data_[Sr2Zn4In3Ga1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Zn  1.6500  1.3500  0.8800
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.6450]
_cell_length_b [4.6450]
_cell_length_c [11.2039]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Sr2Zn4In3Ga]
_chemical_formula_sum '[Sr2 Zn4 In3 Ga1]'
_cell_volume [241.7402]
_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
[
  Sr  Sr0  2  0.0000  0.5000  0.7481  1.0
  Zn  Zn1  2  0.0000  0.5000  0.3703  1.0
  Zn  Zn2  1  0.0000  0.0000  0.0000  1.0
  Zn  Zn3  1  0.5000  0.5000  0.0000  1.0
  In  In4  2  0.0000  0.5000  0.1326  1.0
  In  In5  1  0.0000  0.0000  0.5000  1.0
  Ga  Ga6  1  0.5000  0.5000  0.5000  1.0
]