cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1206379
title: Materials Data on Pr(SiPd)2 by Materials Project

description: PrPd2Si2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Pr4+ is bonded to eight equivalent Si4- atoms to form PrSi8 hexagonal bipyramids that share corners with sixteen equivalent PdSi4 tetrahedra, edges with four equivalent PrSi8 hexagonal bipyramids, edges with eight equivalent PdSi4 tetrahedra, and faces with four equivalent PrSi8 hexagonal bipyramids. All Pr–Si bond lengths are 3.24 Å. Pd2+ is bonded to four equivalent Si4- atoms to form PdSi4 tetrahedra that share corners with eight equivalent PrSi8 hexagonal bipyramids, corners with four equivalent PdSi4 tetrahedra, edges with four equivalent PrSi8 hexagonal bipyramids, and edges with four equivalent PdSi4 tetrahedra. All Pd–Si bond lengths are 2.50 Å. Si4- is bonded in a 9-coordinate geometry to four equivalent Pr4+, four equivalent Pd2+, and one Si4- atom. The Si–Si bond length is 2.39 Å.
DOI: 10.17188/1206380
title: Materials Data on AuCl by Materials Project

description: AuCl crystallizes in the tetragonal I4_1/amd space group. The structure is one-dimensional and consists of four AuCl ribbons oriented in the (1, 0, 0) direction. Au1+ is bonded in a linear geometry to two equivalent Cl1- atoms. Both Au–Cl bond lengths are 2.33 Å. Cl1- is bonded in a water-like geometry to two equivalent Au1+ atoms.
DOI: 10.17188/1206381
title: Materials Data on Ho2S3 by Materials Project

description: Ho2S3 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. there are three inequivalent Ho3+ sites. In the first Ho3+ site, Ho3+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Ho–S bond distances ranging from 2.74–2.97 Å. In the second Ho3+ site, Ho3+ is bonded to eight S2- atoms to form distorted edge-sharing HoS8 hexagonal bipyramids. There are a spread of Ho–S bond distances ranging from 2.75–3.05 Å. In the third Ho3+ site, Ho3+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Ho–S bond distances ranging from 2.71–3.16 Å. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded to five Ho3+ atoms to form a mixture of distorted corner, edge, and face-sharing SHo5 trigonal bipyramids. In the second S2- site, S2- is bonded in a 6-coordinate geometry to six Ho3+ atoms. In the third S2- site, S2- is bonded to five Ho3+ atoms to form a mixture of distorted corner, edge, and face-sharing SHo5 square pyramids.
DOI: 10.17188/1206382
title: Materials Data on Ag2S by Materials Project

description: Ag2S crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. Ag1+ is bonded in a 4-coordinate geometry to four equivalent S2- atoms. There are a spread of Ag–S bond distances ranging from 2.61–2.84 Å. S2- is bonded to eight equivalent Ag1+ atoms to form a mixture of distorted edge and corner-sharing SAg8 hexagonal bipyramids.
DOI: 10.17188/1206383
title: Materials Data on Re3O8 by Materials Project

description: Re3O8 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are two inequivalent Re+5.33+ sites. In the first Re+5.33+ site, Re+5.33+ is bonded to six O2- atoms to form corner-sharing ReO6 octahedra. The corner-sharing octahedra tilt angles range from 39–44°. There is four shorter (1.90 Å) and two longer (2.00 Å) Re–O bond length. In the second Re+5.33+ site, Re+5.33+ is bonded to six O2- atoms to form a mixture of edge and corner-sharing ReO6 octahedra. The corner-sharing octahedra tilt angles range from 39–44°. There are a spread of Re–O bond distances ranging from 1.90–2.06 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted T-shaped geometry to three Re+5.33+ atoms. In the second O2- site, O2- is bonded in a bent 150 degrees geometry to two Re+5.33+ atoms. In the third O2- site, O2- is bonded in an L-shaped geometry to two equivalent Re+5.33+ atoms.
DOI: 10.17188/1206384
title: Materials Data on La2Se3 by Materials Project

description: La2Se3 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. there are three inequivalent La3+ sites. In the first La3+ site, La3+ is bonded in a 8-coordinate geometry to eight Se2- atoms. There are a spread of La–Se bond distances ranging from 3.01–3.38 Å. In the second La3+ site, La3+ is bonded to eight Se2- atoms to form a mixture of distorted corner, edge, and face-sharing LaSe8 hexagonal bipyramids. There are a spread of La–Se bond distances ranging from 3.04–3.21 Å. In the third La3+ site, La3+ is bonded to eight Se2- atoms to form a mixture of distorted corner, edge, and face-sharing LaSe8 hexagonal bipyramids. There are a spread of La–Se bond distances ranging from 3.05–3.29 Å. There are three inequivalent Se2- sites. In the first Se2- site, Se2- is bonded to five La3+ atoms to form a mixture of distorted corner, edge, and face-sharing SeLa5 square pyramids. In the second Se2- site, Se2- is bonded in a 6-coordinate geometry to six La3+ atoms. In the third Se2- site, Se2- is bonded to five La3+ atoms to form a mixture of distorted corner, edge, and face-sharing SeLa5 square pyramids.
DOI: 10.17188/1206385
title: Materials Data on Zr2Ni by Materials Project

description: Zr2Ni is Khatyrkite structured and crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Zr is bonded in a 4-coordinate geometry to four equivalent Ni atoms. All Zr–Ni bond lengths are 2.77 Å. Ni is bonded in a 10-coordinate geometry to eight equivalent Zr and two equivalent Ni atoms. Both Ni–Ni bond lengths are 2.63 Å.
DOI: 10.17188/1206386
title: Materials Data on Ac2S3 by Materials Project

description: Ac2S3 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. there are three inequivalent Ac3+ sites. In the first Ac3+ site, Ac3+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Ac–S bond distances ranging from 2.99–3.46 Å. In the second Ac3+ site, Ac3+ is bonded to eight S2- atoms to form a mixture of distorted corner, edge, and face-sharing AcS8 hexagonal bipyramids. There are a spread of Ac–S bond distances ranging from 3.01–3.23 Å. In the third Ac3+ site, Ac3+ is bonded to eight S2- atoms to form a mixture of distorted corner, edge, and face-sharing AcS8 hexagonal bipyramids. There are a spread of Ac–S bond distances ranging from 3.03–3.28 Å. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded in a 6-coordinate geometry to six Ac3+ atoms. In the second S2- site, S2- is bonded to five Ac3+ atoms to form a mixture of distorted corner, edge, and face-sharing SAc5 trigonal bipyramids. In the third S2- site, S2- is bonded to five Ac3+ atoms to form a mixture of distorted corner, edge, and face-sharing SAc5 square pyramids.
DOI: 10.17188/1206387
title: Materials Data on Al5BO9 by Materials Project

description: Al5BO9 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are four inequivalent Al3+ sites. In the first Al3+ site, Al3+ is bonded to six O2- atoms to form AlO6 octahedra that share corners with two equivalent AlO4 tetrahedra, a cornercorner with one AlO5 trigonal bipyramid, edges with two equivalent AlO6 octahedra, and an edgeedge with one AlO5 trigonal bipyramid. There are a spread of Al–O bond distances ranging from 1.86–1.97 Å. In the second Al3+ site, Al3+ is bonded to four O2- atoms to form AlO4 tetrahedra that share corners with four equivalent AlO6 octahedra, corners with two equivalent AlO5 trigonal bipyramids, and an edgeedge with one AlO5 trigonal bipyramid. The corner-sharing octahedra tilt angles range from 49–56°. There is two shorter (1.75 Å) and two longer (1.79 Å) Al–O bond length. In the third Al3+ site, Al3+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Al–O bond distances ranging from 1.77–2.23 Å. In the fourth Al3+ site, Al3+ is bonded to five O2- atoms to form distorted AlO5 trigonal bipyramids that share corners with two equivalent AlO6 octahedra, corners with two equivalent AlO4 tetrahedra, edges with two equivalent AlO6 octahedra, and an edgeedge with one AlO4 tetrahedra. The corner-sharing octahedral tilt angles are 47°. There are a spread of Al–O bond distances ranging from 1.78–2.17 Å. B3+ is bonded in a trigonal planar geometry to three O2- atoms. There is one shorter (1.37 Å) and two longer (1.39 Å) B–O bond length. There are seven inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted T-shaped geometry to three Al3+ atoms. In the second O2- site, O2- is bonded in a trigonal planar geometry to three Al3+ atoms. In the third O2- site, O2- is bonded to four Al3+ atoms to form corner-sharing OAl4 trigonal pyramids. In the fourth O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Al3+ and one B3+ atom. In the fifth O2- site, O2- is bonded in a distorted trigonal planar geometry to three Al3+ atoms. In the sixth O2- site, O2- is bonded to four Al3+ atoms to form distorted corner-sharing OAl4 trigonal pyramids. In the seventh O2- site, O2- is bonded in a distorted trigonal planar geometry to two Al3+ and one B3+ atom.
DOI: 10.17188/1206388
title: Materials Data on Ag2Te by Materials Project

description: Ag2Te crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. Ag1+ is bonded in a 7-coordinate geometry to three equivalent Ag1+ and four equivalent Te2- atoms. There are two shorter (3.03 Å) and one longer (3.06 Å) Ag–Ag bond lengths. There are a spread of Ag–Te bond distances ranging from 2.91–2.97 Å. Te2- is bonded to eight equivalent Ag1+ atoms to form a mixture of edge and corner-sharing TeAg8 hexagonal bipyramids.
DOI: 10.17188/1206411
title: Materials Data on Ti9O10 by Materials Project

description: Ti9O10 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are five inequivalent Ti+2.22+ sites. In the first Ti+2.22+ site, Ti+2.22+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Ti–O bond distances ranging from 2.07–2.53 Å. In the second Ti+2.22+ site, Ti+2.22+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Ti–O bond distances ranging from 1.96–2.05 Å. In the third Ti+2.22+ site, Ti+2.22+ is bonded in an octahedral geometry to six O2- atoms. There are a spread of Ti–O bond distances ranging from 2.00–2.12 Å. In the fourth Ti+2.22+ site, Ti+2.22+ is bonded in a distorted rectangular see-saw-like geometry to four O2- atoms. There are a spread of Ti–O bond distances ranging from 2.04–2.14 Å. In the fifth Ti+2.22+ site, Ti+2.22+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ti–O bond distances ranging from 2.07–2.58 Å. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to five Ti+2.22+ atoms. In the second O2- site, O2- is bonded in a 5-coordinate geometry to five Ti+2.22+ atoms. In the third O2- site, O2- is bonded to four Ti+2.22+ atoms to form distorted OTi4 trigonal pyramids that share a cornercorner with one OTi5 trigonal bipyramid, a cornercorner with one OTi4 trigonal pyramid, and an edgeedge with one OTi4 trigonal pyramid. In the fourth O2- site, O2- is bonded in a 5-coordinate geometry to five Ti+2.22+ atoms. In the fifth O2- site, O2- is bonded to five Ti+2.22+ atoms to form OTi5 trigonal bipyramids that share a cornercorner with one OTi4 trigonal pyramid and edges with two equivalent OTi5 trigonal bipyramids.
DOI: 10.17188/1206412
title: Materials Data on Dy2S3 by Materials Project

description: Dy2S3 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. there are three inequivalent Dy3+ sites. In the first Dy3+ site, Dy3+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Dy–S bond distances ranging from 2.72–3.17 Å. In the second Dy3+ site, Dy3+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Dy–S bond distances ranging from 2.75–2.99 Å. In the third Dy3+ site, Dy3+ is bonded to eight S2- atoms to form distorted edge-sharing DyS8 hexagonal bipyramids. There are a spread of Dy–S bond distances ranging from 2.76–3.06 Å. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded in a 6-coordinate geometry to six Dy3+ atoms. In the second S2- site, S2- is bonded to five Dy3+ atoms to form a mixture of distorted corner, edge, and face-sharing SDy5 trigonal bipyramids. In the third S2- site, S2- is bonded to five Dy3+ atoms to form a mixture of distorted corner, edge, and face-sharing SDy5 square pyramids.
DOI: 10.17188/1206413
title: Materials Data on CuCl4 by Materials Project

description: CuCl4 is Silicon tetrafluoride-like structured and crystallizes in the orthorhombic Fmm2 space group. The structure is zero-dimensional and consists of four CuCl4 clusters. Cu is bonded in a tetrahedral geometry to four Cl atoms. All Cu–Cl bond lengths are 2.17 Å. There are two inequivalent Cl sites. In the first Cl site, Cl is bonded in a single-bond geometry to one Cu atom. In the second Cl site, Cl is bonded in a single-bond geometry to one Cu atom.
DOI: 10.17188/1206414
title: Materials Data on RbNbO3 by Materials Project

description: RbNbO3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are three inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Rb–O bond distances ranging from 2.84–3.35 Å. In the second Rb1+ site, Rb1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Rb–O bond distances ranging from 2.80–3.17 Å. In the third Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Rb–O bond distances ranging from 2.86–3.40 Å. There are two inequivalent Nb5+ sites. In the first Nb5+ site, Nb5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Nb–O bond distances ranging from 1.82–2.53 Å. In the second Nb5+ site, Nb5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Nb–O bond distances ranging from 1.82–2.44 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to three Rb1+ and one Nb5+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to four Rb1+ and one Nb5+ atom. In the third O2- site, O2- is bonded in a 2-coordinate geometry to two Rb1+ and two Nb5+ atoms. In the fourth O2- site, O2- is bonded in a 2-coordinate geometry to two Rb1+ and two Nb5+ atoms. In the fifth O2- site, O2- is bonded in a 2-coordinate geometry to three Rb1+ and two Nb5+ atoms. In the sixth O2- site, O2- is bonded in a distorted rectangular see-saw-like geometry to four Nb5+ atoms.
DOI: 10.17188/1206416
title: Materials Data on Ce2Te3 by Materials Project

description: Ce2Te3 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. there are three inequivalent Ce3+ sites. In the first Ce3+ site, Ce3+ is bonded to eight Te2- atoms to form a mixture of distorted corner, edge, and face-sharing CeTe8 hexagonal bipyramids. There are a spread of Ce–Te bond distances ranging from 3.18–3.43 Å. In the second Ce3+ site, Ce3+ is bonded to eight Te2- atoms to form a mixture of distorted corner, edge, and face-sharing CeTe8 hexagonal bipyramids. There are a spread of Ce–Te bond distances ranging from 3.19–3.38 Å. In the third Ce3+ site, Ce3+ is bonded to eight Te2- atoms to form a mixture of distorted corner, edge, and face-sharing CeTe8 hexagonal bipyramids. There are a spread of Ce–Te bond distances ranging from 3.20–3.40 Å. There are three inequivalent Te2- sites. In the first Te2- site, Te2- is bonded in a 6-coordinate geometry to six Ce3+ atoms. In the second Te2- site, Te2- is bonded to five Ce3+ atoms to form a mixture of distorted corner, edge, and face-sharing TeCe5 square pyramids. In the third Te2- site, Te2- is bonded to five Ce3+ atoms to form a mixture of distorted corner, edge, and face-sharing TeCe5 square pyramids.
DOI: 10.17188/1206417
title: Materials Data on CeSi2Pt by Materials Project

description: CePtSi2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Ce3+ is bonded in a 10-coordinate geometry to ten Si4- atoms. There are a spread of Ce–Si bond distances ranging from 3.14–3.25 Å. Pt5+ is bonded in a 5-coordinate geometry to five Si4- atoms. There are a spread of Pt–Si bond distances ranging from 2.41–2.44 Å. There are two inequivalent Si4- sites. In the first Si4- site, Si4- is bonded in a distorted single-bond geometry to six equivalent Ce3+, one Pt5+, and two equivalent Si4- atoms. Both Si–Si bond lengths are 2.41 Å. In the second Si4- site, Si4- is bonded in a 4-coordinate geometry to four equivalent Ce3+ and four equivalent Pt5+ atoms.
DOI: 10.17188/1206418
title: Materials Data on Na2Ta4O11 by Materials Project

description: Na2Ta4O11 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. Na1+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Na–O bond distances ranging from 2.48–2.75 Å. There are two inequivalent Ta5+ sites. In the first Ta5+ site, Ta5+ is bonded to seven O2- atoms to form distorted TaO7 pentagonal bipyramids that share corners with two equivalent TaO6 octahedra, corners with two equivalent TaO7 pentagonal bipyramids, and edges with four equivalent TaO7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Ta–O bond distances ranging from 1.98–2.45 Å. In the second Ta5+ site, Ta5+ is bonded to six equivalent O2- atoms to form corner-sharing TaO6 octahedra. All Ta–O bond lengths are 2.00 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Na1+ and two Ta5+ atoms. In the second O2- site, O2- is bonded in a 2-coordinate geometry to three equivalent Ta5+ atoms. In the third O2- site, O2- is bonded in a 4-coordinate geometry to one Na1+ and three equivalent Ta5+ atoms.
DOI: 10.17188/1206419
title: Materials Data on Tm2Se3 by Materials Project

description: Tm2Se3 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. there are three inequivalent Tm3+ sites. In the first Tm3+ site, Tm3+ is bonded in a 8-coordinate geometry to eight Se2- atoms. There are a spread of Tm–Se bond distances ranging from 2.82–3.29 Å. In the second Tm3+ site, Tm3+ is bonded in a 8-coordinate geometry to eight Se2- atoms. There are a spread of Tm–Se bond distances ranging from 2.84–3.13 Å. In the third Tm3+ site, Tm3+ is bonded in a 8-coordinate geometry to eight Se2- atoms. There are a spread of Tm–Se bond distances ranging from 2.85–3.24 Å. There are three inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in a 6-coordinate geometry to six Tm3+ atoms. In the second Se2- site, Se2- is bonded to five Tm3+ atoms to form a mixture of distorted corner, edge, and face-sharing SeTm5 trigonal bipyramids. In the third Se2- site, Se2- is bonded in a 5-coordinate geometry to five Tm3+ atoms.
DOI: 10.17188/1206420
title: Materials Data on H11O8 by Materials Project

description: (H2O)2(H2O2)3(H3O2)4 crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one hydrogen peroxide hydrate molecule, one water molecule, and two water water molecules.
DOI: 10.17188/1206421
title: Materials Data on Cu13Se8 by Materials Project

description: Cu13Se8 crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are three inequivalent Cu+1.23+ sites. In the first Cu+1.23+ site, Cu+1.23+ is bonded to four Se2- atoms to form a mixture of edge and corner-sharing CuSe4 tetrahedra. There are two shorter (2.46 Å) and two longer (2.51 Å) Cu–Se bond lengths. In the second Cu+1.23+ site, Cu+1.23+ is bonded to four Se2- atoms to form a mixture of edge and corner-sharing CuSe4 tetrahedra. There are two shorter (2.45 Å) and two longer (2.49 Å) Cu–Se bond lengths. In the third Cu+1.23+ site, Cu+1.23+ is bonded to four equivalent Se2- atoms to form a mixture of edge and corner-sharing CuSe4 tetrahedra. All Cu–Se bond lengths are 2.52 Å. There are two inequivalent Se2- sites. In the first Se2- site, Se2- is bonded to seven Cu+1.23+ atoms to form a mixture of distorted edge and corner-sharing SeCu7 hexagonal pyramids. In the second Se2- site, Se2- is bonded in a 6-coordinate geometry to six Cu+1.23+ atoms.
DOI: 10.17188/1206422
title: Materials Data on Ce(AlZn)2 by Materials Project

description: Al2Zn2Ce crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ce is bonded in a 8-coordinate geometry to eight equivalent Zn and eight equivalent Al atoms. All Ce–Zn bond lengths are 3.21 Å. All Ce–Al bond lengths are 3.45 Å. Zn is bonded in a 9-coordinate geometry to four equivalent Ce, one Zn, and four equivalent Al atoms. The Zn–Zn bond length is 2.44 Å. All Zn–Al bond lengths are 2.59 Å. Al is bonded to four equivalent Ce and four equivalent Zn atoms to form a mixture of distorted edge, face, and corner-sharing AlCe4Zn4 tetrahedra.
DOI: 10.17188/1206423
title: Materials Data on Rh3Se8 by Materials Project

description: Rh3Se8 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Rh+3.33+ sites. In the first Rh+3.33+ site, Rh+3.33+ is bonded to six Se+1.25- atoms to form RhSe6 octahedra that share corners with eight RhSe6 octahedra and corners with two equivalent SeRh3Se tetrahedra. The corner-sharing octahedra tilt angles range from 63–66°. There are a spread of Rh–Se bond distances ranging from 2.49–2.57 Å. In the second Rh+3.33+ site, Rh+3.33+ is bonded to six Se+1.25- atoms to form corner-sharing RhSe6 octahedra. The corner-sharing octahedra tilt angles range from 63–66°. There are a spread of Rh–Se bond distances ranging from 2.52–2.54 Å. There are four inequivalent Se+1.25- sites. In the first Se+1.25- site, Se+1.25- is bonded to three Rh+3.33+ and one Se+1.25- atom to form distorted SeRh3Se tetrahedra that share corners with two equivalent RhSe6 octahedra and corners with three equivalent SeRh3Se tetrahedra. The corner-sharing octahedra tilt angles range from 79–80°. The Se–Se bond length is 2.46 Å. In the second Se+1.25- site, Se+1.25- is bonded in a 2-coordinate geometry to two equivalent Rh+3.33+ and one Se+1.25- atom. In the third Se+1.25- site, Se+1.25- is bonded in a 3-coordinate geometry to two Rh+3.33+ and one Se+1.25- atom. The Se–Se bond length is 2.44 Å. In the fourth Se+1.25- site, Se+1.25- is bonded in a 3-coordinate geometry to two Rh+3.33+ and one Se+1.25- atom. The Se–Se bond length is 2.45 Å.