# generated using pymatgen
data_Li3Sn(BO2)5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.84287100
_cell_length_b   7.23776596
_cell_length_c   9.62864731
_cell_angle_alpha   84.08012820
_cell_angle_beta   76.43602940
_cell_angle_gamma   72.18680543
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Sn(BO2)5
_chemical_formula_sum   'Li6 Sn2 B10 O20'
_cell_volume   441.09981988
_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
  Li  Li0  1  0.15011200  0.57231800  0.26921300  1
  Li  Li1  1  0.73933200  0.01808500  0.16884500  1
  Li  Li2  1  0.04385100  0.17220700  0.47300800  1
  Li  Li3  1  0.95614900  0.82779300  0.52699200  1
  Li  Li4  1  0.26066800  0.98191500  0.83115500  1
  Li  Li5  1  0.84988800  0.42768200  0.73078700  1
  Sn  Sn6  1  0.22962500  0.53505400  0.86369300  1
  Sn  Sn7  1  0.77037500  0.46494600  0.13630700  1
  B  B8  1  0.25516200  0.85395000  0.09505600  1
  B  B9  1  0.34809200  0.90595600  0.32103500  1
  B  B10  1  0.34799900  0.77958100  0.57535800  1
  B  B11  1  0.20381900  0.18531200  0.15805400  1
  B  B12  1  0.68626800  0.74547100  0.40836700  1
  B  B13  1  0.31373200  0.25452900  0.59163300  1
  B  B14  1  0.79618100  0.81468800  0.84194600  1
  B  B15  1  0.65200100  0.22041900  0.42464200  1
  B  B16  1  0.65190800  0.09404400  0.67896500  1
  B  B17  1  0.74483800  0.14605000  0.90494400  1
  O  O18  1  0.21496700  0.74955700  0.00339600  1
  O  O19  1  0.23825300  0.87507600  0.47012300  1
  O  O20  1  0.30048900  0.78248100  0.22583000  1
  O  O21  1  0.23626900  0.78361400  0.71226100  1
  O  O22  1  0.11607000  0.38013800  0.13513000  1
  O  O23  1  0.57547300  0.86455300  0.30898300  1
  O  O24  1  0.10607000  0.30151000  0.61300000  1
  O  O25  1  0.74369900  0.88504300  0.71352400  1
  O  O26  1  0.56230100  0.68770200  0.53571800  1
  O  O27  1  0.75995700  0.94921300  0.94791500  1
  O  O28  1  0.24004300  0.05078700  0.05208500  1
  O  O29  1  0.43769900  0.31229800  0.46428200  1
  O  O30  1  0.25630100  0.11495700  0.28647600  1
  O  O31  1  0.89393000  0.69849000  0.38700000  1
  O  O32  1  0.42452700  0.13544700  0.69101700  1
  O  O33  1  0.88393000  0.61986200  0.86487000  1
  O  O34  1  0.76373100  0.21638600  0.28773900  1
  O  O35  1  0.69951100  0.21751900  0.77417000  1
  O  O36  1  0.76174700  0.12492400  0.52987700  1
  O  O37  1  0.78503300  0.25044300  0.99660400  1
