The crystal structure described by Mo2As3P is Magnesium tetraboride-derived structured and crystallizes in the monoclinic Cm space group. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 8-coordinate geometry to two equivalent As(2), two equivalent As(3), three equivalent As(1), and one P(1) atom. In the second Mo site, Mo(2) is bonded in a 8-coordinate geometry to one As(3), two equivalent As(1), three equivalent As(2), and two equivalent P(1) atoms. There are three inequivalent As sites. In the first As site, As(1) is bonded in a 8-coordinate geometry to two equivalent Mo(2), three equivalent Mo(1), and three equivalent As(2) atoms. In the second As site, As(2) is bonded in a 8-coordinate geometry to two equivalent Mo(1), three equivalent Mo(2), and three equivalent As(1) atoms. In the third As site, As(3) is bonded in a 6-coordinate geometry to one Mo(2), two equivalent Mo(1), and three equivalent P(1) atoms. P(1) is bonded in a 6-coordinate geometry to one Mo(1), two equivalent Mo(2), and three equivalent As(3) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Mo2As3P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.791
_cell_length_b   4.791
_cell_length_c   7.762
_cell_angle_alpha   62.127
_cell_angle_beta   62.127
_cell_angle_gamma   40.054
_symmetry_Int_Tables_number   1
_cell_volume   99.445
_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  0.846  0.846  0.207  1.0
  Mo  Mo1  1  0.163  0.163  0.789  1.0
  As  As2  1  0.600  0.600  0.110  1.0
  As  As3  1  0.407  0.407  0.891  1.0
  As  As4  1  0.134  0.134  0.474  1.0
  P  P5  1  0.850  0.850  0.529  1.0
[/CIF]
.
The crystal structure described by Mo2As3P is Magnesium tetraboride-derived structured and crystallizes in the monoclinic Cm space group. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 8-coordinate geometry to two equivalent As(2), two equivalent As(3), three equivalent As(1), and one P(1) atom. In the second Mo site, Mo(2) is bonded in a 8-coordinate geometry to one As(3), two equivalent As(1), three equivalent As(2), and two equivalent P(1) atoms. There are three inequivalent As sites. In the first As site, As(1) is bonded in a 8-coordinate geometry to two equivalent Mo(2), three equivalent Mo(1), and three equivalent As(2) atoms. In the second As site, As(2) is bonded in a 8-coordinate geometry to two equivalent Mo(1), three equivalent Mo(2), and three equivalent As(1) atoms. In the third As site, As(3) is bonded in a 6-coordinate geometry to one Mo(2), two equivalent Mo(1), and three equivalent P(1) atoms. P(1) is bonded in a 6-coordinate geometry to one Mo(1), two equivalent Mo(2), and three equivalent As(3) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Mo2As3P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.791
_cell_length_b   4.791
_cell_length_c   7.762
_cell_angle_alpha   62.127
_cell_angle_beta   62.127
_cell_angle_gamma   40.054
_symmetry_Int_Tables_number   1
_cell_volume   99.445
_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  0.846  0.846  0.207  1.0
  Mo  Mo1  1  0.163  0.163  0.789  1.0
  As  As2  1  0.600  0.600  0.110  1.0
  As  As3  1  0.407  0.407  0.891  1.0
  As  As4  1  0.134  0.134  0.474  1.0
  P  P5  1  0.850  0.850  0.529  1.0
[/CIF]
.