# generated using pymatgen
data_Zr5Sn2BiB
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.60083135
_cell_length_b   8.57728573
_cell_length_c   5.83590518
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.90948801
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr5Sn2BiB
_chemical_formula_sum   'Zr10 Sn4 Bi2 B2'
_cell_volume   373.18531729
_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  0.66908488  0.33518578  0.00320412  1.0
  Zr  Zr1  1  0.33091512  0.66610191  0.00320412  1.0
  Zr  Zr2  1  0.33091512  0.66610191  0.49679588  1.0
  Zr  Zr3  1  0.66908488  0.33518578  0.49679588  1.0
  Zr  Zr4  1  0.77487006  0.77025791  0.75000000  1.0
  Zr  Zr5  1  0.22512994  0.99538785  0.75000000  1.0
  Zr  Zr6  1  0.00000000  0.23037624  0.75000000  1.0
  Zr  Zr7  1  0.22961212  0.23038286  0.25000000  1.0
  Zr  Zr8  1  0.77038788  0.00077073  0.25000000  1.0
  Zr  Zr9  1  1.00000000  0.76870073  0.25000000  1.0
  Sn  Sn10  1  1.00000000  0.59704619  0.75000000  1.0
  Sn  Sn11  1  0.60224343  0.60293835  0.25000000  1.0
  Sn  Sn12  1  0.39775657  0.00069492  0.25000000  1.0
  Sn  Sn13  1  0.00000000  0.40047621  0.25000000  1.0
  Bi  Bi14  1  0.40106195  0.40034652  0.75000000  1.0
  Bi  Bi15  1  0.59893805  0.99928457  0.75000000  1.0
  B  B16  1  0.00000000  0.00038077  0.00101533  1.0
  B  B17  1  0.00000000  0.00038077  0.49898467  1.0