data_[Zn2Ga8Cu14]
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
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.2758]
_cell_length_b [4.5104]
_cell_length_c [9.3991]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.3719]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [ZnGa4Cu7]
_chemical_formula_sum '[Zn2 Ga8 Cu14]'
_cell_volume [346.0028]
_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
[
  Zn  Zn0  2  0.0000  0.0000  0.0000  1
  Ga  Ga1  4  0.0954  0.5000  0.7755  1
  Ga  Ga2  4  0.2325  0.5000  0.3119  1
  Cu  Cu3  4  0.0375  0.0000  0.3766  1
  Cu  Cu4  4  0.1483  0.5000  0.5263  1
  Cu  Cu5  4  0.2103  0.0000  0.9201  1
  Cu  Cu6  2  0.0000  0.5000  0.0000  1
]