data_[V4Mo2H4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Mo  2.1600  1.4500  0.7750
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.4908]
_cell_length_b [5.2459]
_cell_length_c [5.2534]
_cell_angle_alpha [95.6647]
_cell_angle_beta [115.1796]
_cell_angle_gamma [115.1276]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [V2MoH2]
_chemical_formula_sum '[V4 Mo2 H4]'
_cell_volume [95.3245]
_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
[
  V  V0  2  0.2462  0.7427  0.7463  1.0
  V  V1  2  0.4016  0.2384  0.5798  1.0
  Mo  Mo2  2  0.0865  0.2466  0.9128  1.0
  H  H3  2  0.2568  0.5023  0.4922  1.0
  H  H4  2  0.3869  0.8812  0.1262  1.0
]