data_[Mg2Te4Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Te  2.1000  1.4000  1.2933
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [8.4151]
_cell_length_b [3.9368]
_cell_length_c [6.5350]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.5010]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [MgTe2Pt]
_chemical_formula_sum '[Mg2 Te4 Pt2]'
_cell_volume [201.4294]
_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
[
  Mg  Mg0  2  0.4935  0.0000  0.4455  1
  Te  Te1  2  0.2764  0.0000  0.6614  1
  Te  Te2  2  0.4874  0.5000  0.0932  1
  Pt  Pt3  2  0.2428  0.5000  0.2999  1
]