# generated using pymatgen
data_Tl2Co3NiSe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.39066149
_cell_length_b   7.39066149
_cell_length_c   5.44867500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   136.71402189
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2Co3NiSe4
_chemical_formula_sum   'Tl2 Co3 Ni1 Se4'
_cell_volume   204.05808889
_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  0.50000000  0.00000000  0.25087300  1.0
  Tl  Tl1  1  0.00000000  0.50000000  0.74912700  1.0
  Co  Co2  1  0.50000000  0.50000000  0.50000000  1.0
  Co  Co3  1  0.50000000  0.50000000  0.00000000  1.0
  Co  Co4  1  0.00000000  0.00000000  0.50000000  1.0
  Ni  Ni5  1  0.00000000  0.00000000  0.00000000  1.0
  Se  Se6  1  0.64738900  0.84447400  0.74580900  1.0
  Se  Se7  1  0.15552600  0.35261100  0.25419100  1.0
  Se  Se8  1  0.84447400  0.64738900  0.25419100  1.0
  Se  Se9  1  0.35261100  0.15552600  0.74580900  1.0