data_[Mo6H2Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mo  2.1600  1.4500  0.7750
  H  2.2000  0.2500  0.0000
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.6245]
_cell_length_b [4.9081]
_cell_length_c [5.7990]
_cell_angle_alpha [90.2536]
_cell_angle_beta [90.1126]
_cell_angle_gamma [91.9771]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Mo3HPt]
_chemical_formula_sum '[Mo6 H2 Pt2]'
_cell_volume [131.5419]
_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
[
  Mo  Mo0  1  0.0136  0.2627  0.4832  1
  Mo  Mo1  1  0.0136  0.2631  0.9700  1
  Mo  Mo2  1  0.0574  0.8237  0.2282  1
  Mo  Mo3  1  0.5009  0.3835  0.2300  1
  Mo  Mo4  1  0.5463  0.9258  0.4730  1
  Mo  Mo5  1  0.5506  0.9321  0.9795  1
  H  H6  1  0.2822  0.5996  0.0056  1
  H  H7  1  0.8911  0.4714  0.2297  1
  Pt  Pt8  1  0.0358  0.7697  0.7214  1
  Pt  Pt9  1  0.5257  0.4287  0.7221  1
]