# generated using pymatgen
data_Ca4Ac3Ni4Sn13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.36770126
_cell_length_b   11.36770126
_cell_length_c   4.68228252
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca4Ac3Ni4Sn13
_chemical_formula_sum   'Ca4 Ac3 Ni4 Sn13'
_cell_volume   605.06623566
_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  0.84000550  0.16983014  0.00000000  1.0
  Ca  Ca1  1  0.83016986  0.84000550  0.00000000  1.0
  Ca  Ca2  1  0.15999450  0.83016986  0.00000000  1.0
  Ca  Ca3  1  0.16983014  0.15999450  0.00000000  1.0
  Ac  Ac4  1  0.50000000  0.50000000  0.50000000  1.0
  Ac  Ac5  1  0.00000000  0.50000000  0.00000000  1.0
  Ac  Ac6  1  0.50000000  0.00000000  0.00000000  1.0
  Ni  Ni7  1  0.77805130  0.61681599  0.50000000  1.0
  Ni  Ni8  1  0.38318401  0.77805130  0.50000000  1.0
  Ni  Ni9  1  0.61681599  0.22194870  0.50000000  1.0
  Ni  Ni10  1  0.22194870  0.38318401  0.50000000  1.0
  Sn  Sn11  1  0.01991894  0.27894407  0.50000000  1.0
  Sn  Sn12  1  0.98008106  0.72105593  0.50000000  1.0
  Sn  Sn13  1  0.21452260  0.61647019  0.50000000  1.0
  Sn  Sn14  1  0.57625110  0.30120684  0.00000000  1.0
  Sn  Sn15  1  0.69879316  0.57625110  0.00000000  1.0
  Sn  Sn16  1  0.78547740  0.38352981  0.50000000  1.0
  Sn  Sn17  1  0.72105593  0.01991894  0.50000000  1.0
  Sn  Sn18  1  0.00000000  0.00000000  0.50000000  1.0
  Sn  Sn19  1  0.27894407  0.98008106  0.50000000  1.0
  Sn  Sn20  1  0.42374890  0.69879316  0.00000000  1.0
  Sn  Sn21  1  0.61647019  0.78547740  0.50000000  1.0
  Sn  Sn22  1  0.30120684  0.42374890  0.00000000  1.0
  Sn  Sn23  1  0.38352981  0.21452260  0.50000000  1.0