data_[V2Cu1H18N6O10]
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
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.9334]
_cell_length_b [7.1984]
_cell_length_c [7.2074]
_cell_angle_alpha [62.3326]
_cell_angle_beta [74.0054]
_cell_angle_gamma [72.1989]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [V2CuH18(N3O5)2]
_chemical_formula_sum '[V2 Cu1 H18 N6 O10]'
_cell_volume [299.5047]
_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
[
  V  V0  2  0.1531  0.5842  0.2394  1
  Cu  Cu1  1  0.5000  0.0000  0.5000  1
  H  H2  2  0.1264  0.9887  0.5923  1
  H  H3  2  0.1496  0.1642  0.9603  1
  H  H4  2  0.1654  0.4147  0.9020  1
  H  H5  2  0.2359  0.3251  0.7079  1
  H  H6  2  0.2466  0.8049  0.4945  1
  H  H7  2  0.2496  0.7482  0.7473  1
  H  H8  2  0.3690  0.9065  0.8982  1
  H  H9  2  0.3989  0.2324  0.1378  1
  H  H10  2  0.4342  0.9724  0.1854  1
  N  N11  2  0.1350  0.3199  0.8460  1
  N  N12  2  0.2525  0.8672  0.5955  1
  N  N13  2  0.4909  0.0818  0.1974  1
  O  O14  2  0.0652  0.3267  0.4575  1
  O  O15  2  0.1450  0.8824  0.1424  1
  O  O16  2  0.2627  0.5326  0.0275  1
  O  O17  2  0.2735  0.3342  0.4570  1
  O  O18  2  0.3156  0.7408  0.2577  1
]