data_[Y6Ni2Te2Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ni  1.9100  1.3500  0.7400
  Te  2.1000  1.4000  1.2933
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.4028]
_cell_length_b [4.0458]
_cell_length_c [9.7589]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.8226]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Y3NiTeCl]
_chemical_formula_sum '[Y6 Ni2 Te2 Cl2]'
_cell_volume [329.4126]
_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
[
  Y  Y0  2  0.2019  0.7500  0.8824  1
  Y  Y1  2  0.3566  0.2500  0.6000  1
  Y  Y2  2  0.3675  0.2500  0.1808  1
  Ni  Ni3  2  0.4433  0.2500  0.9033  1
  Te  Te4  2  0.0886  0.7500  0.1815  1
  Cl  Cl5  2  0.1434  0.7500  0.5871  1
]