# generated using pymatgen
data_TaCo3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.86121585
_cell_length_b   6.86121293
_cell_length_c   6.86121933
_cell_angle_alpha   43.72204007
_cell_angle_beta   43.72200236
_cell_angle_gamma   43.72204106
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaCo3
_chemical_formula_sum   'Ta3 Co9'
_cell_volume   140.06384829
_cell_formula_units_Z   3
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  0.00000000  1.0
  Ta  Ta1  1  0.21858946  0.21858846  0.21858946  1.0
  Ta  Ta2  1  0.78141054  0.78141154  0.78141054  1.0
  Co  Co3  1  0.50000000  0.50000000  0.00000000  1.0
  Co  Co4  1  -0.00000000  0.50000000  0.50000000  1.0
  Co  Co5  1  0.50000000  0.00000000  0.50000000  1.0
  Co  Co6  1  0.71380812  0.24226169  0.71380812  1.0
  Co  Co7  1  0.71380912  0.71380612  0.24226069  1.0
  Co  Co8  1  0.24226069  0.71380612  0.71380912  1.0
  Co  Co9  1  0.75773931  0.28619388  0.28619088  1.0
  Co  Co10  1  0.28619188  0.75773831  0.28619188  1.0
  Co  Co11  1  0.28619088  0.28619388  0.75773931  1.0