data_[Ba4Mg2Ni2Mo2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Mg  1.3100  1.5000  0.8600
  Ni  1.9100  1.3500  0.7400
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.7679]
_cell_length_b [6.1416]
_cell_length_c [6.3900]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.6244]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Ba2MgNiMoO6]
_chemical_formula_sum '[Ba4 Mg2 Ni2 Mo2 O12]'
_cell_volume [381.0209]
_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  0.2040  0.0000  0.7011  1
  Ba  Ba1  2  0.3190  0.5000  0.4405  1
  Mg  Mg2  2  0.0876  0.5000  0.7953  1
  Ni  Ni3  2  0.4755  0.5000  0.9734  1
  Mo  Mo4  2  0.4412  0.0000  0.2835  1
  O  O5  4  0.0083  0.2210  0.7740  1
  O  O6  4  0.0133  0.2393  0.2552  1
  O  O7  2  0.2682  0.5000  0.8074  1
  O  O8  2  0.2863  0.0000  0.3260  1
]