# generated using pymatgen
data_Nd2BeNiCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.94367896
_cell_length_b   3.94367748
_cell_length_c   8.07438839
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000402
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2BeNiCl
_chemical_formula_sum   'Nd2 Be1 Ni1 Cl1'
_cell_volume   108.75348797
_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
  Nd  Nd0  1  0.00000000  0.00000000  0.22345264  1.0
  Nd  Nd1  1  0.00000000  0.00000000  0.77654736  1.0
  Be  Be2  1  0.33333300  0.66666700  0.00000000  1.0
  Ni  Ni3  1  0.66666700  0.33333300  0.00000000  1.0
  Cl  Cl4  1  0.66666700  0.33333300  0.50000000  1.0