data_[Ca4Mn4Ge4O16]
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
  Ge  2.0100  1.2500  0.7700
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [6.0995]
_cell_length_b [9.4140]
_cell_length_c [6.6802]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [CaMnGeO4]
_chemical_formula_sum '[Ca4 Mn4 Ge4 O16]'
_cell_volume [383.5843]
_cell_formula_units_Z [4]
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  0.0000  0.5000  0.0000  1.0
  Mn  Mn1  4  0.0000  0.1615  0.2500  1.0
  Ge  Ge2  4  0.0000  0.1444  0.7500  1.0
  O  O3  8  0.0000  0.2513  0.5323  1.0
  O  O4  8  0.2251  0.0193  0.7500  1.0
]