data_[Li6Mn4Si4O16]
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
  Si  1.9000  1.1000  0.5400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.7349]
_cell_length_b [7.2191]
_cell_length_c [7.2916]
_cell_angle_alpha [97.5944]
_cell_angle_beta [91.5992]
_cell_angle_gamma [90.2753]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li3Mn2(SiO4)2]
_chemical_formula_sum '[Li6 Mn4 Si4 O16]'
_cell_volume [351.2540]
_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  0.0187  0.8550  0.6545  1
  Li  Li1  1  0.2304  0.1674  0.8104  1
  Li  Li2  1  0.2338  0.6709  0.3347  1
  Li  Li3  1  0.4866  0.3846  0.5954  1
  Li  Li4  1  0.5194  0.9185  0.0987  1
  Li  Li5  1  0.9907  0.3228  0.1536  1
  Mn  Mn6  1  0.4891  0.3493  0.1756  1
  Mn  Mn7  1  0.5231  0.8001  0.6321  1
  Mn  Mn8  1  0.9624  0.4242  0.6025  1
  Mn  Mn9  1  0.9981  0.8769  0.0520  1
  Si  Si10  1  0.2406  0.0813  0.4025  1
  Si  Si11  1  0.2469  0.5977  0.9209  1
  Si  Si12  1  0.7473  0.1564  0.8414  1
  Si  Si13  1  0.7638  0.6869  0.3438  1
  O  O14  1  0.0280  0.6577  0.8330  1
  O  O15  1  0.0458  0.0709  0.2532  1
  O  O16  1  0.2141  0.2620  0.5656  1
  O  O17  1  0.2438  0.3949  0.9995  1
  O  O18  1  0.2552  0.8936  0.5113  1
  O  O19  1  0.2685  0.7653  0.0983  1
  O  O20  1  0.4142  0.6092  0.7663  1
  O  O21  1  0.4406  0.1165  0.2918  1
  O  O22  1  0.5463  0.5853  0.3932  1
  O  O23  1  0.5559  0.0017  0.8328  1
  O  O24  1  0.7299  0.2754  0.6677  1
  O  O25  1  0.7346  0.2900  0.0381  1
  O  O26  1  0.7530  0.7714  0.1489  1
  O  O27  1  0.7702  0.8490  0.5268  1
  O  O28  1  0.9579  0.5503  0.3592  1
  O  O29  1  0.9666  0.0494  0.8546  1
]