# generated using pymatgen
data_Ca2Sn2Au3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.80255199
_cell_length_b   4.80255258
_cell_length_c   16.35456183
_cell_angle_alpha   90.00000164
_cell_angle_beta   98.44304767
_cell_angle_gamma   60.00000705
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2Sn2Au3
_chemical_formula_sum   'Ca4 Sn4 Au6'
_cell_volume   321.94423613
_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  0.84668893  0.57665503  0.27003390  1.0
  Ca  Ca2  1  0.00000000  0.50000000  0.50000000  1.0
  Ca  Ca3  1  0.15331007  0.42334597  0.72996510  1.0
  Sn  Sn4  1  0.41381101  0.29309450  0.12071551  1.0
  Sn  Sn5  1  0.25029917  0.87485041  0.37544776  1.0
  Sn  Sn6  1  0.74970183  0.12514859  0.62455124  1.0
  Sn  Sn7  1  0.58618999  0.70690550  0.87928449  1.0
  Au  Au8  1  0.71976895  0.64011552  0.07965443  1.0
  Au  Au9  1  0.13035673  0.93482164  0.19553509  1.0
  Au  Au10  1  0.59450133  0.20274934  0.39175099  1.0
  Au  Au11  1  0.40549967  0.79724966  0.60825001  1.0
  Au  Au12  1  0.86964427  0.06517736  0.80446591  1.0
  Au  Au13  1  0.28023005  0.35988548  0.92034657  1.0