ZrMoP crystallizes in the hexagonal P-62m space group. Zr(1) is bonded in a 11-coordinate geometry to six equivalent Mo(1), one P(2), and four equivalent P(1) atoms. Mo(1) is bonded in a 10-coordinate geometry to six equivalent Zr(1), two equivalent P(1), and two equivalent P(2) atoms. There are two inequivalent P sites. In the first P site, P(2) is bonded in a 9-coordinate geometry to three equivalent Zr(1) and six equivalent Mo(1) atoms. In the second P site, P(1) is bonded in a 9-coordinate geometry to six equivalent Zr(1) and three equivalent Mo(1) atoms.
ZrMoP crystallizes in the hexagonal P-62m space group. Zr(1) is bonded in a 11-coordinate geometry to six equivalent Mo(1), one P(2), and four equivalent P(1) atoms. There are two shorter (2.95 Å) and four longer (3.00 Å) Zr(1)-Mo(1) bond lengths. The Zr(1)-P(2) bond length is 2.80 Å. All Zr(1)-P(1) bond lengths are 2.73 Å. Mo(1) is bonded in a 10-coordinate geometry to six equivalent Zr(1), two equivalent P(1), and two equivalent P(2) atoms. Both Mo(1)-P(1) bond lengths are 2.64 Å. Both Mo(1)-P(2) bond lengths are 2.45 Å. There are two inequivalent P sites. In the first P site, P(2) is bonded in a 9-coordinate geometry to three equivalent Zr(1) and six equivalent Mo(1) atoms. In the second P site, P(1) is bonded in a 9-coordinate geometry to six equivalent Zr(1) and three equivalent Mo(1) atoms.