data_[Er4Mn2Si4Mo2C2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Mn  1.5500  1.4000  0.6483
  Si  1.9000  1.1000  0.5400
  Mo  2.1600  1.4500  0.7750
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.8214]
_cell_length_b [3.7588]
_cell_length_c [6.9846]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.3595]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Er2MnSi2MoC]
_chemical_formula_sum '[Er4 Mn2 Si4 Mo2 C2]'
_cell_volume [228.7928]
_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
[
  Er  Er0  2  0.0701  0.5000  0.2934  1
  Er  Er1  2  0.4262  0.0000  0.7041  1
  Mn  Mn2  2  0.2941  0.5000  0.9173  1
  Si  Si3  2  0.1482  0.0000  0.6812  1
  Si  Si4  2  0.3719  0.5000  0.3301  1
  Mo  Mo5  2  0.2014  0.0000  0.0810  1
  C  C6  2  0.4881  0.5000  0.9929  1
]