# generated using pymatgen
data_TaNb2AlC2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.11414092
_cell_length_b   3.11414072
_cell_length_c   19.23510804
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001265
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaNb2AlC2
_chemical_formula_sum   'Ta2 Nb4 Al2 C4'
_cell_volume   161.54804305
_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
  Ta  Ta0  1  0.00000000  0.00000000  0.50000000  1.0
  Ta  Ta1  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb2  1  0.33333300  0.66666700  0.13424789  1.0
  Nb  Nb3  1  0.66666700  0.33333300  0.63424789  1.0
  Nb  Nb4  1  0.33333300  0.66666700  0.36575211  1.0
  Nb  Nb5  1  0.66666700  0.33333300  0.86575211  1.0
  Al  Al6  1  0.00000000  0.00000000  0.25000000  1.0
  Al  Al7  1  0.00000000  0.00000000  0.75000000  1.0
  C  C8  1  0.66666700  0.33333300  0.43260039  1.0
  C  C9  1  0.66666700  0.33333300  0.06739961  1.0
  C  C10  1  0.33333300  0.66666700  0.56739961  1.0
  C  C11  1  0.33333300  0.66666700  0.93260039  1.0