# generated using pymatgen
data_Zr2(Co7B2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.48408303
_cell_length_b   7.48408303
_cell_length_c   7.48408303
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2(Co7B2)3
_chemical_formula_sum   'Zr2 Co21 B6'
_cell_volume   296.41542042
_cell_formula_units_Z   1
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  0.25000000  0.25000000  0.25000000  1
  Zr  Zr1  1  0.75000000  0.75000000  0.75000000  1
  Co  Co2  1  0.00000000  0.00000000  0.00000000  1
  Co  Co3  1  0.38593100  0.38593100  0.38593100  1
  Co  Co4  1  0.15779400  0.61406900  0.61406900  1
  Co  Co5  1  0.61406900  0.15779400  0.61406900  1
  Co  Co6  1  0.61406900  0.61406900  0.15779400  1
  Co  Co7  1  0.38593100  0.84220600  0.38593100  1
  Co  Co8  1  0.38593100  0.38593100  0.84220600  1
  Co  Co9  1  0.84220600  0.38593100  0.38593100  1
  Co  Co10  1  0.61406900  0.61406900  0.61406900  1
  Co  Co11  1  0.00000000  0.33700400  0.00000000  1
  Co  Co12  1  0.33700400  0.00000000  0.00000000  1
  Co  Co13  1  0.00000000  0.33700400  0.66299600  1
  Co  Co14  1  0.66299600  -0.00000000  0.33700400  1
  Co  Co15  1  0.33700400  -0.00000000  0.66299600  1
  Co  Co16  1  -0.00000000  -0.00000000  0.33700400  1
  Co  Co17  1  0.66299600  0.33700400  0.00000000  1
  Co  Co18  1  -0.00000000  0.66299600  0.33700400  1
  Co  Co19  1  0.00000000  -0.00000000  0.66299600  1
  Co  Co20  1  0.33700400  0.66299600  0.00000000  1
  Co  Co21  1  0.66299600  0.00000000  0.00000000  1
  Co  Co22  1  0.00000000  0.66299600  0.00000000  1
  B  B23  1  0.27355000  0.72645000  0.27355000  1
  B  B24  1  0.27355000  0.72645000  0.72645000  1
  B  B25  1  0.72645000  0.27355000  0.27355000  1
  B  B26  1  0.72645000  0.72645000  0.27355000  1
  B  B27  1  0.27355000  0.27355000  0.72645000  1
  B  B28  1  0.72645000  0.27355000  0.72645000  1
