# generated using pymatgen
data_SmTiFe11C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89482100
_cell_length_b   6.51559400
_cell_length_c   6.51559400
_cell_angle_alpha   97.73667129
_cell_angle_beta   112.06285208
_cell_angle_gamma   67.93714792
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmTiFe11C
_chemical_formula_sum   'Sm1 Ti1 Fe11 C1'
_cell_volume   178.47552155
_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
  Sm  Sm0  1  0.00745800  0.99254200  0.00745800  1.0
  Ti  Ti1  1  0.63339100  0.36660900  0.63339100  1.0
  Fe  Fe2  1  0.72526400  0.77473600  0.22526400  1.0
  Fe  Fe3  1  0.27669300  0.22330700  0.77669300  1.0
  Fe  Fe4  1  0.49789800  0.78156500  0.77736100  1.0
  Fe  Fe5  1  0.49789800  0.22263900  0.21843500  1.0
  Fe  Fe6  1  0.49999700  0.99784600  0.49895900  1.0
  Fe  Fe7  1  0.00111600  0.99784600  0.49895900  1.0
  Fe  Fe8  1  0.49999700  0.50104100  0.00215400  1.0
  Fe  Fe9  1  0.00111600  0.50104100  0.00215400  1.0
  Fe  Fe10  1  0.35738600  0.64261400  0.35738600  1.0
  Fe  Fe11  1  0.00020500  0.35909700  0.35950700  1.0
  Fe  Fe12  1  0.00020500  0.64049300  0.64090300  1.0
  C  C13  1  0.50137600  0.99862400  0.00137600  1.0