# generated using pymatgen
data_Ca2Tb3Sn3Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.08209869
_cell_length_b   9.08414536
_cell_length_c   6.88150246
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00746178
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2Tb3Sn3Cl
_chemical_formula_sum   'Ca4 Tb6 Sn6 Cl2'
_cell_volume   491.64489415
_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  0.74354155  0.99872123  0.75000000  1.0
  Ca  Ca1  1  0.74354155  0.74481932  0.25000000  1.0
  Ca  Ca2  1  0.99982551  0.25593325  0.25000000  1.0
  Ca  Ca3  1  0.99982551  0.74389226  0.75000000  1.0
  Tb  Tb4  1  0.66905207  0.33452554  0.00000000  1.0
  Tb  Tb5  1  0.33338098  0.66669099  0.50000000  1.0
  Tb  Tb6  1  0.66905207  0.33452554  0.50000000  1.0
  Tb  Tb7  1  0.33338098  0.66669099  0.00000000  1.0
  Tb  Tb8  1  0.25558566  0.25389077  0.75000000  1.0
  Tb  Tb9  1  0.25558566  0.00169488  0.25000000  1.0
  Sn  Sn10  1  0.59748998  0.59740076  0.75000000  1.0
  Sn  Sn11  1  0.00436336  0.60863159  0.25000000  1.0
  Sn  Sn12  1  0.59748998  0.00008923  0.25000000  1.0
  Sn  Sn13  1  0.39494394  0.00351600  0.75000000  1.0
  Sn  Sn14  1  0.00436336  0.39573278  0.75000000  1.0
  Sn  Sn15  1  0.39494394  0.39142793  0.25000000  1.0
  Cl  Cl16  1  0.00181695  0.00090897  0.50000000  1.0
  Cl  Cl17  1  0.00181695  0.00090897  0.00000000  1.0