data_[Li1Mn2Sn1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mn  1.5500  1.4000  0.6483
  Sn  1.9600  1.4500  0.8300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.0983]
_cell_length_b [5.1844]
_cell_length_c [5.4106]
_cell_angle_alpha [63.3525]
_cell_angle_beta [89.7281]
_cell_angle_gamma [61.2546]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [LiMn2SnO6]
_chemical_formula_sum '[Li1 Mn2 Sn1 O6]'
_cell_volume [107.9331]
_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  0.8002  0.4034  0.4099  1.0
  Mn  Mn1  1  0.0122  0.9711  0.0414  1.0
  Mn  Mn2  1  0.5209  0.9572  0.5515  1.0
  Sn  Sn3  1  0.3100  0.3783  0.9362  1.0
  O  O4  1  0.1218  0.5100  0.2416  1.0
  O  O5  1  0.2424  0.8564  0.7658  1.0
  O  O6  1  0.3768  0.8901  0.2519  1.0
  O  O7  1  0.6333  0.1330  0.7624  1.0
  O  O8  1  0.7327  0.1306  0.2546  1.0
  O  O9  1  0.9113  0.4466  0.7694  1.0
]