5000  0.0000  0.0000  1.0
]