# generated using pymatgen
data_CaSm(AsPd)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.27721264
_cell_length_b   4.27721201
_cell_length_c   8.00905779
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999727
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaSm(AsPd)2
_chemical_formula_sum   'Ca1 Sm1 As2 Pd2'
_cell_volume   126.89183845
_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  0.00000000  0.00000000  0.49961716  1.0
  Sm  Sm1  1  0.00000000  0.00000000  0.99977885  1.0
  As  As2  1  0.66666700  0.33333300  0.24258078  1.0
  As  As3  1  0.33333300  0.66666700  0.75895109  1.0
  Pd  Pd4  1  0.33333300  0.66666700  0.24809206  1.0
  Pd  Pd5  1  0.66666700  0.33333300  0.74977707  1.0