# generated using pymatgen
data_LiTl6Si2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15105419
_cell_length_b   9.23554567
_cell_length_c   9.23227589
_cell_angle_alpha   58.04224634
_cell_angle_beta   88.00344994
_cell_angle_gamma   89.23347610
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTl6Si2O7
_chemical_formula_sum   'Li1 Tl6 Si2 O7'
_cell_volume   372.40576908
_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
  Li  Li0  1  0.20301100  0.51200000  0.40210800  1
  Tl  Tl1  1  0.75037800  0.75023800  0.36212500  1
  Tl  Tl2  1  0.70990600  0.86759500  0.71224100  1
  Tl  Tl3  1  0.73989500  0.36579700  0.92188800  1
  Tl  Tl4  1  0.12532500  0.17211200  0.65932700  1
  Tl  Tl5  1  0.19176100  0.12832700  0.29053400  1
  Tl  Tl6  1  0.17631900  0.62546300  0.04347600  1
  Si  Si7  1  0.27215300  0.67709900  0.64641600  1
  Si  Si8  1  0.70360600  0.35515200  0.34213500  1
  O  O9  1  0.19917600  0.86654000  0.60344000  1
  O  O10  1  0.21897500  0.52173200  0.84064000  1
  O  O11  1  0.26556500  0.64376800  0.49321200  1
  O  O12  1  0.81975300  0.15673800  0.45403800  1
  O  O13  1  0.78491900  0.43931700  0.13725400  1
  O  O14  1  0.84224500  0.46548200  0.41361900  1
  O  O15  1  0.38301300  0.35032600  0.36799300  1
