# generated using pymatgen
data_CaNd9(Sn3O)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.40178668
_cell_length_b   9.40178609
_cell_length_c   9.40178733
_cell_angle_alpha   126.97132879
_cell_angle_beta   126.97132436
_cell_angle_gamma   78.29746803
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaNd9(Sn3O)2
_chemical_formula_sum   'Ca1 Nd9 Sn6 O2'
_cell_volume   513.77037714
_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
  Ca  Ca0  1  0.50000000  0.50000000  0.00000000  1.0
  Nd  Nd1  1  0.00000000  0.00000000  0.00000000  1.0
  Nd  Nd2  1  0.49879225  0.00706486  0.80644960  1.0
  Nd  Nd3  1  0.20061526  0.69234466  0.19355040  1.0
  Nd  Nd4  1  0.00706486  0.20061526  0.50827161  1.0
  Nd  Nd5  1  0.69234466  0.49879225  0.49172839  1.0
  Nd  Nd6  1  0.50120775  0.99293514  0.19355040  1.0
  Nd  Nd7  1  0.79938474  0.30765534  0.80644960  1.0
  Nd  Nd8  1  0.99293514  0.79938474  0.49172839  1.0
  Nd  Nd9  1  0.30765534  0.50120775  0.50827161  1.0
  Sn  Sn10  1  0.24761346  0.24761346  0.00000000  1.0
  Sn  Sn11  1  0.75238654  0.75238654  1.00000000  1.0
  Sn  Sn12  1  0.86468729  0.36014286  0.22483014  1.0
  Sn  Sn13  1  0.13531271  0.63985714  0.77516986  1.0
  Sn  Sn14  1  0.36014286  0.13531271  0.49545557  1.0
  Sn  Sn15  1  0.63985714  0.86468729  0.50454443  1.0
  O  O16  1  0.25000000  0.75000000  0.50000000  1.0
  O  O17  1  0.75000000  0.25000000  0.50000000  1.0