data_[Ti2V2Zn2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  V  1.6300  1.3500  0.7775
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [2.7902]
_cell_length_b [4.2825]
_cell_length_c [7.5302]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.5981]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [TiVZn]
_chemical_formula_sum '[Ti2 V2 Zn2]'
_cell_volume [89.7995]
_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
[
  Ti  Ti0  2  0.0039  0.7500  0.2468  1.0
  V  V1  2  0.3517  0.2500  0.4365  1.0
  Zn  Zn2  2  0.4673  0.7500  0.9067  1.0
]