data_[Co2Ni4H12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Ni  1.9100  1.3500  0.7400
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [4.4108]
_cell_length_b [4.0312]
_cell_length_c [6.8693]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.9627]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Co(NiH3)2]
_chemical_formula_sum '[Co2 Ni4 H12]'
_cell_volume [107.8818]
_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
[
  Co  Co0  2  0.5000  0.0000  0.5000  1.0
  Ni  Ni1  4  0.1660  0.0433  0.7177  1.0
  H  H2  4  0.1555  0.2312  0.4362  1.0
  H  H3  4  0.1878  0.7190  0.4062  1.0
  H  H4  4  0.4945  0.1883  0.2809  1.0
]