# generated using pymatgen
data_Sm2MgIrO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.76019400
_cell_length_b   5.42801400
_cell_length_c   9.48535488
_cell_angle_alpha   55.32603660
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm2MgIrO6
_chemical_formula_sum   'Sm4 Mg2 Ir2 O12'
_cell_volume   243.90244573
_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
  Sm  Sm0  1  0.93190900  0.73117100  0.74909800  1.0
  Sm  Sm1  1  0.43190900  0.26882900  0.75090200  1.0
  Sm  Sm2  1  0.56809100  0.73117100  0.24909800  1.0
  Sm  Sm3  1  0.06809100  0.26882900  0.25090200  1.0
  Mg  Mg4  1  0.50000000  0.00000000  0.50000000  1.0
  Mg  Mg5  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir6  1  0.00000000  0.50000000  0.50000000  1.0
  Ir  Ir7  1  0.50000000  0.50000000  0.00000000  1.0
  O  O8  1  0.19833100  0.75072000  0.55443900  1.0
  O  O9  1  0.70083400  0.63415300  0.55485500  1.0
  O  O10  1  0.03406900  0.14628400  0.74782700  1.0
  O  O11  1  0.53406900  0.85371600  0.75217300  1.0
  O  O12  1  0.20083400  0.36584700  0.94514500  1.0
  O  O13  1  0.69833100  0.24928000  0.94556100  1.0
  O  O14  1  0.30166900  0.75072000  0.05443900  1.0
  O  O15  1  0.79916600  0.63415300  0.05485500  1.0
  O  O16  1  0.46593100  0.14628400  0.24782700  1.0
  O  O17  1  0.96593100  0.85371600  0.25217300  1.0
  O  O18  1  0.29916600  0.36584700  0.44514500  1.0
  O  O19  1  0.80166900  0.24928000  0.44556100  1.0