# generated using pymatgen
data_CaYb2Ni6Sn5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.28148690
_cell_length_b   8.11522299
_cell_length_c   8.11522418
_cell_angle_alpha   72.99215336
_cell_angle_beta   74.70472653
_cell_angle_gamma   74.70472833
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaYb2Ni6Sn5
_chemical_formula_sum   'Ca1 Yb2 Ni6 Sn5'
_cell_volume   254.70328670
_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  0.00000000  0.00000000  0.00000000  1.0
  Yb  Yb1  1  0.68462210  0.31537790  0.31537790  1.0
  Yb  Yb2  1  0.31537790  0.68462210  0.68462210  1.0
  Ni  Ni3  1  0.50000000  0.32016824  0.67983176  1.0
  Ni  Ni4  1  0.50000000  0.67983176  0.32016824  1.0
  Ni  Ni5  1  0.88836064  0.83073003  0.39255069  1.0
  Ni  Ni6  1  0.11163936  0.16926997  0.60744931  1.0
  Ni  Ni7  1  0.88836064  0.39255069  0.83073003  1.0
  Ni  Ni8  1  0.11163936  0.60744931  0.16926997  1.0
  Sn  Sn9  1  0.67428401  0.99057248  0.66085750  1.0
  Sn  Sn10  1  0.32571599  0.00942752  0.33914250  1.0
  Sn  Sn11  1  0.67428401  0.66085750  0.99057248  1.0
  Sn  Sn12  1  0.32571599  0.33914250  0.00942752  1.0
  Sn  Sn13  1  0.00000000  0.50000000  0.50000000  1.0