# generated using pymatgen
data_CaSmRuC2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17916566
_cell_length_b   6.41237358
_cell_length_c   10.41255611
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaSmRuC2
_chemical_formula_sum   'Ca4 Sm4 Ru4 C8'
_cell_volume   345.80874572
_cell_formula_units_Z   4
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  0.25000000  0.46528889  0.77798020  1.0
  Ca  Ca1  1  0.75000000  0.03471111  0.27798020  1.0
  Ca  Ca2  1  0.25000000  0.96528889  0.72201980  1.0
  Ca  Ca3  1  0.75000000  0.53471111  0.22201980  1.0
  Sm  Sm4  1  0.25000000  0.80831057  0.05612564  1.0
  Sm  Sm5  1  0.75000000  0.69168943  0.55612564  1.0
  Sm  Sm6  1  0.25000000  0.30831057  0.44387436  1.0
  Sm  Sm7  1  0.75000000  0.19168943  0.94387436  1.0
  Ru  Ru8  1  0.25000000  0.27427155  0.14604952  1.0
  Ru  Ru9  1  0.75000000  0.22572845  0.64604952  1.0
  Ru  Ru10  1  0.25000000  0.77427155  0.35395048  1.0
  Ru  Ru11  1  0.75000000  0.72572845  0.85395048  1.0
  C  C12  1  0.25000000  0.69676510  0.52765381  1.0
  C  C13  1  0.75000000  0.80323490  0.02765381  1.0
  C  C14  1  0.25000000  0.19676510  0.97234619  1.0
  C  C15  1  0.75000000  0.30323490  0.47234619  1.0
  C  C16  1  0.25000000  0.03409504  0.25573531  1.0
  C  C17  1  0.75000000  0.46590496  0.75573531  1.0
  C  C18  1  0.25000000  0.53409504  0.24426469  1.0
  C  C19  1  0.75000000  0.96590496  0.74426469  1.0