# generated using pymatgen
data_Ba4Sm2Cu2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.05105200
_cell_length_b   12.05105200
_cell_length_c   3.89166400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba4Sm2Cu2O9
_chemical_formula_sum   'Ba8 Sm4 Cu4 O18'
_cell_volume   565.17801240
_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
  Ba  Ba0  1  0.17198800  0.11327100  0.25910100  1.0
  Ba  Ba1  1  0.61327100  0.67198800  0.24089900  1.0
  Ba  Ba2  1  0.82801200  0.88672900  0.25910100  1.0
  Ba  Ba3  1  0.88672900  0.17198800  0.74089900  1.0
  Ba  Ba4  1  0.11327100  0.82801200  0.74089900  1.0
  Ba  Ba5  1  0.32801200  0.61327100  0.75910100  1.0
  Ba  Ba6  1  0.67198800  0.38672900  0.75910100  1.0
  Ba  Ba7  1  0.38672900  0.32801200  0.24089900  1.0
  Sm  Sm8  1  0.38953100  0.88953100  0.25000000  1.0
  Sm  Sm9  1  0.61046900  0.11046900  0.25000000  1.0
  Sm  Sm10  1  0.88953100  0.61046900  0.75000000  1.0
  Sm  Sm11  1  0.11046900  0.38953100  0.75000000  1.0
  Cu  Cu12  1  0.40319400  0.09680600  0.75000000  1.0
  Cu  Cu13  1  0.09680600  0.59680600  0.25000000  1.0
  Cu  Cu14  1  0.59680600  0.90319400  0.75000000  1.0
  Cu  Cu15  1  0.90319400  0.40319400  0.25000000  1.0
  O  O16  1  0.97504600  0.70808200  0.24969800  1.0
  O  O17  1  0.29191800  0.97504600  0.75030200  1.0
  O  O18  1  0.20808200  0.47504600  0.25030200  1.0
  O  O19  1  0.24275200  0.25724800  0.75000000  1.0
  O  O20  1  0.79191800  0.52495400  0.25030200  1.0
  O  O21  1  0.74275200  0.24275200  0.25000000  1.0
  O  O22  1  0.25724800  0.75724800  0.25000000  1.0
  O  O23  1  0.70808200  0.02495400  0.75030200  1.0
  O  O24  1  0.59093600  0.90906400  0.25000000  1.0
  O  O25  1  0.40906400  0.09093600  0.25000000  1.0
  O  O26  1  0.00000000  0.00000000  0.50000000  1.0
  O  O27  1  0.90906400  0.40906400  0.75000000  1.0
  O  O28  1  0.52495400  0.20808200  0.74969800  1.0
  O  O29  1  0.09093600  0.59093600  0.75000000  1.0
  O  O30  1  0.50000000  0.50000000  0.00000000  1.0
  O  O31  1  0.75724800  0.74275200  0.75000000  1.0
  O  O32  1  0.47504600  0.79191800  0.74969800  1.0
  O  O33  1  0.02495400  0.29191800  0.24969800  1.0