data_[Na6La3Nb1Si2P4O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  La  1.1000  1.9500  1.1720
  Nb  1.6000  1.4500  0.8200
  Si  1.9000  1.1000  0.5400
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [9.4769]
_cell_length_b [9.5296]
_cell_length_c [9.5380]
_cell_angle_alpha [90.4529]
_cell_angle_beta [119.5462]
_cell_angle_gamma [119.3915]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Na6La3NbSi2(PO6)4]
_chemical_formula_sum '[Na6 La3 Nb1 Si2 P4 O24]'
_cell_volume [616.4039]
_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
[
  Na  Na0  1  0.0036  0.5045  0.0010  1
  Na  Na1  1  0.0063  0.9948  0.4971  1
  Na  Na2  1  0.1699  0.7634  0.7561  1
  Na  Na3  1  0.1964  0.9166  0.2922  1
  Na  Na4  1  0.8006  0.0637  0.6961  1
  Na  Na5  1  0.8242  0.2582  0.2497  1
  La  La6  1  0.3042  0.6389  0.4364  1
  La  La7  1  0.3072  0.1622  0.9460  1
  La  La8  1  0.6953  0.3565  0.5593  1
  Nb  Nb9  1  0.6911  0.8448  0.0501  1
  Si  Si10  1  0.5075  0.9459  0.2432  1
  Si  Si11  1  0.5089  0.0471  0.7481  1
  P  P12  1  0.1559  0.2170  0.2301  1
  P  P13  1  0.2039  0.4663  0.7539  1
  P  P14  1  0.8074  0.7525  0.7717  1
  P  P15  1  0.8115  0.5736  0.2559  1
  O  O16  1  0.0668  0.4854  0.7840  1
  O  O17  1  0.1168  0.3551  0.2396  1
  O  O18  1  0.1488  0.1822  0.0695  1
  O  O19  1  0.1689  0.4924  0.5842  1
  O  O20  1  0.1708  0.2916  0.7533  1
  O  O21  1  0.3350  0.0468  0.7447  1
  O  O22  1  0.3411  0.7717  0.2405  1
  O  O23  1  0.3496  0.2523  0.3902  1
  O  O24  1  0.4013  0.9983  0.0807  1
  O  O25  1  0.4072  0.9057  0.5729  1
  O  O26  1  0.4273  0.6206  0.9041  1
  O  O27  1  0.6089  0.6907  0.6057  1
  O  O28  1  0.6102  0.9721  0.9118  1
  O  O29  1  0.6203  0.4090  0.1106  1
  O  O30  1  0.6556  0.9132  0.2180  1
  O  O31  1  0.6572  0.1134  0.4196  1
  O  O32  1  0.6937  0.2271  0.7741  1
  O  O33  1  0.8007  0.8019  0.9259  1
  O  O34  1  0.8102  0.7348  0.2260  1
  O  O35  1  0.8370  0.5620  0.4285  1
  O  O36  1  0.8465  0.6122  0.7872  1
  O  O37  1  0.9658  0.9116  0.7652  1
  O  O38  1  0.9820  0.5928  0.2521  1
  O  O39  1  0.9847  0.0512  0.2246  1
]