# generated using pymatgen
data_Sr3LiTa4(O6F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.47688763
_cell_length_b   7.47688763
_cell_length_c   7.47688823
_cell_angle_alpha   60.89170660
_cell_angle_beta   60.89170660
_cell_angle_gamma   60.89169967
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr3LiTa4(O6F)2
_chemical_formula_sum   'Sr3 Li1 Ta4 O12 F2'
_cell_volume   301.50216165
_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
  Sr  Sr0  1  0.50000000  0.50000000  0.00000000  1
  Sr  Sr1  1  0.00000000  0.50000000  0.50000000  1
  Sr  Sr2  1  0.50000000  0.00000000  0.50000000  1
  Li  Li3  1  0.50000000  0.50000000  0.50000000  1
  Ta  Ta4  1  0.00000000  0.50000000  0.00000000  1
  Ta  Ta5  1  0.00000000  0.00000000  0.00000000  1
  Ta  Ta6  1  0.50000000  0.00000000  0.00000000  1
  Ta  Ta7  1  0.00000000  0.00000000  0.50000000  1
  O  O8  1  0.07284100  0.67874100  0.07284100  1
  O  O9  1  0.92715900  0.32125900  0.92715900  1
  O  O10  1  0.68663500  0.68663500  0.06123300  1
  O  O11  1  0.06123300  0.68663500  0.68663500  1
  O  O12  1  0.67874100  0.07284100  0.07284100  1
  O  O13  1  0.07284100  0.07284100  0.67874100  1
  O  O14  1  0.68663500  0.06123300  0.68663500  1
  O  O15  1  0.93876700  0.31336500  0.31336500  1
  O  O16  1  0.92715900  0.92715900  0.32125900  1
  O  O17  1  0.31336500  0.31336500  0.93876700  1
  O  O18  1  0.32125900  0.92715900  0.92715900  1
  O  O19  1  0.31336500  0.93876700  0.31336500  1
  F  F20  1  0.60828900  0.60828900  0.60828900  1
  F  F21  1  0.39171100  0.39171100  0.39171100  1
