data_[Mn2V1In1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  V  1.6300  1.3500  0.7775
  In  1.7800  1.5500  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.1798]
_cell_length_b [5.2827]
_cell_length_c [5.6269]
_cell_angle_alpha [117.7622]
_cell_angle_beta [90.0145]
_cell_angle_gamma [117.7966]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Mn2VInO6]
_chemical_formula_sum '[Mn2 V1 In1 O6]'
_cell_volume [115.7783]
_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
[
  Mn  Mn0  1  0.0213  0.0327  0.0415  1
  Mn  Mn1  1  0.5280  0.0531  0.5815  1
  V  V2  1  0.3226  0.6257  0.9552  1
  In  In3  1  0.8153  0.6069  0.4127  1
  O  O4  1  0.1287  0.8442  0.2298  1
  O  O5  1  0.2003  0.8136  0.7604  1
  O  O6  1  0.4096  0.5369  0.2414  1
  O  O7  1  0.5651  0.5273  0.7468  1
  O  O8  1  0.7216  0.1088  0.2320  1
  O  O9  1  0.9492  0.1739  0.7834  1
]