data_[Tm1Co2Sn1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Co  1.8800  1.3500  0.7683
  Sn  1.9600  1.4500  0.8300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.2457]
_cell_length_b [5.3010]
_cell_length_c [5.6465]
_cell_angle_alpha [62.4000]
_cell_angle_beta [63.8957]
_cell_angle_gamma [61.5195]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [TmCo2SnO6]
_chemical_formula_sum '[Tm1 Co2 Sn1 O6]'
_cell_volume [117.3702]
_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
[
  Tm  Tm0  1  0.8083  0.8065  0.5841  1
  Co  Co1  1  0.0190  0.0074  0.9643  1
  Co  Co2  1  0.5242  0.5279  0.4261  1
  Sn  Sn3  1  0.3187  0.3210  0.0509  1
  O  O4  1  0.1260  0.3670  0.7657  1
  O  O5  1  0.2203  0.9213  0.2302  1
  O  O6  1  0.3854  0.7221  0.7433  1
  O  O7  1  0.6034  0.2292  0.2581  1
  O  O8  1  0.7352  0.1297  0.7662  1
  O  O9  1  0.9212  0.6294  0.2263  1
]