# generated using pymatgen
data_Mg6FeC
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.88730517
_cell_length_b   6.88730517
_cell_length_c   3.16997100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   94.15573298
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg6FeC
_chemical_formula_sum   'Mg6 Fe1 C1'
_cell_volume   149.97213543
_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
  Mg  Mg0  1  0.94756100  0.71079400  0.50000000  1.0
  Mg  Mg1  1  0.28920600  0.05243900  0.50000000  1.0
  Mg  Mg2  1  0.84615500  0.15384500  0.50000000  1.0
  Mg  Mg3  1  0.60224700  0.85713400  0.00000000  1.0
  Mg  Mg4  1  0.14286600  0.39775300  0.00000000  1.0
  Mg  Mg5  1  0.59177900  0.40822100  0.00000000  1.0
  Fe  Fe6  1  0.33156300  0.66843700  0.50000000  1.0
  C  C7  1  0.24862300  0.75137700  0.00000000  1.0