# generated using pymatgen
data_MgPa2(SnIr)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.36506912
_cell_length_b   7.36506836
_cell_length_c   3.98163765
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.45087128
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgPa2(SnIr)3
_chemical_formula_sum   'Mg1 Pa2 Sn3 Ir3'
_cell_volume   186.18936528
_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
  Mg  Mg0  1  0.39835879  0.39835879  0.50000000  1.0
  Pa  Pa1  1  0.59022269  0.00241839  0.50000000  1.0
  Pa  Pa2  1  0.00241839  0.59022269  0.50000000  1.0
  Sn  Sn3  1  0.72525823  0.72525823  0.00000000  1.0
  Sn  Sn4  1  0.25989362  0.01929329  0.00000000  1.0
  Sn  Sn5  1  0.01929329  0.25989362  0.00000000  1.0
  Ir  Ir6  1  0.68594385  0.33018265  0.00000000  1.0
  Ir  Ir7  1  0.33018265  0.68594385  0.00000000  1.0
  Ir  Ir8  1  0.98842949  0.98842949  0.50000000  1.0