Mn4N2Te3 crystallizes in the orthorhombic Pnma space group. There are three inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a distorted L-shaped geometry to two equivalent N(1), one Te(1), and two equivalent Te(2) atoms. In the second Mn site, Mn(2) is bonded in a distorted water-like geometry to two equivalent N(1) and two equivalent Te(1) atoms. In the third Mn site, Mn(3) is bonded in a distorted L-shaped geometry to two equivalent N(1), one Te(1), and three equivalent Te(2) atoms. N(1) is bonded in a distorted see-saw-like geometry to one Mn(1), one Mn(2), and two equivalent Mn(3) atoms. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded in a 5-coordinate geometry to one Mn(1), two equivalent Mn(2), and two equivalent Mn(3) atoms. In the second Te site, Te(2) is bonded in a 4-coordinate geometry to one Mn(1) and three equivalent Mn(3) atoms.
Mn4N2Te3 crystallizes in the orthorhombic Pnma space group. There are three inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a distorted L-shaped geometry to two equivalent N(1), one Te(1), and two equivalent Te(2) atoms. Both Mn(1)-N(1) bond lengths are 1.96 Å. The Mn(1)-Te(1) bond length is 2.65 Å. Both Mn(1)-Te(2) bond lengths are 2.80 Å. In the second Mn site, Mn(2) is bonded in a distorted water-like geometry to two equivalent N(1) and two equivalent Te(1) atoms. Both Mn(2)-N(1) bond lengths are 1.83 Å. There is one shorter (2.69 Å) and one longer (2.71 Å) Mn(2)-Te(1) bond length. In the third Mn site, Mn(3) is bonded in a distorted L-shaped geometry to two equivalent N(1), one Te(1), and three equivalent Te(2) atoms. There is one shorter (1.90 Å) and one longer (1.91 Å) Mn(3)-N(1) bond length. The Mn(3)-Te(1) bond length is 3.07 Å. There are a spread of Mn(3)-Te(2) bond distances ranging from 2.76-2.87 Å. N(1) is bonded in a distorted see-saw-like geometry to one Mn(1), one Mn(2), and two equivalent Mn(3) atoms. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded in a 5-coordinate geometry to one Mn(1), two equivalent Mn(2), and two equivalent Mn(3) atoms. In the second Te site, Te(2) is bonded in a 4-coordinate geometry to one Mn(1) and three equivalent Mn(3) atoms.