# generated using pymatgen
data_Ca9CeSn6F2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.50541395
_cell_length_b   9.50541385
_cell_length_c   9.48846511
_cell_angle_alpha   129.17163257
_cell_angle_beta   129.17162172
_cell_angle_gamma   74.68784836
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca9CeSn6F2
_chemical_formula_sum   'Ca9 Ce1 Sn6 F2'
_cell_volume   502.11768500
_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  0.49851099  0.50423824  0.00113708  1.0
  Ca  Ca1  1  0.00423824  0.99851099  0.00113708  1.0
  Ca  Ca2  1  0.18610645  0.68610645  0.17452567  1.0
  Ca  Ca3  1  0.00773292  0.18928863  0.50142938  1.0
  Ca  Ca4  1  0.68928863  0.50773292  0.50142938  1.0
  Ca  Ca5  1  0.49192392  0.99192392  0.18412840  1.0
  Ca  Ca6  1  0.81081555  0.31081555  0.82152515  1.0
  Ca  Ca7  1  0.98899659  0.80960826  0.49613728  1.0
  Ca  Ca8  1  0.30960826  0.48899659  0.49613728  1.0
  Ce  Ce9  1  0.51831731  0.01831731  0.83177206  1.0
  Sn  Sn10  1  0.25402228  0.24725703  0.99567037  1.0
  Sn  Sn11  1  0.74725703  0.75402228  0.99567037  1.0
  Sn  Sn12  1  0.87098623  0.37098623  0.24396854  1.0
  Sn  Sn13  1  0.12635642  0.62635642  0.75142833  1.0
  Sn  Sn14  1  0.37321131  0.12746562  0.50404330  1.0
  Sn  Sn15  1  0.62746562  0.87321131  0.50404330  1.0
  F  F16  1  0.24529337  0.74529337  0.49267290  1.0
  F  F17  1  0.74986688  0.24986688  0.50314415  1.0