data_In3Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.87
_cell_length_b   9.12
_cell_length_c   5.68
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In3Mo
_chemical_formula_sum   'In12 Mo4'
_cell_volume   355.53
_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
  In  In0  1  0.04  0.84  0.76  1.0
  In  In1  1  0.4  0.28  0.6  1.0
  In  In2  1  0.47  0.84  0.08  1.0
  In  In3  1  0.83  0.28  0.92  1.0
  In  In4  1  0.27  0.81  0.43  1.0
  In  In5  1  0.16  0.31  0.59  1.0
  In  In6  1  0.7  0.87  0.08  1.0
  In  In7  1  0.6  0.25  0.24  1.0
  In  In8  1  0.6  0.31  0.24  1.0
  In  In9  1  0.7  0.81  0.08  1.0
  In  In10  1  0.16  0.25  0.59  1.0
  In  In11  1  0.27  0.87  0.43  1.0
  Mo  Mo12  1  0.92  0.84  0.59  1.0
  Mo  Mo13  1  0.38  0.28  0.75  1.0
  Mo  Mo14  1  0.49  0.84  0.93  1.0
  Mo  Mo15  1  0.95  0.28  0.09  1.0

data_In3Mo
_symmetry_space_group_name_H-M   P-1
_cell_length_a   5.68
_cell_length_b   6.87
_cell_length_c   9.12
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   In3Mo
_chemical_formula_sum   'In12 Mo4'
_cell_volume   355.53
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  In  In0  2  0.09  0.84  0.75  1.0
  In  In1  2  0.09  0.84  0.81  1.0
  In  In2  2  0.26  0.73  0.25  1.0
  In  In3  2  0.26  0.73  0.19  1.0
  In  In4  2  0.26  0.96  0.22  1.0
  In  In5  2  0.42  0.6  0.78  1.0
  Mo  Mo6  2  0.25  0.49  0.78  1.0
  Mo  Mo7  2  0.41  0.95  0.22  1.0

In In In In In In In In In In In In Mo Mo Mo Mo