# generated using pymatgen
data_Ca(NdSi)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.69378922
_cell_length_b   7.69378922
_cell_length_c   4.42383501
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca(NdSi)2
_chemical_formula_sum   'Ca2 Nd4 Si4'
_cell_volume   261.86622631
_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  0.50000000  0.50000000  0.00000000  1.0
  Ca  Ca1  1  0.00000000  0.00000000  0.00000000  1.0
  Nd  Nd2  1  0.67844467  0.17844467  0.50000000  1.0
  Nd  Nd3  1  0.32155533  0.82155533  0.50000000  1.0
  Nd  Nd4  1  0.17844467  0.32155533  0.50000000  1.0
  Nd  Nd5  1  0.82155533  0.67844467  0.50000000  1.0
  Si  Si6  1  0.11050760  0.61050760  0.00000000  1.0
  Si  Si7  1  0.88949240  0.38949240  0.00000000  1.0
  Si  Si8  1  0.61050760  0.88949240  0.00000000  1.0
  Si  Si9  1  0.38949240  0.11050760  0.00000000  1.0