data_[Cu1Ni1H4Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Ni  1.9100  1.3500  0.7400
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.8517]
_cell_length_b [2.8253]
_cell_length_c [5.0473]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.5171]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [CuNi(H2Pd)2]
_chemical_formula_sum '[Cu1 Ni1 H4 Pd2]'
_cell_volume [63.9124]
_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
[
  Cu  Cu0  1  0.5000  0.5000  0.0000  1
  Ni  Ni1  1  0.5000  0.0000  0.5000  1
  H  H2  2  0.2669  0.5000  0.2826  1
  H  H3  2  0.2780  0.0000  0.7008  1
  Pd  Pd4  1  0.0000  0.0000  0.0000  1
  Pd  Pd5  1  0.0000  0.5000  0.5000  1
]