# generated using pymatgen
data_Li3Sm3(TeO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.91465673
_cell_length_b   10.91465673
_cell_length_c   10.91465673
_cell_angle_alpha   109.47122063
_cell_angle_beta   109.47122063
_cell_angle_gamma   109.47122063
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Sm3(TeO6)2
_chemical_formula_sum   'Li12 Sm12 Te8 O48'
_cell_volume   1000.94071114
_cell_formula_units_Z   4
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  0.25000000  0.62500000  0.37500000  1
  Li  Li1  1  0.75000000  0.37500000  0.62500000  1
  Li  Li2  1  0.75000000  0.87500000  0.12500000  1
  Li  Li3  1  0.37500000  0.25000000  0.62500000  1
  Li  Li4  1  0.62500000  0.75000000  0.37500000  1
  Li  Li5  1  0.25000000  0.12500000  0.87500000  1
  Li  Li6  1  0.12500000  0.75000000  0.87500000  1
  Li  Li7  1  0.87500000  0.25000000  0.12500000  1
  Li  Li8  1  0.62500000  0.37500000  0.25000000  1
  Li  Li9  1  0.37500000  0.62500000  0.75000000  1
  Li  Li10  1  0.87500000  0.12500000  0.75000000  1
  Li  Li11  1  0.12500000  0.87500000  0.25000000  1
  Sm  Sm12  1  0.25000000  0.37500000  0.12500000  1
  Sm  Sm13  1  0.75000000  0.62500000  0.87500000  1
  Sm  Sm14  1  0.75000000  0.12500000  0.37500000  1
  Sm  Sm15  1  0.12500000  0.25000000  0.37500000  1
  Sm  Sm16  1  0.37500000  0.75000000  0.12500000  1
  Sm  Sm17  1  0.25000000  0.87500000  0.62500000  1
  Sm  Sm18  1  0.87500000  0.75000000  0.62500000  1
  Sm  Sm19  1  0.62500000  0.25000000  0.87500000  1
  Sm  Sm20  1  0.37500000  0.12500000  0.25000000  1
  Sm  Sm21  1  0.62500000  0.87500000  0.75000000  1
  Sm  Sm22  1  0.12500000  0.37500000  0.75000000  1
  Sm  Sm23  1  0.87500000  0.62500000  0.25000000  1
  Te  Te24  1  0.00000000  0.00000000  0.00000000  1
  Te  Te25  1  0.50000000  0.00000000  0.50000000  1
  Te  Te26  1  0.00000000  0.50000000  0.50000000  1
  Te  Te27  1  0.50000000  0.00000000  0.00000000  1
  Te  Te28  1  0.50000000  0.50000000  0.00000000  1
  Te  Te29  1  0.50000000  0.50000000  0.50000000  1
  Te  Te30  1  0.00000000  0.00000000  0.50000000  1
  Te  Te31  1  0.00000000  0.50000000  0.00000000  1
  O  O32  1  0.47538200  0.38213500  0.30417200  1
  O  O33  1  0.52461800  0.61786500  0.69582800  1
  O  O34  1  0.57796200  0.17121000  0.19582800  1
  O  O35  1  0.92203800  0.11786500  0.59324700  1
  O  O36  1  0.30417200  0.47538200  0.38213500  1
  O  O37  1  0.32879000  0.92203800  0.30417200  1
  O  O38  1  0.42203800  0.82879000  0.80417200  1
  O  O39  1  0.07796200  0.88213500  0.40675300  1
  O  O40  1  0.69582800  0.52461800  0.61786500  1
  O  O41  1  0.67121000  0.07796200  0.69582800  1
  O  O42  1  0.02461800  0.32879000  0.90675300  1
  O  O43  1  0.19582800  0.57796200  0.17121000  1
  O  O44  1  0.11786500  0.02461800  0.19582800  1
  O  O45  1  0.97538200  0.67121000  0.09324700  1
  O  O46  1  0.80417200  0.42203800  0.82879000  1
  O  O47  1  0.88213500  0.97538200  0.80417200  1
  O  O48  1  0.59324700  0.92203800  0.11786500  1
  O  O49  1  0.17121000  0.47538200  0.59324700  1
  O  O50  1  0.40675300  0.07796200  0.88213500  1
  O  O51  1  0.82879000  0.52461800  0.40675300  1
  O  O52  1  0.90675300  0.02461800  0.32879000  1
  O  O53  1  0.38213500  0.57796200  0.90675300  1
  O  O54  1  0.09324700  0.97538200  0.67121000  1
  O  O55  1  0.61786500  0.42203800  0.09324700  1
  O  O56  1  0.38213500  0.30417200  0.47538200  1
  O  O57  1  0.57796200  0.90675300  0.38213500  1
  O  O58  1  0.61786500  0.69582800  0.52461800  1
  O  O59  1  0.42203800  0.09324700  0.61786500  1
  O  O60  1  0.11786500  0.59324700  0.92203800  1
  O  O61  1  0.02461800  0.19582800  0.11786500  1
  O  O62  1  0.88213500  0.40675300  0.07796200  1
  O  O63  1  0.97538200  0.80417200  0.88213500  1
  O  O64  1  0.32879000  0.90675300  0.02461800  1
  O  O65  1  0.92203800  0.30417200  0.32879000  1
  O  O66  1  0.67121000  0.09324700  0.97538200  1
  O  O67  1  0.07796200  0.69582800  0.67121000  1
  O  O68  1  0.17121000  0.19582800  0.57796200  1
  O  O69  1  0.47538200  0.59324700  0.17121000  1
  O  O70  1  0.82879000  0.80417200  0.42203800  1
  O  O71  1  0.52461800  0.40675300  0.82879000  1
  O  O72  1  0.30417200  0.32879000  0.92203800  1
  O  O73  1  0.69582800  0.67121000  0.07796200  1
  O  O74  1  0.19582800  0.11786500  0.02461800  1
  O  O75  1  0.80417200  0.88213500  0.97538200  1
  O  O76  1  0.90675300  0.38213500  0.57796200  1
  O  O77  1  0.09324700  0.61786500  0.42203800  1
  O  O78  1  0.59324700  0.17121000  0.47538200  1
  O  O79  1  0.40675300  0.82879000  0.52461800  1
