data_In2CoMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45
_cell_length_b   5.45
_cell_length_c   5.45
_cell_angle_alpha   147.78
_cell_angle_beta   125.57
_cell_angle_gamma   64.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2CoMo
_chemical_formula_sum   'In2 Co1 Mo1'
_cell_volume   69.44
_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  In1  1  0.0  0.49  0.53  1.0
  In  In2  1  0.51  0.0  0.08  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0
  Mo  Mo3  1  0.0  0.0  0.61  1.0

data_In2CoMo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.02
_cell_length_b   4.99
_cell_length_c   5.45
_cell_angle_alpha   117.22
_cell_angle_beta   106.11
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2CoMo
_chemical_formula_sum   'In2 Co1 Mo1'
_cell_volume   69.44
_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  0.43  0.92  0.43  1.0
  In  In1  1  0.47  0.97  0.97  1.0
  Co  Co2  1  0.0  0.0  0.0  1.0
  Mo  Mo3  1  0.39  0.39  0.39  1.0

In In Co Mo
In In Co Mo 0 2 o + + 0 2 o o o 0 1 o + + 0 1 - o o 0 3 o + o 1 3 o o - 1 3 + o o 1 1 o + + 1 2 o o o 1 2 + o o 2 3 o o - 
MoCoIn2 crystallizes in the triclinic P1 space group. Mo(1) is bonded in a 8-coordinate geometry to two equivalent Mo(1), two equivalent Co(1), two equivalent In(1), and two equivalent In(2) atoms. Both Mo(1)-Mo(1) bond lengths are 3.02 Å. There is one shorter (2.15 Å) and one longer (3.30 Å) Mo(1)-Co(1) bond length. There is one shorter (2.41 Å) and one longer (3.06 Å) Mo(1)-In(1) bond length. There is one shorter (2.46 Å) and one longer (2.54 Å) Mo(1)-In(2) bond length. Co(1) is bonded in a 3-coordinate geometry to two equivalent Mo(1) and two equivalent In(1) atoms. There is one shorter (1.49 Å) and one longer (1.55 Å) Co(1)-In(1) bond length. There are two inequivalent In sites. In the first In site, In(1) is bonded in a distorted linear geometry to two equivalent Mo(1) and two equivalent Co(1) atoms. In the second In site, In(2) is bonded in a 2-coordinate geometry to two equivalent Mo(1) atoms.