data_InB2Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.65
_cell_length_b   5.65
_cell_length_c   3.03
_cell_angle_alpha   91.15
_cell_angle_beta   91.15
_cell_angle_gamma   32.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InB2Mo
_chemical_formula_sum   'In1 B2 Mo1'
_cell_volume   51.51
_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
  In  In2  1  0.87  0.0  0.18  1.0
  B  B0  1  0.16  0.0  0.62  1.0
  B  B1  1  0.9  0.0  0.12  1.0
  Mo  Mo3  1  0.21  0.0  0.65  1.0

data_InB2Mo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.03
_cell_length_b   3.13
_cell_length_c   5.65
_cell_angle_alpha   106.09
_cell_angle_beta   91.15
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InB2Mo
_chemical_formula_sum   'In1 B2 Mo1'
_cell_volume   51.51
_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
  In  In0  1  0.82  0.0  0.13  1.0
  B  B1  1  0.38  0.0  0.84  1.0
  B  B2  1  0.88  0.0  0.1  1.0
  Mo  Mo3  1  0.35  0.0  0.79  1.0

In B B Mo