data_[Mn2P2Au2C2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  P  2.1900  1.0000  0.5500
  Au  2.5400  1.3500  1.0700
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [7.3253]
_cell_length_b [2.9144]
_cell_length_c [6.4244]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.2340]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [MnPAuC]
_chemical_formula_sum '[Mn2 P2 Au2 C2]'
_cell_volume [118.4972]
_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  2  0.1999  0.5000  0.5651  1
  P  P1  2  0.3158  0.0000  0.3479  1
  Au  Au2  2  0.1465  0.0000  0.9261  1
  C  C3  2  0.4675  0.5000  0.5319  1
]