# generated using pymatgen
data_LiSm3Bi(Ru2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.38723131
_cell_length_b   7.40000188
_cell_length_c   7.40519628
_cell_angle_alpha   89.99427139
_cell_angle_beta   60.07057833
_cell_angle_gamma   120.05227755
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiSm3Bi(Ru2O7)2
_chemical_formula_sum   'Li1 Sm3 Bi1 Ru4 O14'
_cell_volume   286.30768250
_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
  Li  Li0  1  0.27509100  0.63790300  0.63800700  1
  Sm  Sm1  1  0.24817100  0.36790800  0.35298600  1
  Sm  Sm2  1  0.24810700  0.88061800  0.35245800  1
  Sm  Sm3  1  0.73785500  0.36865200  0.38571400  1
  Bi  Bi4  1  0.72626300  0.36378400  0.87856300  1
  Ru  Ru5  1  0.75778500  0.87912400  0.36470500  1
  Ru  Ru6  1  0.24314300  0.87637000  0.87930900  1
  Ru  Ru7  1  0.24308400  0.36716600  0.87928100  1
  Ru  Ru8  1  0.75561500  0.87807100  0.87443500  1
  O  O9  1  0.50147300  0.25086800  0.25314300  1
  O  O10  1  0.01396700  0.50721600  0.49977700  1
  O  O11  1  0.92325700  0.96187200  0.53540400  1
  O  O12  1  0.49033300  0.53829900  0.53845000  1
  O  O13  1  0.49058000  0.95276200  0.53842400  1
  O  O14  1  0.09921600  0.54978000  0.94881200  1
  O  O15  1  0.50165900  0.96262700  0.95526400  1
  O  O16  1  0.50153500  0.53922000  0.95559400  1
  O  O17  1  0.58648300  0.79348100  0.20454300  1
  O  O18  1  0.99626800  0.20902500  0.20924200  1
  O  O19  1  0.99600800  0.78757700  0.20917800  1
  O  O20  1  0.41535100  0.20797400  0.79283800  1
  O  O21  1  0.99476400  0.79859600  0.80742200  1
  O  O22  1  0.99506200  0.19610900  0.80756200  1
