# generated using pymatgen
data_NdZrReB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.66041832
_cell_length_b   9.10917141
_cell_length_c   11.55884597
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdZrReB6
_chemical_formula_sum   'Nd4 Zr4 Re4 B24'
_cell_volume   385.41096960
_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
  Nd  Nd0  1  0.00000000  0.32241218  0.41446250  1.0
  Nd  Nd1  1  0.00000000  0.67758782  0.58553750  1.0
  Nd  Nd2  1  0.00000000  0.82241218  0.08553750  1.0
  Nd  Nd3  1  0.00000000  0.17758782  0.91446250  1.0
  Zr  Zr4  1  0.00000000  0.94563613  0.37200518  1.0
  Zr  Zr5  1  0.00000000  0.05436387  0.62799482  1.0
  Zr  Zr6  1  0.00000000  0.44563613  0.12799482  1.0
  Zr  Zr7  1  0.00000000  0.55436387  0.87200518  1.0
  Re  Re8  1  0.00000000  0.64195357  0.31659609  1.0
  Re  Re9  1  0.00000000  0.35804643  0.68340391  1.0
  Re  Re10  1  0.00000000  0.14195357  0.18340391  1.0
  Re  Re11  1  0.00000000  0.85804643  0.81659609  1.0
  B  B12  1  0.50000000  0.55651312  0.42996374  1.0
  B  B13  1  0.50000000  0.44348688  0.57003626  1.0
  B  B14  1  0.50000000  0.05651312  0.07003626  1.0
  B  B15  1  0.50000000  0.94348688  0.92996374  1.0
  B  B16  1  0.50000000  0.75280403  0.41546141  1.0
  B  B17  1  0.50000000  0.24719597  0.58453859  1.0
  B  B18  1  0.50000000  0.25280403  0.08453859  1.0
  B  B19  1  0.50000000  0.74719597  0.91546141  1.0
  B  B20  1  0.50000000  0.79453918  0.26515360  1.0
  B  B21  1  0.50000000  0.20546082  0.73484640  1.0
  B  B22  1  0.50000000  0.29453918  0.23484640  1.0
  B  B23  1  0.50000000  0.70546082  0.76515360  1.0
  B  B24  1  0.50000000  0.62983666  0.18380170  1.0
  B  B25  1  0.50000000  0.37016334  0.81619830  1.0
  B  B26  1  0.50000000  0.12983666  0.31619830  1.0
  B  B27  1  0.50000000  0.87016334  0.68380170  1.0
  B  B28  1  0.50000000  0.98415543  0.21485594  1.0
  B  B29  1  0.50000000  0.01584457  0.78514406  1.0
  B  B30  1  0.50000000  0.48415543  0.28514406  1.0
  B  B31  1  0.50000000  0.51584457  0.71485594  1.0
  B  B32  1  0.50000000  0.59849001  0.02601142  1.0
  B  B33  1  0.50000000  0.40150999  0.97398858  1.0
  B  B34  1  0.50000000  0.09849001  0.47398858  1.0
  B  B35  1  0.50000000  0.90150999  0.52601142  1.0