# generated using pymatgen
data_Sr3MgTi2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.93292836
_cell_length_b   3.93292797
_cell_length_c   12.04067309
_cell_angle_alpha   99.39956499
_cell_angle_beta   99.39956327
_cell_angle_gamma   90.00000293
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr3MgTi2O7
_chemical_formula_sum   'Sr3 Mg1 Ti2 O7'
_cell_volume   181.20845898
_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  0.34277200  0.34277200  0.68554500  1.0
  Sr  Sr1  1  0.50000000  0.50000000  0.00000000  1.0
  Sr  Sr2  1  0.65722800  0.65722800  0.31445500  1.0
  Mg  Mg3  1  0.75000000  0.25000000  0.50000000  1.0
  Ti  Ti4  1  0.08242100  0.08242100  0.16484100  1.0
  Ti  Ti5  1  0.91757900  0.91757900  0.83515900  1.0
  O  O6  1  0.90984800  0.40984800  0.81969600  1.0
  O  O7  1  0.79112100  0.79112100  0.58224200  1.0
  O  O8  1  0.00000000  0.00000000  0.00000000  1.0
  O  O9  1  0.59015200  0.09015200  0.18030400  1.0
  O  O10  1  0.08921000  0.58921000  0.17842100  1.0
  O  O11  1  0.41079000  0.91079000  0.82157900  1.0
  O  O12  1  0.20887900  0.20887900  0.41775800  1.0