# generated using pymatgen
data_Zr2Be16Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.70319798
_cell_length_b   5.70319834
_cell_length_c   5.70319854
_cell_angle_alpha   82.80408046
_cell_angle_beta   82.80407907
_cell_angle_gamma   82.80407135
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Be16Ni
_chemical_formula_sum   'Zr2 Be16 Ni1'
_cell_volume   181.45933999
_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  0.16152672  0.16152672  0.16152672  1.0
  Zr  Zr1  1  0.83922635  0.83922635  0.83922635  1.0
  Be  Be2  1  0.49885662  0.49885662  0.00326932  1.0
  Be  Be3  1  0.00326732  0.49885562  0.49885762  1.0
  Be  Be4  1  0.49885562  0.00326732  0.49885762  1.0
  Be  Be5  1  0.78246513  0.21541747  0.49798091  1.0
  Be  Be6  1  0.49798191  0.78246413  0.21541747  1.0
  Be  Be7  1  0.21541847  0.49797991  0.78246513  1.0
  Be  Be8  1  0.21541747  0.78246513  0.49798091  1.0
  Be  Be9  1  0.49797991  0.21541847  0.78246513  1.0
  Be  Be10  1  0.78246413  0.49798191  0.21541747  1.0
  Be  Be11  1  0.59921885  0.59921885  0.59921885  1.0
  Be  Be12  1  0.15980980  0.65700495  0.15980880  1.0
  Be  Be13  1  0.15980880  0.15980880  0.65700595  1.0
  Be  Be14  1  0.65700495  0.15980980  0.15980880  1.0
  Be  Be15  1  0.34051004  0.84295502  0.84295602  1.0
  Be  Be16  1  0.84295602  0.84295602  0.34050904  1.0
  Be  Be17  1  0.84295502  0.34051004  0.84295602  1.0
  Ni  Ni18  1  0.40427286  0.40427286  0.40427286  1.0