data_[Mn6Cr4C4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Cr  1.6600  1.4000  0.9400
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.2733]
_cell_length_b [2.6726]
_cell_length_c [6.3090]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.2929]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mn3(CrC)2]
_chemical_formula_sum '[Mn6 Cr4 C4]'
_cell_volume [128.1287]
_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
[
  Mn  Mn0  4  0.1131  0.5000  0.4287  1.0
  Mn  Mn1  2  0.0000  0.5000  0.0000  1.0
  Cr  Cr2  4  0.1655  0.0000  0.8019  1.0
  C  C3  4  0.1587  0.0000  0.2293  1.0
]