data_Ba2MgCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.71
_cell_length_b   6.71
_cell_length_c   6.71
_cell_angle_alpha   146.65
_cell_angle_beta   128.66
_cell_angle_gamma   62.61
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2MgCo
_chemical_formula_sum   'Ba2 Mg1 Co1'
_cell_volume   128.49
_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
  Ba  Ba0  1  0.0  0.91  0.64  1.0
  Ba  Ba1  1  0.0  0.0  0.5  1.0
  Mg  Mg3  1  0.0  0.0  0.78  1.0
  Co  Co2  1  0.0  0.91  0.29  1.0

data_Ba2MgCo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.85
_cell_length_b   5.82
_cell_length_c   6.71
_cell_angle_alpha   115.67
_cell_angle_beta   106.67
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2MgCo
_chemical_formula_sum   'Ba2 Mg1 Co1'
_cell_volume   128.49
_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
  Ba  Ba0  1  0.36  0.27  0.27  1.0
  Ba  Ba1  1  0.5  0.5  0.5  1.0
  Mg  Mg2  1  0.22  0.22  0.22  1.0
  Co  Co3  1  0.71  0.62  0.62  1.0

Ba Ba Mg Co