data_Cd2MoP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.84
_cell_length_b   5.23
_cell_length_c   4.98
_cell_angle_alpha   90.0
_cell_angle_beta   97.98
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2MoP
_chemical_formula_sum   'Cd2 Mo1 P1'
_cell_volume   73.29
_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
  Cd  Cd0  1  0.56  0.61  0.7  1.0
  Cd  Cd1  1  0.59  0.61  0.23  1.0
  Mo  Mo2  1  0.65  0.0  0.47  1.0
  P  P3  1  0.0  0.0  0.0  1.0

data_Cd2MoP
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.84
_cell_length_b   4.98
_cell_length_c   5.23
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   97.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2MoP
_chemical_formula_sum   'Cd2 Mo1 P1'
_cell_volume   73.29
_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
  Cd  Cd0  1  0.41  0.77  0.39  1.0
  Cd  Cd1  1  0.44  0.3  0.39  1.0
  Mo  Mo2  1  0.35  0.53  0.0  1.0
  P  P3  1  0.0  0.0  0.0  1.0

Cd Cd Mo P
Cd Cd Mo P 0 0 + o o 0 2 o + o 0 1 o o o 0 1 o o + 0 3 + + + 0 3 o + + 1 3 o + o 1 3 + + o 1 1 + o o 1 2 o + o 2 3 o o o 2 3 + o o 2 3 + o + 2 2 + o o 3 3 + o o 
MoCd2P crystallizes in the triclinic P1 space group. Mo(1) is bonded in a 2-coordinate geometry to one Cd(1), two equivalent Cd(2), and three equivalent P(1) atoms. The Mo(1)-Cd(1) bond length is 2.36 Å. There is one shorter (2.32 Å) and one longer (3.41 Å) Mo(1)-Cd(2) bond length. There are a spread of Mo(1)-P(1) bond distances ranging from 2.64-2.77 Å. There are two inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a 1-coordinate geometry to one Mo(1), two equivalent Cd(2), and two equivalent P(1) atoms. There is one shorter (2.33 Å) and one longer (2.66 Å) Cd(1)-Cd(2) bond length. There is one shorter (2.72 Å) and one longer (3.08 Å) Cd(1)-P(1) bond length. In the second Cd site, Cd(2) is bonded in a 8-coordinate geometry to two equivalent Mo(1), two equivalent Cd(1), two equivalent Cd(2), and two equivalent P(1) atoms. Both Cd(2)-Cd(2) bond lengths are 2.84 Å. There is one shorter (2.68 Å) and one longer (2.78 Å) Cd(2)-P(1) bond length. P(1) is bonded in a 9-coordinate geometry to three equivalent Mo(1), two equivalent Cd(1), two equivalent Cd(2), and two equivalent P(1) atoms. Both P(1)-P(1) bond lengths are 2.84 Å.