Re2Fe(MoS4)2 crystallizes in the orthorhombic Imm2 space group. Mo(1) is bonded in a 6-coordinate geometry to one S(1), one S(3), two equivalent S(2), and two equivalent S(4) atoms. Re(1) is bonded in a 6-coordinate geometry to one S(2), one S(4), two equivalent S(1), and two equivalent S(3) atoms. Fe(1) is bonded in a tetrahedral geometry to two equivalent S(3) and two equivalent S(4) atoms. There are four inequivalent S sites. In the first S site, S(1) is bonded in a 3-coordinate geometry to one Mo(1) and two equivalent Re(1) atoms. In the second S site, S(2) is bonded in a 3-coordinate geometry to two equivalent Mo(1) and one Re(1) atom. In the third S site, S(3) is bonded to one Mo(1), two equivalent Re(1), and one Fe(1) atom to form SFeRe2Mo tetrahedra that share  a cornercorner with one S(3)FeRe2Mo tetrahedra, corners with two equivalent S(4)FeReMo2 tetrahedra,  an edgeedge with one S(3)FeRe2Mo tetrahedra, and edges with two equivalent S(4)FeReMo2 tetrahedra. In the fourth S site, S(4) is bonded to two equivalent Mo(1), one Re(1), and one Fe(1) atom to form distorted SFeReMo2 tetrahedra that share  a cornercorner with one S(4)FeReMo2 tetrahedra, corners with two equivalent S(3)FeRe2Mo tetrahedra,  an edgeedge with one S(4)FeReMo2 tetrahedra, and edges with two equivalent S(3)FeRe2Mo tetrahedra.
Re2Fe(MoS4)2 crystallizes in the orthorhombic Imm2 space group. Mo(1) is bonded in a 6-coordinate geometry to one S(1), one S(3), two equivalent S(2), and two equivalent S(4) atoms. The Mo(1)-S(1) bond length is 2.35 Å. The Mo(1)-S(3) bond length is 2.60 Å. Both Mo(1)-S(2) bond lengths are 2.34 Å. Both Mo(1)-S(4) bond lengths are 2.61 Å. Re(1) is bonded in a 6-coordinate geometry to one S(2), one S(4), two equivalent S(1), and two equivalent S(3) atoms. The Re(1)-S(2) bond length is 2.35 Å. The Re(1)-S(4) bond length is 2.53 Å. Both Re(1)-S(1) bond lengths are 2.34 Å. Both Re(1)-S(3) bond lengths are 2.55 Å. Fe(1) is bonded in a tetrahedral geometry to two equivalent S(3) and two equivalent S(4) atoms. Both Fe(1)-S(3) bond lengths are 2.30 Å. Both Fe(1)-S(4) bond lengths are 2.27 Å. There are four inequivalent S sites. In the first S site, S(1) is bonded in a 3-coordinate geometry to one Mo(1) and two equivalent Re(1) atoms. In the second S site, S(2) is bonded in a 3-coordinate geometry to two equivalent Mo(1) and one Re(1) atom. In the third S site, S(3) is bonded to one Mo(1), two equivalent Re(1), and one Fe(1) atom to form SFeRe2Mo tetrahedra that share  a cornercorner with one S(3)FeRe2Mo tetrahedra, corners with two equivalent S(4)FeReMo2 tetrahedra,  an edgeedge with one S(3)FeRe2Mo tetrahedra, and edges with two equivalent S(4)FeReMo2 tetrahedra. In the fourth S site, S(4) is bonded to two equivalent Mo(1), one Re(1), and one Fe(1) atom to form distorted SFeReMo2 tetrahedra that share  a cornercorner with one S(4)FeReMo2 tetrahedra, corners with two equivalent S(3)FeRe2Mo tetrahedra,  an edgeedge with one S(4)FeReMo2 tetrahedra, and edges with two equivalent S(3)FeRe2Mo tetrahedra.