data_[V2Ni13]
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
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.3045]
_cell_length_b [6.0739]
_cell_length_c [6.5857]
_cell_angle_alpha [107.8524]
_cell_angle_beta [96.3113]
_cell_angle_gamma [90.0112]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [V2Ni13]
_chemical_formula_sum '[V2 Ni13]'
_cell_volume [162.7955]
_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  0.2015  0.4036  0.2004  1.0
  Ni  Ni1  2  0.0668  0.1346  0.3964  1.0
  Ni  Ni2  2  0.1324  0.2682  0.7990  1.0
  Ni  Ni3  2  0.2672  0.5335  0.6021  1.0
  Ni  Ni4  2  0.3322  0.6689  0.0043  1.0
  Ni  Ni5  2  0.3983  0.7984  0.4014  1.0
  Ni  Ni6  2  0.4689  0.9310  0.7998  1.0
  Ni  Ni7  1  0.0000  0.0000  0.0000  1.0
]