data_[V4Ni2B4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Ni  1.9100  1.3500  0.7400
  B  2.0400  0.8500  0.4100
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.0776]
_cell_length_b [5.0713]
_cell_length_c [5.7065]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.6063]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [V2Ni(BO3)2]
_chemical_formula_sum '[V4 Ni2 B4 O12]'
_cell_volume [210.7994]
_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  4  0.2009  0.5000  0.6858  1
  Ni  Ni1  2  0.0000  0.5000  0.0000  1
  B  B2  4  0.0467  0.0000  0.7713  1
  O  O3  8  0.0556  0.2329  0.2952  1
  O  O4  4  0.2305  0.0000  0.9074  1
]