# generated using pymatgen
data_Mg6CdB
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.80622200
_cell_length_b   6.14238000
_cell_length_c   11.05610500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg6CdB
_chemical_formula_sum   'Mg12 Cd2 B2'
_cell_volume   326.39437249
_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
  Mg  Mg0  1  0.00000000  0.27270300  0.10198000  1.0
  Mg  Mg1  1  0.00000000  0.72729700  0.10198000  1.0
  Mg  Mg2  1  0.00000000  0.00000000  0.33743600  1.0
  Mg  Mg3  1  0.50000000  0.75083100  0.42208300  1.0
  Mg  Mg4  1  0.50000000  0.24916900  0.42208300  1.0
  Mg  Mg5  1  0.50000000  0.00000000  0.16720200  1.0
  Mg  Mg6  1  0.00000000  0.77270300  0.60198000  1.0
  Mg  Mg7  1  0.00000000  0.22729700  0.60198000  1.0
  Mg  Mg8  1  0.00000000  0.50000000  0.83743600  1.0
  Mg  Mg9  1  0.50000000  0.25083100  0.92208300  1.0
  Mg  Mg10  1  0.50000000  0.74916900  0.92208300  1.0
  Mg  Mg11  1  0.50000000  0.50000000  0.66720200  1.0
  Cd  Cd12  1  0.00000000  0.50000000  0.35170000  1.0
  Cd  Cd13  1  0.00000000  0.00000000  0.85170000  1.0
  B  B14  1  0.50000000  0.50000000  0.09553600  1.0
  B  B15  1  0.50000000  0.00000000  0.59553600  1.0