data_Mn2InSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.71
_cell_length_b   4.71
_cell_length_c   3.35
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   103.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2InSe
_chemical_formula_sum   'Mn2 In1 Se1'
_cell_volume   72.24
_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  Mn1  1  0.46  0.15  0.67  1.0
  Mn  Mn2  1  0.46  0.85  0.67  1.0
  In  In0  1  0.91  0.0  0.0  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

data_Mn2InSe
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.35
_cell_length_b   4.71
_cell_length_c   4.71
_cell_angle_alpha   103.68
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2InSe
_chemical_formula_sum   'Mn2 In1 Se1'
_cell_volume   72.24
_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  0.67  0.46  0.15  1.0
  Mn  Mn1  1  0.67  0.46  0.85  1.0
  In  In2  1  0.0  0.91  0.0  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

Mn Mn In Se