data_[Zn7Ga3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.0286]
_cell_length_b [5.5389]
_cell_length_c [7.5856]
_cell_angle_alpha [98.1939]
_cell_angle_beta [99.8793]
_cell_angle_gamma [97.3081]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Zn7Ga3]
_chemical_formula_sum '[Zn7 Ga3]'
_cell_volume [163.0456]
_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
[
  Zn  Zn0  2  0.2056  0.1000  0.4019  1.0
  Zn  Zn1  2  0.3923  0.1972  0.7956  1.0
  Zn  Zn2  2  0.4069  0.7025  0.8058  1.0
  Zn  Zn3  1  0.0000  0.5000  0.0000  1.0
  Ga  Ga4  2  0.1877  0.5973  0.3891  1.0
  Ga  Ga5  1  0.0000  0.0000  0.0000  1.0
]