# generated using pymatgen
data_Sr2YTlNi2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.85770100
_cell_length_b   3.85766600
_cell_length_c   12.05840700
_cell_angle_alpha   90.00003386
_cell_angle_beta   90.00004396
_cell_angle_gamma   90.00579243
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2YTlNi2O7
_chemical_formula_sum   'Sr2 Y1 Tl1 Ni2 O7'
_cell_volume   179.44986011
_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  0.50000000  0.50000000  0.78912300  1.0
  Sr  Sr1  1  0.50000000  0.50000100  0.21089200  1.0
  Y  Y2  1  0.49999900  0.49999800  0.49999700  1.0
  Tl  Tl3  1  0.00000000  0.00000300  0.00000700  1.0
  Ni  Ni4  1  0.99999800  0.00000000  0.64942700  1.0
  Ni  Ni5  1  0.00000100  0.00000000  0.35056600  1.0
  O  O6  1  0.49999900  0.99999900  0.62016000  1.0
  O  O7  1  0.99999900  0.49999800  0.62015400  1.0
  O  O8  1  0.50000000  0.99999900  0.37983000  1.0
  O  O9  1  0.99999900  0.50000000  0.37983700  1.0
  O  O10  1  0.00000500  0.99999900  0.81970400  1.0
  O  O11  1  0.00000000  0.00000400  0.18030000  1.0
  O  O12  1  0.50000000  0.50000100  0.00000400  1.0