data_[Li5Ti7In1P12O48]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ti  1.5400  1.4000  0.8517
  In  1.7800  1.5500  0.9400
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [8.6352]
_cell_length_b [8.6501]
_cell_length_c [14.9983]
_cell_angle_alpha [90.1694]
_cell_angle_beta [106.6495]
_cell_angle_gamma [119.7328]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li5Ti7In(PO4)12]
_chemical_formula_sum '[Li5 Ti7 In1 P12 O48]'
_cell_volume [917.7622]
_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  0.0016  0.5018  0.5007  1
  Li  Li1  1  0.0045  0.0096  0.0004  1
  Li  Li2  1  0.4930  0.2437  0.7453  1
  Li  Li3  1  0.5004  0.7512  0.2501  1
  Li  Li4  1  0.7510  0.5702  0.9306  1
  Ti  Ti5  1  0.1415  0.2871  0.4286  1
  Ti  Ti6  1  0.3489  0.4633  0.8183  1
  Ti  Ti7  1  0.3590  0.9631  0.3212  1
  Ti  Ti8  1  0.6394  0.0351  0.6755  1
  Ti  Ti9  1  0.6451  0.5391  0.1837  1
  Ti  Ti10  1  0.8577  0.7112  0.5704  1
  Ti  Ti11  1  0.8579  0.2094  0.0721  1
  In  In12  1  0.1506  0.7920  0.9292  1
  P  P13  1  0.0375  0.6618  0.1285  1
  P  P14  1  0.0407  0.1641  0.6245  1
  P  P15  1  0.2471  0.7711  0.7234  1
  P  P16  1  0.2511  0.2708  0.2308  1
  P  P17  1  0.4592  0.7286  0.4783  1
  P  P18  1  0.4645  0.2373  0.9823  1
  P  P19  1  0.5401  0.2711  0.5196  1
  P  P20  1  0.5540  0.7723  0.0232  1
  P  P21  1  0.7438  0.7279  0.7682  1
  P  P22  1  0.7491  0.2276  0.2707  1
  P  P23  1  0.9488  0.3267  0.8758  1
  P  P24  1  0.9607  0.8363  0.3759  1
  O  O25  1  0.0041  0.0292  0.4035  1
  O  O26  1  0.0241  0.7577  0.0422  1
  O  O27  1  0.0596  0.2719  0.5425  1
  O  O28  1  0.0843  0.6849  0.6273  1
  O  O29  1  0.0862  0.1950  0.1364  1
  O  O30  1  0.1259  0.3615  0.8501  1
  O  O31  1  0.1259  0.8505  0.3479  1
  O  O32  1  0.1913  0.8239  0.7993  1
  O  O33  1  0.1940  0.3097  0.3129  1
  O  O34  1  0.2293  0.2633  0.7094  1
  O  O35  1  0.2319  0.7668  0.2068  1
  O  O36  1  0.2693  0.0765  0.9741  1
  O  O37  1  0.2710  0.5550  0.4709  1
  O  O38  1  0.3042  0.6271  0.7506  1
  O  O39  1  0.3060  0.1263  0.2517  1
  O  O40  1  0.3757  0.3060  0.4986  1
  O  O41  1  0.3977  0.8115  0.0102  1
  O  O42  1  0.4133  0.9468  0.7113  1
  O  O43  1  0.4163  0.4517  0.2231  1
  O  O44  1  0.4431  0.7999  0.3838  1
  O  O45  1  0.4659  0.3180  0.8892  1
  O  O46  1  0.4988  0.1328  0.4375  1
  O  O47  1  0.5013  0.8689  0.5589  1
  O  O48  1  0.5136  0.6358  0.9391  1
  O  O49  1  0.5185  0.3823  0.0639  1
  O  O50  1  0.5580  0.2019  0.6146  1
  O  O51  1  0.5752  0.7005  0.1178  1
  O  O52  1  0.5812  0.5438  0.7783  1
  O  O53  1  0.5842  0.0464  0.2792  1
  O  O54  1  0.6228  0.1916  0.0025  1
  O  O55  1  0.6256  0.6951  0.5009  1
  O  O56  1  0.6809  0.8642  0.7423  1
  O  O57  1  0.6908  0.3690  0.2513  1
  O  O58  1  0.7290  0.4454  0.5279  1
  O  O59  1  0.7456  0.9451  0.0320  1
  O  O60  1  0.7650  0.2173  0.7907  1
  O  O61  1  0.7701  0.7376  0.2945  1
  O  O62  1  0.8047  0.1874  0.1880  1
  O  O63  1  0.8085  0.6896  0.6892  1
  O  O64  1  0.8766  0.1514  0.6520  1
  O  O65  1  0.8815  0.6449  0.1652  1
  O  O66  1  0.8946  0.8034  0.8676  1
  O  O67  1  0.9162  0.3059  0.3649  1
  O  O68  1  0.9409  0.2173  0.9574  1
  O  O69  1  0.9432  0.7297  0.4584  1
  O  O70  1  0.9603  0.5038  0.9027  1
  O  O71  1  0.9967  0.4701  0.0980  1
  O  O72  1  1.0000  0.9718  0.5976  1
]