# generated using pymatgen
data_TaTi2PC2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.19325760
_cell_length_b   3.19325866
_cell_length_c   16.38687730
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000977
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaTi2PC2
_chemical_formula_sum   'Ta2 Ti4 P2 C4'
_cell_volume   144.70876728
_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
  Ti  Ti2  1  0.66666700  0.33333300  0.35362096  1.0
  Ti  Ti3  1  0.33333300  0.66666700  0.64637904  1.0
  Ti  Ti4  1  0.33333300  0.66666700  0.85362096  1.0
  Ti  Ti5  1  0.66666700  0.33333300  0.14637904  1.0
  P  P6  1  0.00000000  0.00000000  0.25000000  1.0
  P  P7  1  0.00000000  0.00000000  0.75000000  1.0
  C  C8  1  0.66666700  0.33333300  0.92117412  1.0
  C  C9  1  0.33333300  0.66666700  0.07882588  1.0
  C  C10  1  0.33333300  0.66666700  0.42117412  1.0
  C  C11  1  0.66666700  0.33333300  0.57882588  1.0