# generated using pymatgen
data_Sr3MgIrO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.69332711
_cell_length_b   6.69332605
_cell_length_c   6.69332715
_cell_angle_alpha   92.38207594
_cell_angle_beta   92.38205499
_cell_angle_gamma   92.38204907
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr3MgIrO6
_chemical_formula_sum   'Sr6 Mg2 Ir2 O12'
_cell_volume   299.06560377
_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
  Sr  Sr0  1  0.61502289  0.24999909  0.88497886  1.0
  Sr  Sr1  1  0.88497876  0.61502267  0.24999892  1.0
  Sr  Sr2  1  0.75000111  0.11502138  0.38497730  1.0
  Sr  Sr3  1  0.38497711  0.75000091  0.11502114  1.0
  Sr  Sr4  1  0.11502124  0.38497733  0.75000108  1.0
  Sr  Sr5  1  0.24999889  0.88497862  0.61502270  1.0
  Mg  Mg6  1  0.25000020  0.25000062  0.25000072  1.0
  Mg  Mg7  1  0.74999980  0.74999938  0.74999928  1.0
  Ir  Ir8  1  -0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir9  1  0.50000000  0.50000000  0.50000000  1.0
  O  O10  1  0.59592152  0.78758267  0.46396777  1.0
  O  O11  1  0.46396770  0.59592139  0.78758258  1.0
  O  O12  1  0.78758273  0.46396773  0.59592158  1.0
  O  O13  1  0.90407951  0.03603250  0.71241435  1.0
  O  O14  1  0.71241443  0.90407935  0.03603271  1.0
  O  O15  1  0.03603271  0.71241431  0.90407896  1.0
  O  O16  1  0.40407848  0.21241733  0.53603223  1.0
  O  O17  1  0.53603230  0.40407861  0.21241742  1.0
  O  O18  1  0.21241727  0.53603227  0.40407842  1.0
  O  O19  1  0.09592049  0.96396750  0.28758565  1.0
  O  O20  1  0.96396729  0.28758569  0.09592104  1.0
  O  O21  1  0.28758557  0.09592065  0.96396729  1.0