data_[Na2Li10Mn4P4C4O28]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Li  0.9800  1.4500  0.9000
  Mn  1.5500  1.4000  0.6483
  P  2.1900  1.0000  0.5500
  C  2.5500  0.7000  0.3000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1]
_cell_length_a [8.6338]
_cell_length_b [6.6823]
_cell_length_c [9.9974]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.3948]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [4]
_chemical_formula_structural [NaLi5Mn2P2(CO7)2]
_chemical_formula_sum '[Na2 Li10 Mn4 P4 C4 O28]'
_cell_volume [576.2824]
_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
[
  Na  Na0  2  0.2481  0.0019  0.6237  1
  Li  Li1  2  0.0843  0.7448  0.8806  1
  Li  Li2  2  0.0907  0.7496  0.3759  1
  Li  Li3  2  0.2655  0.9705  0.1325  1
  Li  Li4  2  0.2667  0.5321  0.1343  1
  Li  Li5  2  0.2697  0.5248  0.6351  1
  Mn  Mn6  2  0.3508  0.2538  0.8672  1
  Mn  Mn7  2  0.3539  0.2522  0.3572  1
  P  P8  2  0.4062  0.7500  0.8979  1
  P  P9  2  0.4084  0.7510  0.3911  1
  C  C10  2  0.0378  0.2501  0.8863  1
  C  C11  2  0.0430  0.2413  0.3881  1
  O  O12  2  0.0785  0.2481  0.2631  1
  O  O13  2  0.0791  0.2442  0.7634  1
  O  O14  2  0.0990  0.7185  0.5769  1
  O  O15  2  0.1082  0.7515  0.0847  1
  O  O16  2  0.1416  0.2549  0.9845  1
  O  O17  2  0.1519  0.2587  0.4815  1
  O  O18  2  0.3032  0.9329  0.3494  1
  O  O19  2  0.3074  0.5704  0.8440  1
  O  O20  2  0.3137  0.9377  0.8515  1
  O  O21  2  0.3181  0.5676  0.3320  1
  O  O22  2  0.4169  0.7452  0.0548  1
  O  O23  2  0.4220  0.7327  0.5470  1
  O  O24  2  0.4240  0.2448  0.1497  1
  O  O25  2  0.4256  0.2708  0.6604  1
]