data_[Li1Mn2Ge1O6]
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
  Ge  2.0100  1.2500  0.7700
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.9390]
_cell_length_b [5.0003]
_cell_length_c [5.3284]
_cell_angle_alpha [64.1447]
_cell_angle_beta [89.6372]
_cell_angle_gamma [60.9968]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [LiMn2GeO6]
_chemical_formula_sum '[Li1 Mn2 Ge1 O6]'
_cell_volume [99.9907]
_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  0.7929  0.4140  0.4001  1.0
  Mn  Mn1  1  0.0095  0.9766  0.0331  1.0
  Mn  Mn2  1  0.5201  0.9550  0.5572  1.0
  Ge  Ge3  1  0.3166  0.3610  0.9625  1.0
  O  O4  1  0.1163  0.5046  0.2296  1.0
  O  O5  1  0.2459  0.8193  0.7733  1.0
  O  O6  1  0.3851  0.8946  0.2424  1.0
  O  O7  1  0.6081  0.1594  0.7691  1.0
  O  O8  1  0.7177  0.1519  0.2446  1.0
  O  O9  1  0.9494  0.4403  0.7729  1.0
]