# generated using pymatgen
data_Ca7NdBi6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.40549449
_cell_length_b   8.33003328
_cell_length_c   8.40549457
_cell_angle_alpha   109.28945691
_cell_angle_beta   109.65236185
_cell_angle_gamma   109.28946133
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca7NdBi6
_chemical_formula_sum   'Ca7 Nd1 Bi6'
_cell_volume   454.06780677
_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
  Ca  Ca0  1  0.14548304  0.50255367  0.00311572  1.0
  Ca  Ca1  1  0.64715574  0.50029486  0.00039438  1.0
  Ca  Ca2  1  0.49960562  0.99990048  0.64676136  1.0
  Ca  Ca3  1  0.35763268  0.35707063  0.35451696  1.0
  Ca  Ca4  1  0.49688428  0.99943795  0.14236732  1.0
  Ca  Ca5  1  0.00000000  0.64586854  0.50000000  1.0
  Ca  Ca6  1  0.85323864  0.85313912  0.85284426  1.0
  Nd  Nd7  1  1.00000000  0.14291817  0.50000000  1.0
  Bi  Bi8  1  0.37219527  0.62073360  0.74748288  1.0
  Bi  Bi9  1  0.87528662  0.24853833  0.12780473  1.0
  Bi  Bi10  1  0.62504147  0.75175166  0.37391958  1.0
  Bi  Bi11  1  0.12608042  0.87783208  0.25112189  1.0
  Bi  Bi12  1  0.24887811  0.12671019  0.87495853  1.0
  Bi  Bi13  1  0.75251712  0.37325072  0.62471338  1.0