data_[Ca4Mn2Rh2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Mn  1.5500  1.4000  0.6483
  Rh  2.2800  1.3500  0.7450
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.4399]
_cell_length_b [5.4333]
_cell_length_c [5.5026]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.7592]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ca2MnRhO6]
_chemical_formula_sum '[Ca4 Mn2 Rh2 O12]'
_cell_volume [229.0233]
_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
[
  Ca  Ca0  4  0.2498  0.0000  0.7347  1.0
  Mn  Mn1  2  0.0000  0.5000  0.5000  1.0
  Rh  Rh2  2  0.0000  0.0000  0.0000  1.0
  O  O3  8  0.0562  0.2546  0.3079  1.0
  O  O4  4  0.2451  0.5000  0.8435  1.0
]