# generated using pymatgen
data_Sr2TiCu2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.14983174
_cell_length_b   13.14983174
_cell_length_c   13.14983174
_cell_angle_alpha   157.39465762
_cell_angle_beta   156.85069448
_cell_angle_gamma   32.57813768
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2TiCu2O7
_chemical_formula_sum   'Sr4 Ti2 Cu4 O14'
_cell_volume   343.31543795
_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  0.63258800  0.62430400  0.96951000  1.0
  Sr  Sr1  1  0.36741200  0.33692200  0.99171600  1.0
  Sr  Sr2  1  0.15479400  0.12430400  0.99171600  1.0
  Sr  Sr3  1  0.84520600  0.83692200  0.96951000  1.0
  Ti  Ti4  1  0.17919900  0.79513900  0.47433900  1.0
  Ti  Ti5  1  0.82080100  0.29513900  0.61594000  1.0
  Cu  Cu6  1  0.56274200  0.03833300  0.48057600  1.0
  Cu  Cu7  1  0.43725800  0.91783500  0.47559100  1.0
  Cu  Cu8  1  0.05775600  0.53833300  0.47559100  1.0
  Cu  Cu9  1  0.94224400  0.41783500  0.48057600  1.0
  O  O10  1  0.84914600  0.65987200  0.00901800  1.0
  O  O11  1  0.15085400  0.15987200  0.81072600  1.0
  O  O12  1  0.32567900  0.30329800  0.47921100  1.0
  O  O13  1  0.67432100  0.15353200  0.97762000  1.0
  O  O14  1  0.32408700  0.80329800  0.97762000  1.0
  O  O15  1  0.67591300  0.65353200  0.47921100  1.0
  O  O16  1  0.82757000  0.80524100  0.47839300  1.0
  O  O17  1  0.17243000  0.65082400  0.97767100  1.0
  O  O18  1  0.82684800  0.30524100  0.97767100  1.0
  O  O19  1  0.17315200  0.15082400  0.47839300  1.0
  O  O20  1  0.23087800  0.64212000  0.50143100  1.0
  O  O21  1  0.76912200  0.27055400  0.41124200  1.0
  O  O22  1  0.64068900  0.14212000  0.41124200  1.0
  O  O23  1  0.35931100  0.77055400  0.50143100  1.0