data_[Li4Cr1Co2Ni3P6O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cr  1.6600  1.4000  0.9400
  Co  1.8800  1.3500  0.7683
  Ni  1.9100  1.3500  0.7400
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [8.3542]
_cell_length_b [8.4720]
_cell_length_c [8.4725]
_cell_angle_alpha [62.9948]
_cell_angle_beta [63.2250]
_cell_angle_gamma [63.1919]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li4CrCo2Ni3(PO4)6]
_chemical_formula_sum '[Li4 Cr1 Co2 Ni3 P6 O24]'
_cell_volume [453.5142]
_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  0.1467  0.7280  0.3556  1
  Li  Li1  1  0.2519  0.6455  0.8534  1
  Li  Li2  1  0.3564  0.1463  0.7301  1
  Li  Li3  1  0.7294  0.3544  0.1487  1
  Cr  Cr4  1  0.1441  0.1442  0.1473  1
  Co  Co5  1  0.5105  0.5021  0.4959  1
  Co  Co6  1  0.9865  0.0035  0.9975  1
  Ni  Ni7  1  0.3543  0.3506  0.3537  1
  Ni  Ni8  1  0.6424  0.6453  0.6443  1
  Ni  Ni9  1  0.8580  0.8546  0.8540  1
  P  P10  1  0.0533  0.4557  0.7530  1
  P  P11  1  0.2509  0.9503  0.5509  1
  P  P12  1  0.4477  0.7504  0.0449  1
  P  P13  1  0.5536  0.2493  0.9508  1
  P  P14  1  0.7518  0.0463  0.4553  1
  P  P15  1  0.9473  0.5505  0.2527  1
  O  O16  1  0.0404  0.6035  0.8174  1
  O  O17  1  0.0730  0.2533  0.9076  1
  O  O18  1  0.1004  0.9262  0.7495  1
  O  O19  1  0.1018  0.5215  0.3235  1
  O  O20  1  0.1846  0.9889  0.3908  1
  O  O21  1  0.2447  0.9070  0.0774  1
  O  O22  1  0.2528  0.4279  0.5968  1
  O  O23  1  0.3189  0.1031  0.5247  1
  O  O24  1  0.3917  0.1793  0.9938  1
  O  O25  1  0.3985  0.7505  0.5699  1
  O  O26  1  0.4325  0.5965  0.2436  1
  O  O27  1  0.4556  0.6906  0.8960  1
  O  O28  1  0.5272  0.3143  0.1057  1
  O  O29  1  0.5484  0.4109  0.7629  1
  O  O30  1  0.5990  0.2468  0.4320  1
  O  O31  1  0.6104  0.8134  0.9964  1
  O  O32  1  0.6869  0.8919  0.4859  1
  O  O33  1  0.7491  0.0960  0.9289  1
  O  O34  1  0.7503  0.5666  0.4023  1
  O  O35  1  0.8213  0.0135  0.6070  1
  O  O36  1  0.8889  0.4987  0.6949  1
  O  O37  1  0.9046  0.0738  0.2514  1
  O  O38  1  0.9465  0.7381  0.0880  1
  O  O39  1  0.9876  0.3880  0.1886  1
]