data_[Ca3Fe5Sn3O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Fe  1.8300  1.4000  0.8525
  Sn  1.9600  1.4500  0.8300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [9.4349]
_cell_length_b [3.1357]
_cell_length_c [10.9723]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.1165]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Ca3Fe5Sn3O16]
_chemical_formula_sum '[Ca3 Fe5 Sn3 O16]'
_cell_volume [324.6178]
_cell_formula_units_Z [1]
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  1  0.2477  0.0000  0.6587  1
  Ca  Ca1  1  0.2598  0.5000  0.1494  1
  Ca  Ca2  1  0.7416  0.0000  0.8538  1
  Fe  Fe3  1  0.0689  0.0000  0.8868  1
  Fe  Fe4  1  0.0804  0.0000  0.3939  1
  Fe  Fe5  1  0.4159  0.5000  0.8939  1
  Fe  Fe6  1  0.5640  0.0000  0.6203  1
  Fe  Fe7  1  0.5740  0.0000  0.1032  1
  Sn  Sn8  1  0.4506  0.5000  0.3899  1
  Sn  Sn9  1  0.9095  0.5000  0.5977  1
  Sn  Sn10  1  0.9260  0.5000  0.1182  1
  O  O11  1  0.0410  0.5000  0.2815  1
  O  O12  1  0.0809  0.0000  0.0765  1
  O  O13  1  0.1196  0.5000  0.5213  1
  O  O14  1  0.2103  0.5000  0.8331  1
  O  O15  1  0.2967  0.0000  0.3373  1
  O  O16  1  0.3774  0.0000  0.0226  1
  O  O17  1  0.4109  0.5000  0.5777  1
  O  O18  1  0.4752  0.0000  0.7884  1
  O  O19  1  0.5091  0.5000  0.2075  1
  O  O20  1  0.5795  0.0000  0.4350  1
  O  O21  1  0.6129  0.5000  0.9786  1
  O  O22  1  0.7089  0.5000  0.6754  1
  O  O23  1  0.7881  0.0000  0.1444  1
  O  O24  1  0.8877  0.0000  0.4770  1
  O  O25  1  0.9151  0.5000  0.9283  1
  O  O26  1  0.9740  0.0000  0.7166  1
]