data_[V4Ni4Te8]
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
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pmna]
_cell_length_a [7.7870]
_cell_length_b [7.5496]
_cell_length_c [6.0871]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [53]
_chemical_formula_structural [VNiTe2]
_chemical_formula_sum '[V4 Ni4 Te8]'
_cell_volume [357.8537]
_cell_formula_units_Z [4]
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  0.2084  0.0000  0.5000  1.0
  Ni  Ni1  4  0.0000  0.1111  0.1439  1.0
  Te  Te2  4  0.0000  0.2097  0.7363  1.0
  Te  Te3  4  0.2500  0.2999  0.2500  1.0
]