# generated using pymatgen
data_Ba3La5Tl2(Cu2O9)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.12877024
_cell_length_b   16.12877024
_cell_length_c   5.42915100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   160.61106028
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3La5Tl2(Cu2O9)2
_chemical_formula_sum   'Ba3 La5 Tl2 Cu4 O18'
_cell_volume   468.86207609
_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
  Ba  Ba0  1  0.91678200  0.08321800  0.50000000  1.0
  Ba  Ba1  1  0.08359000  0.91641000  0.50000000  1.0
  Ba  Ba2  1  0.58247500  0.41752500  0.00000000  1.0
  La  La3  1  0.79672900  0.20327100  0.50000000  1.0
  La  La4  1  0.29608900  0.70391100  0.00000000  1.0
  La  La5  1  0.70425500  0.29574500  0.00000000  1.0
  La  La6  1  0.20428600  0.79571400  0.50000000  1.0
  La  La7  1  0.41310900  0.58689100  0.00000000  1.0
  Tl  Tl8  1  0.49814100  0.50185900  0.50000000  1.0
  Tl  Tl9  1  0.99832900  0.00167100  0.00000000  1.0
  Cu  Cu10  1  0.85356700  0.14643300  0.00000000  1.0
  Cu  Cu11  1  0.35350500  0.64649500  0.50000000  1.0
  Cu  Cu12  1  0.64778900  0.35221100  0.50000000  1.0
  Cu  Cu13  1  0.14860200  0.85139800  0.00000000  1.0
  O  O14  1  0.93126800  0.06873200  0.00000000  1.0
  O  O15  1  0.43128200  0.56871800  0.50000000  1.0
  O  O16  1  0.56406200  0.43593800  0.50000000  1.0
  O  O17  1  0.06442900  0.93557100  0.00000000  1.0
  O  O18  1  0.77921800  0.22078200  0.00000000  1.0
  O  O19  1  0.27897000  0.72103000  0.50000000  1.0
  O  O20  1  0.72516100  0.27483900  0.50000000  1.0
  O  O21  1  0.22270100  0.77729900  0.00000000  1.0
  O  O22  1  0.11244500  0.40585800  0.75744600  1.0
  O  O23  1  0.59414200  0.88755500  0.24255400  1.0
  O  O24  1  0.59414200  0.88755500  0.75744600  1.0
  O  O25  1  0.11244500  0.40585800  0.24255400  1.0
  O  O26  1  0.40336900  0.10119200  0.74951600  1.0
  O  O27  1  0.89880800  0.59663100  0.25048400  1.0
  O  O28  1  0.89880800  0.59663100  0.74951600  1.0
  O  O29  1  0.40336900  0.10119200  0.25048400  1.0
  O  O30  1  0.48861200  0.51138800  0.00000000  1.0
  O  O31  1  0.99951800  0.00048200  0.50000000  1.0