# generated using pymatgen
data_CaSm5(MnC3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.17625904
_cell_length_b   8.19701973
_cell_length_c   5.10437021
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.95006982
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaSm5(MnC3)4
_chemical_formula_sum   'Ca1 Sm5 Mn4 C12'
_cell_volume   296.41604383
_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  0.61075276  0.68555888  0.75000000  1.0
  Sm  Sm1  1  0.92874199  0.61686046  0.25000000  1.0
  Sm  Sm2  1  0.68572998  0.06979009  0.25000000  1.0
  Sm  Sm3  1  0.31445589  0.92902610  0.75000000  1.0
  Sm  Sm4  1  0.07214912  0.38596636  0.75000000  1.0
  Sm  Sm5  1  0.38701801  0.31728920  0.25000000  1.0
  Mn  Mn6  1  0.99893663  0.99944661  0.49925023  1.0
  Mn  Mn7  1  0.99893663  0.99944661  0.00074977  1.0
  Mn  Mn8  1  0.66583242  0.33038614  0.75000000  1.0
  Mn  Mn9  1  0.33260239  0.66695117  0.25000000  1.0
  C  C10  1  0.95942768  0.76693261  0.75000000  1.0
  C  C11  1  0.18918735  0.96059349  0.25000000  1.0
  C  C12  1  0.77124360  0.81485308  0.25000000  1.0
  C  C13  1  0.22922951  0.18832596  0.75000000  1.0
  C  C14  1  0.81530020  0.04196286  0.75000000  1.0
  C  C15  1  0.04132157  0.22945056  0.25000000  1.0
  C  C16  1  0.85476614  0.57768202  0.75000000  1.0
  C  C17  1  0.28131489  0.86067571  0.25000000  1.0
  C  C18  1  0.57996216  0.71941304  0.25000000  1.0
  C  C19  1  0.42082341  0.27904667  0.75000000  1.0
  C  C20  1  0.14058631  0.42115097  0.25000000  1.0
  C  C21  1  0.72168334  0.13918843  0.75000000  1.0