data_[Ti3Mn9Sb6P18O72]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Mn  1.5500  1.4000  0.6483
  Sb  2.0500  1.4500  0.8300
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [8.7287]
_cell_length_b [8.7287]
_cell_length_c [21.8917]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [TiMn3Sb2(PO4)6]
_chemical_formula_sum '[Ti3 Mn9 Sb6 P18 O72]'
_cell_volume [1444.4739]
_cell_formula_units_Z [3]
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
[
  Ti  Ti0  3  0.0000  0.0000  0.8537  1
  Mn  Mn1  3  0.0000  0.0000  0.1539  1
  Mn  Mn2  3  0.0000  0.0000  0.3494  1
  Mn  Mn3  3  0.0000  0.0000  0.6476  1
  Sb  Sb4  3  0.0000  0.0000  0.0110  1
  Sb  Sb5  3  0.0000  0.0000  0.5011  1
  P  P6  9  0.0013  0.7113  0.7495  1
  P  P7  9  0.0375  0.3696  0.9161  1
  O  O8  9  0.0049  0.8035  0.6900  1
  O  O9  9  0.0101  0.2051  0.1909  1
  O  O10  9  0.0112  0.8197  0.8067  1
  O  O11  9  0.0126  0.1787  0.9140  1
  O  O12  9  0.0230  0.8312  0.4230  1
  O  O13  9  0.1326  0.4543  0.9755  1
  O  O14  9  0.1647  0.4877  0.2473  1
  O  O15  9  0.1705  0.6872  0.7480  1
]