data_[Ba4Sr2Mg2In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Sr  0.9500  2.0000  1.3200
  Mg  1.3100  1.5000  0.8600
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [5.4042]
_cell_length_b [9.5445]
_cell_length_c [8.9482]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [Ba2SrMgIn2]
_chemical_formula_sum '[Ba4 Sr2 Mg2 In4]'
_cell_volume [461.5516]
_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
[
  Ba  Ba0  2  0.0000  0.1580  0.3556  1.0
  Ba  Ba1  2  0.5000  0.1291  0.0039  1.0
  Sr  Sr2  2  0.0000  0.4672  0.0201  1.0
  Mg  Mg3  2  0.5000  0.3036  0.6272  1.0
  In  In4  2  0.0000  0.2008  0.7482  1.0
  In  In5  2  0.5000  0.4096  0.2906  1.0
]