# generated using pymatgen
data_TlV5Se8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.31861017
_cell_length_b   9.31861017
_cell_length_c   9.24011911
_cell_angle_alpha   76.99164296
_cell_angle_beta   76.99164296
_cell_angle_gamma   21.55098557
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlV5Se8
_chemical_formula_sum   'Tl1 V5 Se8'
_cell_volume   286.89582686
_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
  Tl  Tl0  1  0.00000000  0.00000000  0.00000000  1.0
  V  V1  1  0.85480000  0.85480000  0.49700600  1.0
  V  V2  1  0.20710200  0.20710200  0.16605800  1.0
  V  V3  1  0.79289800  0.79289800  0.83394200  1.0
  V  V4  1  0.50000000  0.50000000  0.50000000  1.0
  V  V5  1  0.14520000  0.14520000  0.50299400  1.0
  Se  Se6  1  0.33571700  0.33571700  0.99589700  1.0
  Se  Se7  1  0.74040600  0.74040600  0.35044200  1.0
  Se  Se8  1  0.93039200  0.93039200  0.68028800  1.0
  Se  Se9  1  0.25959400  0.25959400  0.64955800  1.0
  Se  Se10  1  0.06960800  0.06960800  0.31971200  1.0
  Se  Se11  1  0.41328300  0.41328300  0.32003300  1.0
  Se  Se12  1  0.66428300  0.66428300  0.00410300  1.0
  Se  Se13  1  0.58671700  0.58671700  0.67996700  1.0