# generated using pymatgen
data_CaSm4Si2Sn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.00169368
_cell_length_b   9.00169354
_cell_length_c   9.00169482
_cell_angle_alpha   128.49689976
_cell_angle_beta   128.49690383
_cell_angle_gamma   75.82143966
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaSm4Si2Sn
_chemical_formula_sum   'Ca2 Sm8 Si4 Sn2'
_cell_volume   434.52178384
_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
  Sm  Sm2  1  0.81266548  0.31266548  0.84424265  1.0
  Sm  Sm3  1  0.18733452  0.68733452  0.15575735  1.0
  Sm  Sm4  1  0.46842282  0.96842282  0.15575735  1.0
  Sm  Sm5  1  0.31266548  0.46842282  0.50000000  1.0
  Sm  Sm6  1  0.03157718  0.18733452  0.50000000  1.0
  Sm  Sm7  1  0.53157718  0.03157718  0.84424265  1.0
  Sm  Sm8  1  0.68733452  0.53157718  0.50000000  1.0
  Sm  Sm9  1  0.96842282  0.81266548  0.50000000  1.0
  Si  Si10  1  0.11736322  0.61736322  0.73472645  1.0
  Si  Si11  1  0.88263678  0.38263678  0.26527355  1.0
  Si  Si12  1  0.61736322  0.88263678  0.50000000  1.0
  Si  Si13  1  0.38263678  0.11736322  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