data_[V6Cu2H2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Cu  1.9000  1.3500  0.8200
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P2_1]
_cell_length_a [4.7993]
_cell_length_b [4.3873]
_cell_length_c [5.2427]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.8238]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [4]
_chemical_formula_structural [V3CuH]
_chemical_formula_sum '[V6 Cu2 H2]'
_cell_volume [110.1437]
_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  0.1247  0.4265  0.7275  1
  V  V1  2  0.3466  0.9183  0.0275  1
  V  V2  2  0.3492  0.9538  0.5352  1
  Cu  Cu3  2  0.1543  0.4339  0.2372  1
  H  H4  2  0.4431  0.6457  0.7504  1
]