Th3S is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. There are two inequivalent Th sites. In the first Th site, Th(1) is bonded to four equivalent S(1) atoms to form a mixture of distorted edge and corner-sharing ThS4 cuboctahedra. In the second Th site, Th(2) is bonded in a square co-planar geometry to four equivalent S(1) atoms. S(1) is bonded to four equivalent Th(2) and eight equivalent Th(1) atoms to form a mixture of edge, face, and corner-sharing STh12 cuboctahedra.
Th3S is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. There are two inequivalent Th sites. In the first Th site, Th(1) is bonded to four equivalent S(1) atoms to form a mixture of distorted edge and corner-sharing ThS4 cuboctahedra. All Th(1)-S(1) bond lengths are 3.43 Å. In the second Th site, Th(2) is bonded in a square co-planar geometry to four equivalent S(1) atoms. All Th(2)-S(1) bond lengths are 3.29 Å. S(1) is bonded to four equivalent Th(2) and eight equivalent Th(1) atoms to form a mixture of edge, face, and corner-sharing STh12 cuboctahedra.