data_[Mg4P2H2Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  P  2.1900  1.0000  0.5500
  H  2.2000  0.2500  0.0000
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.6640]
_cell_length_b [5.5578]
_cell_length_c [6.5661]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.3913]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Mg2PHPt6]
_chemical_formula_sum '[Mg4 P2 H2 Pt12]'
_cell_volume [307.2755]
_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  0.2343  0.0000  0.6519  1
  Mg  Mg1  2  0.3036  0.5000  0.3567  1
  P  P2  2  0.0011  0.5000  0.4904  1
  H  H3  2  0.3745  0.5000  0.0780  1
  Pt  Pt4  4  0.0061  0.2543  0.2039  1
  Pt  Pt5  4  0.0268  0.2475  0.7841  1
  Pt  Pt6  2  0.2461  0.0000  0.1889  1
  Pt  Pt7  2  0.2714  0.5000  0.7596  1
]