# generated using pymatgen
data_BaNdZr2O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.39413175
_cell_length_b   8.40714699
_cell_length_c   8.42904838
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99582463
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaNdZr2O6
_chemical_formula_sum   'Ba4 Nd4 Zr8 O24'
_cell_volume   594.84383902
_cell_formula_units_Z   4
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  0.00000000  0.50000000  0.50000000  1.0
  Ba  Ba1  1  0.50000000  0.50000000  0.50000000  1.0
  Ba  Ba2  1  0.50000000  -0.00000000  0.50000000  1.0
  Ba  Ba3  1  0.00000000  -0.00000000  0.00000000  1.0
  Nd  Nd4  1  0.00000000  -0.00000000  0.50000000  1.0
  Nd  Nd5  1  0.00000000  0.50000000  0.00000000  1.0
  Nd  Nd6  1  0.50000000  0.50000000  0.00000000  1.0
  Nd  Nd7  1  0.50000000  -0.00000000  0.00000000  1.0
  Zr  Zr8  1  0.75052527  0.75051799  0.24685003  1.0
  Zr  Zr9  1  0.75052527  0.24948201  0.24685003  1.0
  Zr  Zr10  1  0.24954186  0.75045197  0.24683376  1.0
  Zr  Zr11  1  0.24954186  0.24954803  0.24683376  1.0
  Zr  Zr12  1  0.75045814  0.75045197  0.75316624  1.0
  Zr  Zr13  1  0.75045814  0.24954803  0.75316624  1.0
  Zr  Zr14  1  0.24947473  0.75051799  0.75314997  1.0
  Zr  Zr15  1  0.24947473  0.24948201  0.75314997  1.0
  O  O16  1  0.74776480  0.50000000  0.23263083  1.0
  O  O17  1  0.74444637  -0.00000000  0.23888332  1.0
  O  O18  1  0.25230677  0.50000000  0.23265357  1.0
  O  O19  1  0.25558067  -0.00000000  0.23894715  1.0
  O  O20  1  0.74769323  0.50000000  0.76734643  1.0
  O  O21  1  0.74441933  -0.00000000  0.76105285  1.0
  O  O22  1  0.25223520  0.50000000  0.76736917  1.0
  O  O23  1  0.25555363  -0.00000000  0.76111668  1.0
  O  O24  1  0.74476703  0.74474848  0.99998464  1.0
  O  O25  1  0.74476703  0.25525152  0.99998464  1.0
  O  O26  1  0.25523297  0.74474848  0.00001536  1.0
  O  O27  1  0.25523297  0.25525152  0.00001536  1.0
  O  O28  1  0.75684492  0.75684844  0.49999577  1.0
  O  O29  1  0.75684492  0.24315156  0.49999577  1.0
  O  O30  1  0.24315508  0.75684844  0.50000423  1.0
  O  O31  1  0.24315508  0.24315156  0.50000423  1.0
  O  O32  1  0.00007631  0.74446296  0.23896510  1.0
  O  O33  1  0.00007631  0.25553704  0.23896510  1.0
  O  O34  1  0.50002289  0.74772207  0.23256538  1.0
  O  O35  1  0.50002289  0.25227793  0.23256538  1.0
  O  O36  1  -0.00007631  0.74446296  0.76103490  1.0
  O  O37  1  -0.00007631  0.25553704  0.76103490  1.0
  O  O38  1  0.49997711  0.74772207  0.76743462  1.0
  O  O39  1  0.49997711  0.25227793  0.76743462  1.0