# generated using pymatgen
data_ZrCo3B2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.42907182
_cell_length_b   8.42907182
_cell_length_c   9.05972832
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCo3B2
_chemical_formula_sum   'Zr9 Co27 B18'
_cell_volume   557.44922321
_cell_formula_units_Z   9
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
  Zr  Zr0  1  0.00000000  0.00000000  0.33037200  1
  Zr  Zr1  1  0.00000000  0.00000000  0.66962800  1
  Zr  Zr2  1  0.00000000  0.00000000  0.00000000  1
  Zr  Zr3  1  0.66666700  0.33333300  0.66370500  1
  Zr  Zr4  1  0.66666700  0.33333300  0.00296100  1
  Zr  Zr5  1  0.66666700  0.33333300  0.33333300  1
  Zr  Zr6  1  0.33333300  0.66666700  0.99703900  1
  Zr  Zr7  1  0.33333300  0.66666700  0.33629500  1
  Zr  Zr8  1  0.33333300  0.66666700  0.66666700  1
  Co  Co9  1  0.16593200  0.33186400  0.52882200  1
  Co  Co10  1  0.83406800  0.66813600  0.47117800  1
  Co  Co11  1  0.83406800  0.16593200  0.47117800  1
  Co  Co12  1  0.66813600  0.83406800  0.52882200  1
  Co  Co13  1  0.16593200  0.83406800  0.52882200  1
  Co  Co14  1  0.16666700  0.33333300  0.83333300  1
  Co  Co15  1  0.33186400  0.16593200  0.47117800  1
  Co  Co16  1  0.16666700  0.83333300  0.83333300  1
  Co  Co17  1  0.66666700  0.83333300  0.83333300  1
  Co  Co18  1  0.83259800  0.66519700  0.86215500  1
  Co  Co19  1  0.50073500  0.00147000  0.80451200  1
  Co  Co20  1  0.50073500  0.49926500  0.80451200  1
  Co  Co21  1  0.33480300  0.16740200  0.86215500  1
  Co  Co22  1  0.83259800  0.16740200  0.86215500  1
  Co  Co23  1  0.83333300  0.66666700  0.16666700  1
  Co  Co24  1  0.99853000  0.49926500  0.80451200  1
  Co  Co25  1  0.83333300  0.16666700  0.16666700  1
  Co  Co26  1  0.33333300  0.16666700  0.16666700  1
  Co  Co27  1  0.49926500  0.99853000  0.19548800  1
  Co  Co28  1  0.16740200  0.33480300  0.13784500  1
  Co  Co29  1  0.16740200  0.83259800  0.13784500  1
  Co  Co30  1  0.00147000  0.50073500  0.19548800  1
  Co  Co31  1  0.49926500  0.50073500  0.19548800  1
  Co  Co32  1  0.50000000  0.00000000  0.50000000  1
  Co  Co33  1  0.66519700  0.83259800  0.13784500  1
  Co  Co34  1  0.50000000  0.50000000  0.50000000  1
  Co  Co35  1  0.00000000  0.50000000  0.50000000  1
  B  B36  1  0.71206500  0.66666700  0.66666700  1
  B  B37  1  0.66666700  0.95460200  0.33333300  1
  B  B38  1  0.33333300  0.04539800  0.66666700  1
  B  B39  1  0.28793500  0.33333300  0.33333300  1
  B  B40  1  0.95460200  0.28793500  0.66666700  1
  B  B41  1  0.04539800  0.71206500  0.33333300  1
  B  B42  1  0.37873200  0.00000000  0.00000000  1
  B  B43  1  0.33333300  0.28793500  0.66666700  1
  B  B44  1  0.00000000  0.37873200  0.00000000  1
  B  B45  1  0.95460200  0.66666700  0.66666700  1
  B  B46  1  0.62126800  0.62126800  0.00000000  1
  B  B47  1  0.71206500  0.04539800  0.66666700  1
  B  B48  1  0.04539800  0.33333300  0.33333300  1
  B  B49  1  0.00000000  0.62126800  0.00000000  1
  B  B50  1  0.66666700  0.71206500  0.33333300  1
  B  B51  1  0.62126800  0.00000000  0.00000000  1
  B  B52  1  0.28793500  0.95460200  0.33333300  1
  B  B53  1  0.37873200  0.37873200  0.00000000  1
