# generated using pymatgen
data_Zr5CuBi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.78777438
_cell_length_b   8.78777438
_cell_length_c   5.91127577
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99995872
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr5CuBi3
_chemical_formula_sum   'Zr10 Cu2 Bi6'
_cell_volume   395.33915413
_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
  Zr  Zr0  1  0.74158835  0.00000000  0.25000000  1.0
  Zr  Zr1  1  0.00000000  0.74158835  0.25000000  1.0
  Zr  Zr2  1  0.25841165  0.25841165  0.25000000  1.0
  Zr  Zr3  1  0.25841165  -0.00000000  0.75000000  1.0
  Zr  Zr4  1  -0.00000000  0.25841165  0.75000000  1.0
  Zr  Zr5  1  0.74158835  0.74158835  0.75000000  1.0
  Zr  Zr6  1  0.33333300  0.66666700  0.50000000  1.0
  Zr  Zr7  1  0.66666700  0.33333300  0.50000000  1.0
  Zr  Zr8  1  0.66666700  0.33333300  0.00000000  1.0
  Zr  Zr9  1  0.33333300  0.66666700  0.00000000  1.0
  Cu  Cu10  1  0.00000000  -0.00000000  0.50000000  1.0
  Cu  Cu11  1  0.00000000  -0.00000000  0.00000000  1.0
  Bi  Bi12  1  0.38621449  0.00000000  0.25000000  1.0
  Bi  Bi13  1  0.00000000  0.38621449  0.25000000  1.0
  Bi  Bi14  1  0.61378551  0.61378551  0.25000000  1.0
  Bi  Bi15  1  0.61378551  -0.00000000  0.75000000  1.0
  Bi  Bi16  1  -0.00000000  0.61378551  0.75000000  1.0
  Bi  Bi17  1  0.38621449  0.38621449  0.75000000  1.0