The crystal structure described by Ga5(PS)3 crystallizes in the orthorhombic Pmm2 space group. There are three inequivalent Ga sites. In the first Ga site, Ga(1) is bonded to one P(1), one S(2), and two equivalent S(1) atoms to form GaPS3 tetrahedra that share  a cornercorner with one Ga(2)P4 tetrahedra, corners with three equivalent Ga(1)PS3 tetrahedra, and corners with four equivalent Ga(3)P3S tetrahedra. In the second Ga site, Ga(2) is bonded to two equivalent P(1) and two equivalent P(2) atoms to form GaP4 tetrahedra that share corners with two equivalent Ga(2)P4 tetrahedra, corners with two equivalent Ga(1)PS3 tetrahedra, and corners with eight equivalent Ga(3)P3S tetrahedra. In the third Ga site, Ga(3) is bonded to one P(2), two equivalent P(1), and one S(1) atom to form GaP3S tetrahedra that share corners with three equivalent Ga(3)P3S tetrahedra, corners with four equivalent Ga(2)P4 tetrahedra, and corners with four equivalent Ga(1)PS3 tetrahedra. There are two inequivalent P sites. In the first P site, P(1) is bonded to one Ga(1), one Ga(2), and two equivalent Ga(3) atoms to form corner-sharing PGa4 tetrahedra. In the second P site, P(2) is bonded to two equivalent Ga(2) and two equivalent Ga(3) atoms to form corner-sharing PGa4 tetrahedra. There are two inequivalent S sites. In the first S site, S(1) is bonded in a trigonal non-coplanar geometry to one Ga(3) and two equivalent Ga(1) atoms. In the second S site, S(2) is bonded in a water-like geometry to two equivalent Ga(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Ga5(PS)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.788
_cell_length_b   22.855
_cell_length_c   6.616
_cell_angle_alpha   29.722
_cell_angle_beta   55.068
_cell_angle_gamma   60.177
_symmetry_Int_Tables_number   1
_cell_volume   232.827
_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
  Ga  Ga0  1  0.999  0.009  0.974  1.0
  Ga  Ga1  1  0.999  0.324  0.028  1.0
  Ga  Ga2  1  0.010  0.667  0.990  1.0
  Ga  Ga3  1  0.006  0.497  0.004  1.0
  Ga  Ga4  1  0.006  0.837  0.984  1.0
  P  P5  1  0.253  0.494  0.265  1.0
  P  P6  1  0.255  0.667  0.245  1.0
  P  P7  1  0.253  0.839  0.230  1.0
  S  S8  1  0.240  0.006  0.240  1.0
  S  S9  1  0.239  0.167  0.262  1.0
  S  S10  1  0.241  0.327  0.279  1.0
[/CIF]
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The crystal structure described by Ga5(PS)3 crystallizes in the orthorhombic Pmm2 space group. There are three inequivalent Ga sites. In the first Ga site, Ga(1) is bonded to one P(1), one S(2), and two equivalent S(1) atoms to form GaPS3 tetrahedra that share  a cornercorner with one Ga(2)P4 tetrahedra, corners with three equivalent Ga(1)PS3 tetrahedra, and corners with four equivalent Ga(3)P3S tetrahedra. In the second Ga site, Ga(2) is bonded to two equivalent P(1) and two equivalent P(2) atoms to form GaP4 tetrahedra that share corners with two equivalent Ga(2)P4 tetrahedra, corners with two equivalent Ga(1)PS3 tetrahedra, and corners with eight equivalent Ga(3)P3S tetrahedra. In the third Ga site, Ga(3) is bonded to one P(2), two equivalent P(1), and one S(1) atom to form GaP3S tetrahedra that share corners with three equivalent Ga(3)P3S tetrahedra, corners with four equivalent Ga(2)P4 tetrahedra, and corners with four equivalent Ga(1)PS3 tetrahedra. There are two inequivalent P sites. In the first P site, P(1) is bonded to one Ga(1), one Ga(2), and two equivalent Ga(3) atoms to form corner-sharing PGa4 tetrahedra. In the second P site, P(2) is bonded to two equivalent Ga(2) and two equivalent Ga(3) atoms to form corner-sharing PGa4 tetrahedra. There are two inequivalent S sites. In the first S site, S(1) is bonded in a trigonal non-coplanar geometry to one Ga(3) and two equivalent Ga(1) atoms. In the second S site, S(2) is bonded in a water-like geometry to two equivalent Ga(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Ga5(PS)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.788
_cell_length_b   22.855
_cell_length_c   6.616
_cell_angle_alpha   29.722
_cell_angle_beta   55.068
_cell_angle_gamma   60.177
_symmetry_Int_Tables_number   1
_cell_volume   232.827
_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
  Ga  Ga0  1  0.999  0.009  0.974  1.0
  Ga  Ga1  1  0.999  0.324  0.028  1.0
  Ga  Ga2  1  0.010  0.667  0.990  1.0
  Ga  Ga3  1  0.006  0.497  0.004  1.0
  Ga  Ga4  1  0.006  0.837  0.984  1.0
  P  P5  1  0.253  0.494  0.265  1.0
  P  P6  1  0.255  0.667  0.245  1.0
  P  P7  1  0.253  0.839  0.230  1.0
  S  S8  1  0.240  0.006  0.240  1.0
  S  S9  1  0.239  0.167  0.262  1.0
  S  S10  1  0.241  0.327  0.279  1.0
[/CIF]
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