# generated using pymatgen
data_LiSm3MnC6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.43054105
_cell_length_b   8.43054093
_cell_length_c   5.12947740
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998527
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiSm3MnC6
_chemical_formula_sum   'Li2 Sm6 Mn2 C12'
_cell_volume   315.72916861
_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
  Li  Li0  1  0.00000000  0.00000000  0.50000000  1.0
  Li  Li1  1  0.00000000  0.00000000  0.00000000  1.0
  Sm  Sm2  1  0.62275183  0.67991434  0.75000000  1.0
  Sm  Sm3  1  0.94283649  0.62275183  0.25000000  1.0
  Sm  Sm4  1  0.67991434  0.05716351  0.25000000  1.0
  Sm  Sm5  1  0.32008566  0.94283649  0.75000000  1.0
  Sm  Sm6  1  0.05716351  0.37724817  0.75000000  1.0
  Sm  Sm7  1  0.37724817  0.32008566  0.25000000  1.0
  Mn  Mn8  1  0.66666700  0.33333300  0.75000000  1.0
  Mn  Mn9  1  0.33333300  0.66666700  0.25000000  1.0
  C  C10  1  0.98294916  0.74142333  0.75000000  1.0
  C  C11  1  0.24152583  0.98294916  0.25000000  1.0
  C  C12  1  0.74142333  0.75847417  0.25000000  1.0
  C  C13  1  0.25857667  0.24152583  0.75000000  1.0
  C  C14  1  0.75847417  0.01705084  0.75000000  1.0
  C  C15  1  0.01705084  0.25857667  0.25000000  1.0
  C  C16  1  0.85811998  0.56508959  0.75000000  1.0
  C  C17  1  0.29302939  0.85811998  0.25000000  1.0
  C  C18  1  0.56508959  0.70697061  0.25000000  1.0
  C  C19  1  0.43491041  0.29302939  0.75000000  1.0
  C  C20  1  0.14188002  0.43491041  0.25000000  1.0
  C  C21  1  0.70697061  0.14188002  0.75000000  1.0