data_[Zr4Tl1Co1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Tl  1.6200  1.9000  1.3325
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [5.0481]
_cell_length_b [4.0160]
_cell_length_c [7.1348]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.3078]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Zr4TlCo]
_chemical_formula_sum '[Zr4 Tl1 Co1]'
_cell_volume [142.3106]
_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
[
  Zr  Zr0  2  0.0644  0.5000  0.2896  1
  Zr  Zr1  2  0.4471  0.0000  0.6932  1
  Tl  Tl2  1  0.5000  0.5000  0.0000  1
  Co  Co3  1  0.0000  0.0000  0.5000  1
]