# generated using pymatgen
data_CaNd4Si3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.91480457
_cell_length_b   8.91480430
_cell_length_c   8.91480450
_cell_angle_alpha   128.39619485
_cell_angle_beta   128.39618894
_cell_angle_gamma   75.98408362
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaNd4Si3
_chemical_formula_sum   'Ca2 Nd8 Si6'
_cell_volume   423.13044026
_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
  Ca  Ca0  1  0.00000000  0.00000000  0.00000000  1.0
  Ca  Ca1  1  0.50000000  0.50000000  0.00000000  1.0
  Nd  Nd2  1  0.82341951  0.32341951  0.85468531  1.0
  Nd  Nd3  1  0.17658049  0.67658049  0.14531469  1.0
  Nd  Nd4  1  0.46873520  0.96873520  0.14531469  1.0
  Nd  Nd5  1  0.32341951  0.46873520  0.50000000  1.0
  Nd  Nd6  1  0.03126480  0.17658049  0.50000000  1.0
  Nd  Nd7  1  0.53126480  0.03126480  0.85468531  1.0
  Nd  Nd8  1  0.67658049  0.53126480  0.50000000  1.0
  Nd  Nd9  1  0.96873520  0.82341951  0.50000000  1.0
  Si  Si10  1  0.11364657  0.61364657  0.72729415  1.0
  Si  Si11  1  0.88635343  0.38635343  0.27270585  1.0
  Si  Si12  1  0.61364657  0.88635343  0.50000000  1.0
  Si  Si13  1  0.38635343  0.11364657  0.50000000  1.0
  Si  Si14  1  0.25000000  0.25000000  0.00000000  1.0
  Si  Si15  1  0.75000000  0.75000000  0.00000000  1.0