The structure described by Mo5As4 is Titanium telluride structured and crystallizes in the tetragonal I4/m space group. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 7-coordinate geometry to two equivalent Mo(2) and five equivalent As(1) atoms. In the second Mo site, Mo(2) is bonded to eight equivalent Mo(1) and four equivalent As(1) atoms to form face-sharing MoMo8As4 cuboctahedra. As(1) is bonded in a 6-coordinate geometry to one Mo(2) and five equivalent Mo(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Mo5As4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.294
_cell_length_b   7.004
_cell_length_c   7.004
_cell_angle_alpha   86.831
_cell_angle_beta   76.401
_cell_angle_gamma   76.401
_symmetry_Int_Tables_number   1
_cell_volume   152.643
_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
  Mo  Mo0  1  0.701  0.919  0.678  1.0
  Mo  Mo1  1  0.379  0.322  0.919  1.0
  Mo  Mo2  1  0.621  0.678  0.081  1.0
  Mo  Mo3  1  0.299  0.081  0.322  1.0
  Mo  Mo4  1  0.000  0.000  0.000  1.0
  As  As5  1  0.943  0.773  0.342  1.0
  As  As6  1  0.285  0.658  0.773  1.0
  As  As7  1  0.715  0.342  0.227  1.0
  As  As8  1  0.057  0.227  0.658  1.0
[/CIF]
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The structure described by Mo5As4 is Titanium telluride structured and crystallizes in the tetragonal I4/m space group. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 7-coordinate geometry to two equivalent Mo(2) and five equivalent As(1) atoms. In the second Mo site, Mo(2) is bonded to eight equivalent Mo(1) and four equivalent As(1) atoms to form face-sharing MoMo8As4 cuboctahedra. As(1) is bonded in a 6-coordinate geometry to one Mo(2) and five equivalent Mo(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Mo5As4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.294
_cell_length_b   7.004
_cell_length_c   7.004
_cell_angle_alpha   86.831
_cell_angle_beta   76.401
_cell_angle_gamma   76.401
_symmetry_Int_Tables_number   1
_cell_volume   152.643
_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
  Mo  Mo0  1  0.701  0.919  0.678  1.0
  Mo  Mo1  1  0.379  0.322  0.919  1.0
  Mo  Mo2  1  0.621  0.678  0.081  1.0
  Mo  Mo3  1  0.299  0.081  0.322  1.0
  Mo  Mo4  1  0.000  0.000  0.000  1.0
  As  As5  1  0.943  0.773  0.342  1.0
  As  As6  1  0.285  0.658  0.773  1.0
  As  As7  1  0.715  0.342  0.227  1.0
  As  As8  1  0.057  0.227  0.658  1.0
[/CIF]
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