data_[Tm3Ga3Si2Ni1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Ga  1.8100  1.3000  0.7600
  Si  1.9000  1.1000  0.5400
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [P-62m]
_cell_length_a [6.8314]
_cell_length_b [6.8314]
_cell_length_c [4.0970]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [189]
_chemical_formula_structural [Tm3Ga3Si2Ni]
_chemical_formula_sum '[Tm3 Ga3 Si2 Ni1]'
_cell_volume [165.5812]
_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
[
  Tm  Tm0  3  0.0000  0.4041  0.0000  1.0
  Ga  Ga1  3  0.0000  0.7635  0.5000  1.0
  Si  Si2  2  0.3333  0.6667  0.5000  1.0
  Ni  Ni3  1  0.0000  0.0000  0.0000  1.0
]