# generated using pymatgen
data_CaAc4Sn3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.97938026
_cell_length_b   9.97938035
_cell_length_c   9.97938058
_cell_angle_alpha   128.78794638
_cell_angle_beta   128.78794712
_cell_angle_gamma   75.35201551
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaAc4Sn3
_chemical_formula_sum   'Ca2 Ac8 Sn6'
_cell_volume   587.68006741
_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  0.50000000  0.50000000  0.00000000  1.0
  Ac  Ac2  1  0.81585581  0.31585581  0.83758719  1.0
  Ac  Ac3  1  0.18414419  0.68414419  0.16241281  1.0
  Ac  Ac4  1  0.47826862  0.97826862  0.16241281  1.0
  Ac  Ac5  1  0.31585581  0.47826862  0.50000000  1.0
  Ac  Ac6  1  0.02173138  0.18414419  0.50000000  1.0
  Ac  Ac7  1  0.52173138  0.02173138  0.83758719  1.0
  Ac  Ac8  1  0.68414419  0.52173138  0.50000000  1.0
  Ac  Ac9  1  0.97826862  0.81585581  0.50000000  1.0
  Sn  Sn10  1  0.13157177  0.63157177  0.76314454  1.0
  Sn  Sn11  1  0.86842823  0.36842823  0.23685546  1.0
  Sn  Sn12  1  0.63157177  0.86842823  0.50000000  1.0
  Sn  Sn13  1  0.36842823  0.13157177  0.50000000  1.0
  Sn  Sn14  1  0.25000000  0.25000000  0.00000000  1.0
  Sn  Sn15  1  0.75000000  0.75000000  0.00000000  1.0