The crystal structure described by Mo2Ni3P crystallizes in the hexagonal P6_3/mmc space group. Mo(1) is bonded in a 16-coordinate geometry to four equivalent Mo(1), nine equivalent Ni(1), and three equivalent P(1) atoms. Ni(1) is bonded to six equivalent Mo(1), four equivalent Ni(1), and two equivalent P(1) atoms to form a mixture of distorted edge, face, and corner-sharing NiNi4Mo6P2 cuboctahedra. P(1) is bonded in a 6-coordinate geometry to six equivalent Mo(1) and six equivalent Ni(1) atoms. is represented by the CIF card [CIF]
data_Ni3Mo2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.755
_cell_length_b   4.755
_cell_length_c   7.389
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   144.689
_cell_formula_units_Z   2
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
  Ni  Ni0  1  0.832  0.168  0.250  1.0
  Ni  Ni1  1  0.832  0.664  0.250  1.0
  Ni  Ni2  1  0.336  0.168  0.250  1.0
  Ni  Ni3  1  0.168  0.832  0.750  1.0
  Ni  Ni4  1  0.168  0.336  0.750  1.0
  Ni  Ni5  1  0.664  0.832  0.750  1.0
  Mo  Mo6  1  0.333  0.667  0.436  1.0
  Mo  Mo7  1  0.667  0.333  0.564  1.0
  Mo  Mo8  1  0.667  0.333  0.936  1.0
  Mo  Mo9  1  0.333  0.667  0.064  1.0
  P  P10  1  0.000  0.000  0.500  1.0
  P  P11  1  0.000  0.000  0.000  1.0
[/CIF]
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The crystal structure described by Mo2Ni3P crystallizes in the hexagonal P6_3/mmc space group. Mo(1) is bonded in a 16-coordinate geometry to four equivalent Mo(1), nine equivalent Ni(1), and three equivalent P(1) atoms. Ni(1) is bonded to six equivalent Mo(1), four equivalent Ni(1), and two equivalent P(1) atoms to form a mixture of distorted edge, face, and corner-sharing NiNi4Mo6P2 cuboctahedra. P(1) is bonded in a 6-coordinate geometry to six equivalent Mo(1) and six equivalent Ni(1) atoms. is represented by the CIF card [CIF]
data_Ni3Mo2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.755
_cell_length_b   4.755
_cell_length_c   7.389
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   144.689
_cell_formula_units_Z   2
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
  Ni  Ni0  1  0.832  0.168  0.250  1.0
  Ni  Ni1  1  0.832  0.664  0.250  1.0
  Ni  Ni2  1  0.336  0.168  0.250  1.0
  Ni  Ni3  1  0.168  0.832  0.750  1.0
  Ni  Ni4  1  0.168  0.336  0.750  1.0
  Ni  Ni5  1  0.664  0.832  0.750  1.0
  Mo  Mo6  1  0.333  0.667  0.436  1.0
  Mo  Mo7  1  0.667  0.333  0.564  1.0
  Mo  Mo8  1  0.667  0.333  0.936  1.0
  Mo  Mo9  1  0.333  0.667  0.064  1.0
  P  P10  1  0.000  0.000  0.500  1.0
  P  P11  1  0.000  0.000  0.000  1.0
[/CIF]
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