# generated using pymatgen
data_Zr2BeNi6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.58377805
_cell_length_b   4.74601261
_cell_length_c   6.24627632
_cell_angle_alpha   81.37036034
_cell_angle_beta   83.17786311
_cell_angle_gamma   121.65228378
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2BeNi6
_chemical_formula_sum   'Zr2 Be1 Ni6'
_cell_volume   111.16850726
_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  0.60961079  0.61300308  0.22470799  1.0
  Zr  Zr1  1  0.39038921  0.38699692  0.77529201  1.0
  Be  Be2  1  0.50000000  0.00000000  0.50000000  1.0
  Ni  Ni3  1  0.00000000  0.00000000  0.50000000  1.0
  Ni  Ni4  1  0.30167330  0.97036333  0.16000257  1.0
  Ni  Ni5  1  0.05005703  0.70947281  0.83945731  1.0
  Ni  Ni6  1  0.69832670  0.02963667  0.83999743  1.0
  Ni  Ni7  1  0.94994297  0.29052719  0.16054269  1.0
  Ni  Ni8  1  0.00000000  0.50000000  0.50000000  1.0