# generated using pymatgen
data_CsMg6Sn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.98179600
_cell_length_b   7.42131500
_cell_length_c   12.87605700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsMg6Sn
_chemical_formula_sum   'Cs2 Mg12 Sn2'
_cell_volume   476.04685014
_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
  Cs  Cs0  1  0.50000000  0.50000000  0.16894900  1.0
  Cs  Cs1  1  0.50000000  0.00000000  0.66894900  1.0
  Mg  Mg2  1  0.00000000  0.80106300  0.06800200  1.0
  Mg  Mg3  1  0.00000000  0.19893700  0.06800200  1.0
  Mg  Mg4  1  0.00000000  0.00000000  0.32941100  1.0
  Mg  Mg5  1  0.50000000  0.25922100  0.41804200  1.0
  Mg  Mg6  1  0.50000000  0.74077900  0.41804200  1.0
  Mg  Mg7  1  0.50000000  0.00000000  0.16502000  1.0
  Mg  Mg8  1  0.00000000  0.30106300  0.56800200  1.0
  Mg  Mg9  1  0.00000000  0.69893700  0.56800200  1.0
  Mg  Mg10  1  0.00000000  0.50000000  0.82941100  1.0
  Mg  Mg11  1  0.50000000  0.75922100  0.91804200  1.0
  Mg  Mg12  1  0.50000000  0.24077900  0.91804200  1.0
  Mg  Mg13  1  0.50000000  0.50000000  0.66502000  1.0
  Sn  Sn14  1  0.00000000  0.50000000  0.36453100  1.0
  Sn  Sn15  1  0.00000000  0.00000000  0.86453100  1.0