# generated using pymatgen
data_BaNd2ZnO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.58512763
_cell_length_b   7.58512763
_cell_length_c   7.58512763
_cell_angle_alpha   126.54970164
_cell_angle_beta   126.54970164
_cell_angle_gamma   78.98653104
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaNd2ZnO5
_chemical_formula_sum   'Ba2 Nd4 Zn2 O10'
_cell_volume   272.43568367
_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
  Ba  Ba0  1  0.25000000  0.25000000  0.00000000  1.0
  Ba  Ba1  1  0.75000000  0.75000000  0.00000000  1.0
  Nd  Nd2  1  0.32593000  0.17407000  0.50000000  1.0
  Nd  Nd3  1  0.17407000  0.67407000  0.84814000  1.0
  Nd  Nd4  1  0.82593000  0.32593000  0.15186000  1.0
  Nd  Nd5  1  0.67407000  0.82593000  0.50000000  1.0
  Zn  Zn6  1  0.75000000  0.25000000  0.50000000  1.0
  Zn  Zn7  1  0.25000000  0.75000000  0.50000000  1.0
  O  O8  1  0.77491100  0.27491100  0.78911900  1.0
  O  O9  1  0.51420700  0.01420700  0.78911900  1.0
  O  O10  1  0.22508900  0.72508900  0.21088100  1.0
  O  O11  1  0.72508900  0.51420700  0.50000000  1.0
  O  O12  1  0.01420700  0.22508900  0.50000000  1.0
  O  O13  1  0.27491100  0.48579300  0.50000000  1.0
  O  O14  1  0.98579300  0.77491100  0.50000000  1.0
  O  O15  1  0.48579300  0.98579300  0.21088100  1.0
  O  O16  1  0.50000000  0.50000000  0.00000000  1.0
  O  O17  1  0.00000000  0.00000000  0.00000000  1.0