# generated using pymatgen
data_Sc2TlC
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.37093332
_cell_length_b   3.37093366
_cell_length_c   15.22314849
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999668
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2TlC
_chemical_formula_sum   'Sc4 Tl2 C2'
_cell_volume   149.80816940
_cell_formula_units_Z   2
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
  Sc  Sc0  1  0.66666700  0.33333300  0.58031472  1.0
  Sc  Sc1  1  0.33333300  0.66666700  0.41968528  1.0
  Sc  Sc2  1  0.33333300  0.66666700  0.08031472  1.0
  Sc  Sc3  1  0.66666700  0.33333300  0.91968528  1.0
  Tl  Tl4  1  0.66666700  0.33333300  0.25000000  1.0
  Tl  Tl5  1  0.33333300  0.66666700  0.75000000  1.0
  C  C6  1  0.00000000  0.00000000  0.50000000  1.0
  C  C7  1  0.00000000  0.00000000  0.00000000  1.0