# generated using pymatgen
data_Ca20Ga11Sn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.97271613
_cell_length_b   7.97271613
_cell_length_c   14.81990105
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca20Ga11Sn
_chemical_formula_sum   'Ca20 Ga11 Sn1'
_cell_volume   942.01519112
_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  0.67953175  0.17770289  0.10633400  1.0
  Ca  Ca1  1  0.18291406  0.67614209  0.60892391  1.0
  Ca  Ca2  1  0.32046825  0.82229711  0.10633400  1.0
  Ca  Ca3  1  0.81708594  0.32385791  0.60892391  1.0
  Ca  Ca4  1  0.82229711  0.67953175  0.10633400  1.0
  Ca  Ca5  1  0.32385791  0.18291406  0.60892391  1.0
  Ca  Ca6  1  0.17770289  0.32046825  0.10633400  1.0
  Ca  Ca7  1  0.67614209  0.81708594  0.60892391  1.0
  Ca  Ca8  1  0.82229711  0.32046825  0.89366600  1.0
  Ca  Ca9  1  0.32385791  0.81708594  0.39107609  1.0
  Ca  Ca10  1  0.17770289  0.67953175  0.89366600  1.0
  Ca  Ca11  1  0.67614209  0.18291406  0.39107609  1.0
  Ca  Ca12  1  0.67953175  0.82229711  0.89366600  1.0
  Ca  Ca13  1  0.18291406  0.32385791  0.39107609  1.0
  Ca  Ca14  1  0.32046825  0.17770289  0.89366600  1.0
  Ca  Ca15  1  0.81708594  0.67614209  0.39107609  1.0
  Ca  Ca16  1  0.50000000  0.50000000  0.75558874  1.0
  Ca  Ca17  1  0.00000000  0.00000000  0.25107500  1.0
  Ca  Ca18  1  0.00000000  0.00000000  0.74892500  1.0
  Ca  Ca19  1  0.50000000  0.50000000  0.24441126  1.0
  Ga  Ga20  1  0.50000000  0.50000000  0.50000000  1.0
  Ga  Ga21  1  0.50000000  0.50000000  0.00000000  1.0
  Ga  Ga22  1  0.60899310  0.10860629  0.75037432  1.0
  Ga  Ga23  1  0.10860629  0.60899310  0.24962568  1.0
  Ga  Ga24  1  0.89139371  0.39100690  0.24962568  1.0
  Ga  Ga25  1  0.39100690  0.89139371  0.75037432  1.0
  Ga  Ga26  1  0.89139371  0.60899310  0.75037432  1.0
  Ga  Ga27  1  0.39100690  0.10860629  0.24962568  1.0
  Ga  Ga28  1  0.10860629  0.39100690  0.75037432  1.0
  Ga  Ga29  1  0.60899310  0.89139371  0.24962568  1.0
  Ga  Ga30  1  0.00000000  0.00000000  0.00000000  1.0
  Sn  Sn31  1  0.00000000  0.00000000  0.50000000  1.0