# generated using pymatgen
data_BaCaMg14
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.73011390
_cell_length_b   6.67344384
_cell_length_c   10.74877272
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.72185100
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaCaMg14
_chemical_formula_sum   'Ba1 Ca1 Mg14'
_cell_volume   419.24932434
_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  0.16521498  0.83260699  0.12500000  1.0
  Ca  Ca1  1  0.17515724  0.33757812  0.12500000  1.0
  Mg  Mg2  1  0.16360369  0.33180134  0.62500000  1.0
  Mg  Mg3  1  0.16486582  0.83243241  0.62500000  1.0
  Mg  Mg4  1  0.66300866  0.33347607  0.12500000  1.0
  Mg  Mg5  1  0.66827145  0.33309089  0.62500000  1.0
  Mg  Mg6  1  0.66300866  0.82953159  0.12500000  1.0
  Mg  Mg7  1  0.66827145  0.83517956  0.62500000  1.0
  Mg  Mg8  1  0.34283916  0.17658101  0.39309315  1.0
  Mg  Mg9  1  0.34283916  0.17658101  0.85690685  1.0
  Mg  Mg10  1  0.34283916  0.66625915  0.39309315  1.0
  Mg  Mg11  1  0.34283916  0.66625915  0.85690685  1.0
  Mg  Mg12  1  0.82849415  0.16424757  0.37739875  1.0
  Mg  Mg13  1  0.82849415  0.16424757  0.87260125  1.0
  Mg  Mg14  1  0.82012656  0.66006378  0.38682332  1.0
  Mg  Mg15  1  0.82012656  0.66006378  0.86317668  1.0