# generated using pymatgen
data_CaAc2Sn5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.86115558
_cell_length_b   6.86115465
_cell_length_c   10.66022717
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   101.53641797
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaAc2Sn5
_chemical_formula_sum   'Ca2 Ac4 Sn10'
_cell_volume   491.69680797
_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  0.64059115  0.64059115  0.25000000  1.0
  Ca  Ca1  1  0.35940885  0.35940885  0.75000000  1.0
  Ac  Ac2  1  0.79668036  0.20331964  0.00000000  1.0
  Ac  Ac3  1  0.20331964  0.79668036  0.00000000  1.0
  Ac  Ac4  1  0.20331964  0.79668036  0.50000000  1.0
  Ac  Ac5  1  0.79668036  0.20331964  0.50000000  1.0
  Sn  Sn6  1  0.07856920  0.48441592  0.25000000  1.0
  Sn  Sn7  1  0.92143180  0.51558408  0.75000000  1.0
  Sn  Sn8  1  0.48441592  0.07856820  0.25000000  1.0
  Sn  Sn9  1  0.51558408  0.92143180  0.75000000  1.0
  Sn  Sn10  1  0.03432238  0.03432238  0.25000000  1.0
  Sn  Sn11  1  0.96567762  0.96567762  0.75000000  1.0
  Sn  Sn12  1  0.31987609  0.31987609  0.04684119  1.0
  Sn  Sn13  1  0.68012391  0.68012391  0.95315881  1.0
  Sn  Sn14  1  0.68012391  0.68012391  0.54684119  1.0
  Sn  Sn15  1  0.31987609  0.31987609  0.45315881  1.0