# generated using pymatgen
data_Sr2MgNiIrO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.79434144
_cell_length_b   5.96273829
_cell_length_c   5.25372928
_cell_angle_alpha   106.12548737
_cell_angle_beta   120.46923617
_cell_angle_gamma   109.00445685
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2MgNiIrO6
_chemical_formula_sum   'Sr2 Mg1 Ni1 Ir1 O6'
_cell_volume   145.60233767
_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
  Sr  Sr0  1  0.79430742  0.19210171  0.49155510  1.0
  Sr  Sr1  1  0.20569258  0.80789829  0.50844490  1.0
  Mg  Mg2  1  0.50000000  0.50000000  0.50000000  1.0
  Ni  Ni3  1  -0.00000000  -0.00000000  -0.00000000  1.0
  Ir  Ir4  1  0.50000000  0.50000000  -0.00000000  1.0
  O  O5  1  0.17506920  0.31099295  0.47463263  1.0
  O  O6  1  0.82493080  0.68900705  0.52536737  1.0
  O  O7  1  0.34801067  0.17338978  0.05650617  1.0
  O  O8  1  0.65198933  0.82661022  0.94349383  1.0
  O  O9  1  0.66963565  0.35604030  0.84674431  1.0
  O  O10  1  0.33036435  0.64395970  0.15325569  1.0