# generated using pymatgen
data_CaSm3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.41269819
_cell_length_b   7.41269819
_cell_length_c   5.93849900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000171
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaSm3
_chemical_formula_sum   'Ca2 Sm6'
_cell_volume   282.59205539
_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  0.33333300  0.66666700  0.75000000  1.0
  Ca  Ca1  1  0.66666700  0.33333300  0.25000000  1.0
  Sm  Sm2  1  0.16449100  0.32898200  0.25000000  1.0
  Sm  Sm3  1  0.67101800  0.83550900  0.25000000  1.0
  Sm  Sm4  1  0.16449100  0.83550900  0.25000000  1.0
  Sm  Sm5  1  0.83550900  0.67101800  0.75000000  1.0
  Sm  Sm6  1  0.32898200  0.16449100  0.75000000  1.0
  Sm  Sm7  1  0.83550900  0.16449100  0.75000000  1.0