# generated using pymatgen
data_Mg(Sn2Ir)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.15959633
_cell_length_b   8.11130005
_cell_length_c   8.11129930
_cell_angle_alpha   109.35029284
_cell_angle_beta   109.59187997
_cell_angle_gamma   109.59187706
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg(Sn2Ir)3
_chemical_formula_sum   'Mg2 Sn12 Ir6'
_cell_volume   412.64711693
_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  0.68784414  1.00000000  1.00000000  1.0
  Mg  Mg1  1  0.31215586  0.00000000  0.00000000  1.0
  Sn  Sn2  1  0.50000000  0.75795421  0.24204579  1.0
  Sn  Sn3  1  0.50000000  0.24204579  0.75795421  1.0
  Sn  Sn4  1  0.25795421  0.51590842  0.75795421  1.0
  Sn  Sn5  1  0.74204579  0.48409158  0.24204579  1.0
  Sn  Sn6  1  0.74204579  0.24204579  0.48409158  1.0
  Sn  Sn7  1  0.25795421  0.75795421  0.51590842  1.0
  Sn  Sn8  1  0.32939677  0.32363021  0.32363021  1.0
  Sn  Sn9  1  0.67060323  0.67636979  0.67636979  1.0
  Sn  Sn10  1  0.00576656  0.00000000  0.67636979  1.0
  Sn  Sn11  1  0.00576656  0.67636979  1.00000000  1.0
  Sn  Sn12  1  0.99423344  1.00000000  0.32363021  1.0
  Sn  Sn13  1  0.99423344  0.32363021  0.00000000  1.0
  Ir  Ir14  1  0.00960462  0.34904693  0.34904693  1.0
  Ir  Ir15  1  0.99039538  0.65095307  0.65095307  1.0
  Ir  Ir16  1  0.33944231  0.00000000  0.34904693  1.0
  Ir  Ir17  1  0.66055769  1.00000000  0.65095307  1.0
  Ir  Ir18  1  0.33944231  0.34904693  0.00000000  1.0
  Ir  Ir19  1  0.66055769  0.65095307  1.00000000  1.0