# generated using pymatgen
data_Ta2CN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.47975741
_cell_length_b   5.47975741
_cell_length_c   5.47975741
_cell_angle_alpha   132.11905356
_cell_angle_beta   132.11905356
_cell_angle_gamma   70.04105962
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2CN
_chemical_formula_sum   'Ta4 C2 N2'
_cell_volume   88.75573424
_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  0.75957400  0.75957400  0.00000000  1.0
  Ta  Ta1  1  0.24042600  0.24042600  0.00000000  1.0
  Ta  Ta2  1  0.99042600  0.49042600  0.50000000  1.0
  Ta  Ta3  1  0.50957400  0.00957400  0.50000000  1.0
  C  C4  1  0.00000000  0.00000000  0.00000000  1.0
  C  C5  1  0.75000000  0.25000000  0.50000000  1.0
  N  N6  1  0.50000000  0.50000000  0.00000000  1.0
  N  N7  1  0.25000000  0.75000000  0.50000000  1.0