# generated using pymatgen
data_Ta5Al3C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.79935203
_cell_length_b   7.79935203
_cell_length_c   5.35320900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000026
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta5Al3C
_chemical_formula_sum   'Ta10 Al6 C2'
_cell_volume   282.00829059
_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  0.23165800  0.00000000  0.25000000  1.0
  Ta  Ta1  1  0.76834200  0.00000000  0.75000000  1.0
  Ta  Ta2  1  0.00000000  0.23165800  0.25000000  1.0
  Ta  Ta3  1  0.00000000  0.76834200  0.75000000  1.0
  Ta  Ta4  1  0.76834200  0.76834200  0.25000000  1.0
  Ta  Ta5  1  0.23165800  0.23165800  0.75000000  1.0
  Ta  Ta6  1  0.33333300  0.66666700  0.00000000  1.0
  Ta  Ta7  1  0.66666700  0.33333300  0.00000000  1.0
  Ta  Ta8  1  0.66666700  0.33333300  0.50000000  1.0
  Ta  Ta9  1  0.33333300  0.66666700  0.50000000  1.0
  Al  Al10  1  0.59197700  0.00000000  0.25000000  1.0
  Al  Al11  1  0.40802300  0.00000000  0.75000000  1.0
  Al  Al12  1  0.00000000  0.59197700  0.25000000  1.0
  Al  Al13  1  0.00000000  0.40802300  0.75000000  1.0
  Al  Al14  1  0.40802300  0.40802300  0.25000000  1.0
  Al  Al15  1  0.59197700  0.59197700  0.75000000  1.0
  C  C16  1  0.00000000  0.00000000  0.00000000  1.0
  C  C17  1  0.00000000  0.00000000  0.50000000  1.0