cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1197560
title: Materials Data on Mg4As6Rh7 by Materials Project

description: Mg4Rh7As6 crystallizes in the cubic Im-3m space group. The structure is three-dimensional. Mg is bonded to six equivalent Rh and six equivalent As atoms to form MgAs6Rh6 cuboctahedra that share corners with twelve equivalent MgAs6Rh6 cuboctahedra, faces with six equivalent MgAs6Rh6 cuboctahedra, and faces with two equivalent RhAs6 octahedra. All Mg–Rh bond lengths are 2.89 Å. All Mg–As bond lengths are 2.93 Å. There are two inequivalent Rh sites. In the first Rh site, Rh is bonded to six equivalent As atoms to form RhAs6 octahedra that share faces with eight equivalent MgAs6Rh6 cuboctahedra. All Rh–As bond lengths are 2.56 Å. In the second Rh site, Rh is bonded in a 12-coordinate geometry to four equivalent Mg and four equivalent As atoms. All Rh–As bond lengths are 2.55 Å. As is bonded in a 9-coordinate geometry to four equivalent Mg and five Rh atoms.
DOI: 10.17188/1197561
title: Materials Data on PuGa3 by Materials Project

description: PuGa3 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Pu sites. In the first Pu site, Pu is bonded to twelve Ga atoms to form PuGa12 cuboctahedra that share corners with nine PuGa12 cuboctahedra, edges with twelve equivalent GaPu4Ga8 cuboctahedra, faces with seven PuGa12 cuboctahedra, and faces with nine equivalent GaPu4Ga8 cuboctahedra. There are a spread of Pu–Ga bond distances ranging from 3.01–3.08 Å. In the second Pu site, Pu is bonded to twelve Ga atoms to form PuGa12 cuboctahedra that share corners with six equivalent GaPu4Ga8 cuboctahedra, corners with nine PuGa12 cuboctahedra, edges with nine equivalent GaPu4Ga8 cuboctahedra, faces with three equivalent GaPu4Ga8 cuboctahedra, and faces with seven PuGa12 cuboctahedra. There are a spread of Pu–Ga bond distances ranging from 3.01–3.08 Å. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 4-coordinate geometry to four Pu and six Ga atoms. There are a spread of Ga–Ga bond distances ranging from 2.81–2.93 Å. In the second Ga site, Ga is bonded to four Pu and eight Ga atoms to form distorted GaPu4Ga8 cuboctahedra that share corners with two equivalent PuGa12 cuboctahedra, corners with six equivalent GaPu4Ga8 cuboctahedra, edges with seven PuGa12 cuboctahedra, edges with eight equivalent GaPu4Ga8 cuboctahedra, faces with four PuGa12 cuboctahedra, and faces with nine equivalent GaPu4Ga8 cuboctahedra. There are a spread of Ga–Ga bond distances ranging from 2.99–3.08 Å.
DOI: 10.17188/1197562
title: Materials Data on K4PbO4 by Materials Project

description: K4PbO4 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are four inequivalent K1+ sites. In the first K1+ site, K1+ is bonded to five O2- atoms to form distorted KO5 trigonal bipyramids that share corners with three equivalent KO5 square pyramids, corners with three equivalent PbO4 tetrahedra, corners with two equivalent KO4 trigonal pyramids, edges with three equivalent KO5 square pyramids, an edgeedge with one PbO4 tetrahedra, and edges with two equivalent KO5 trigonal bipyramids. There are a spread of K–O bond distances ranging from 2.65–2.88 Å. In the second K1+ site, K1+ is bonded to five O2- atoms to form KO5 square pyramids that share a cornercorner with one PbO4 tetrahedra, corners with three equivalent KO5 trigonal bipyramids, corners with two equivalent KO4 trigonal pyramids, edges with two equivalent KO5 square pyramids, edges with two equivalent PbO4 tetrahedra, and edges with three equivalent KO5 trigonal bipyramids. There are a spread of K–O bond distances ranging from 2.79–2.98 Å. In the third K1+ site, K1+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of K–O bond distances ranging from 2.74–3.30 Å. In the fourth K1+ site, K1+ is bonded to four O2- atoms to form distorted KO4 trigonal pyramids that share corners with two equivalent KO5 square pyramids, corners with four equivalent PbO4 tetrahedra, corners with two equivalent KO5 trigonal bipyramids, and edges with two equivalent KO4 trigonal pyramids. There are a spread of K–O bond distances ranging from 2.67–2.72 Å. Pb4+ is bonded to four O2- atoms to form PbO4 tetrahedra that share a cornercorner with one KO5 square pyramid, corners with three equivalent KO5 trigonal bipyramids, corners with four equivalent KO4 trigonal pyramids, edges with two equivalent KO5 square pyramids, and an edgeedge with one KO5 trigonal bipyramid. There are one shorter (2.10 Å) and three longer (2.12 Å) Pb–O bond lengths. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded to five K1+ and one Pb4+ atom to form a mixture of edge and corner-sharing OK5Pb octahedra. The corner-sharing octahedra tilt angles range from 15–18°. In the second O2- site, O2- is bonded to five K1+ and one Pb4+ atom to form a mixture of edge and corner-sharing OK5Pb octahedra. The corner-sharing octahedra tilt angles range from 8–28°. In the third O2- site, O2- is bonded to five K1+ and one Pb4+ atom to form a mixture of distorted edge and corner-sharing OK5Pb octahedra. The corner-sharing octahedra tilt angles range from 8–28°. In the fourth O2- site, O2- is bonded in a 4-coordinate geometry to four K1+ and one Pb4+ atom.
DOI: 10.17188/1197563
title: Materials Data on NaNd2OsO6 by Materials Project

description: NaNd2OsO6 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Na1+ is bonded to six O2- atoms to form NaO6 octahedra that share corners with six equivalent OsO6 octahedra. The corner-sharing octahedra tilt angles range from 36–42°. There are four shorter (2.31 Å) and two longer (2.35 Å) Na–O bond lengths. Nd3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Nd–O bond distances ranging from 2.34–2.96 Å. Os5+ is bonded to six O2- atoms to form OsO6 octahedra that share corners with six equivalent NaO6 octahedra. The corner-sharing octahedra tilt angles range from 36–42°. There is four shorter (1.99 Å) and two longer (2.00 Å) Os–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to one Na1+, three equivalent Nd3+, and one Os5+ atom. In the second O2- site, O2- is bonded to one Na1+, two equivalent Nd3+, and one Os5+ atom to form distorted corner-sharing ONaNd2Os trigonal pyramids. In the third O2- site, O2- is bonded in a 5-coordinate geometry to one Na1+, three equivalent Nd3+, and one Os5+ atom.
DOI: 10.17188/1197564
title: Materials Data on Th2Ag by Materials Project

description: Th2Ag is Khatyrkite structured and crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Th is bonded in a 4-coordinate geometry to four equivalent Ag atoms. All Th–Ag bond lengths are 3.23 Å. Ag is bonded in a 10-coordinate geometry to eight equivalent Th and two equivalent Ag atoms. Both Ag–Ag bond lengths are 2.95 Å.
DOI: 10.17188/1197565
title: Materials Data on NdTiGe by Materials Project

description: NdTiGe is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Nd is bonded in a 5-coordinate geometry to five equivalent Ge atoms. There are four shorter (3.08 Å) and one longer (3.38 Å) Nd–Ge bond lengths. Ti is bonded to four equivalent Ge atoms to form a mixture of distorted corner and edge-sharing TiGe4 tetrahedra. All Ti–Ge bond lengths are 2.74 Å. Ge is bonded in a 9-coordinate geometry to five equivalent Nd and four equivalent Ti atoms.
DOI: 10.17188/1197566
title: Materials Data on TaInS2 by Materials Project

description: TaInS2 crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Ta3+ is bonded to six equivalent S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. All Ta–S bond lengths are 2.48 Å. In1+ is bonded in a linear geometry to two equivalent S2- atoms. Both In–S bond lengths are 2.90 Å. S2- is bonded in a distorted rectangular see-saw-like geometry to three equivalent Ta3+ and one In1+ atom.
DOI: 10.17188/1197567
title: Materials Data on GdB2Ru3 by Materials Project

description: GdRu3B2 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Gd is bonded in a 12-coordinate geometry to two equivalent Gd, twelve equivalent Ru, and six equivalent B atoms. Both Gd–Gd bond lengths are 3.03 Å. All Gd–Ru bond lengths are 3.15 Å. All Gd–B bond lengths are 3.19 Å. Ru is bonded in a distorted square co-planar geometry to four equivalent Gd and four equivalent B atoms. All Ru–B bond lengths are 2.20 Å. B is bonded in a 6-coordinate geometry to three equivalent Gd and six equivalent Ru atoms.
DOI: 10.17188/1197568
title: Materials Data on Hf5Ga3 by Materials Project

description: Hf5Ga3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Hf sites. In the first Hf site, Hf is bonded in a 6-coordinate geometry to six equivalent Ga atoms. All Hf–Ga bond lengths are 2.85 Å. In the second Hf site, Hf is bonded in a 5-coordinate geometry to five equivalent Ga atoms. There are a spread of Hf–Ga bond distances ranging from 2.74–3.09 Å. Ga is bonded in a 9-coordinate geometry to nine Hf atoms.
DOI: 10.17188/1197569
title: Materials Data on EuOF by Materials Project

description: EuOF crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Eu3+ is bonded in a body-centered cubic geometry to four equivalent O2- and four equivalent F1- atoms. There are one shorter (2.32 Å) and three longer (2.37 Å) Eu–O bond lengths. There are three shorter (2.50 Å) and one longer (2.52 Å) Eu–F bond lengths. O2- is bonded to four equivalent Eu3+ atoms to form distorted OEu4 tetrahedra that share corners with six equivalent OEu4 tetrahedra, corners with ten equivalent FEu4 tetrahedra, edges with three equivalent OEu4 tetrahedra, and edges with three equivalent FEu4 tetrahedra. F1- is bonded to four equivalent Eu3+ atoms to form distorted FEu4 tetrahedra that share corners with six equivalent FEu4 tetrahedra, corners with ten equivalent OEu4 tetrahedra, edges with three equivalent OEu4 tetrahedra, and edges with three equivalent FEu4 tetrahedra.
DOI: 10.17188/1197570
title: Materials Data on ThCoSn by Materials Project

description: ThCoSn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Th is bonded in a 11-coordinate geometry to five Co and six equivalent Sn atoms. There are four shorter (3.01 Å) and one longer (3.04 Å) Th–Co bond lengths. There are two shorter (3.21 Å) and four longer (3.35 Å) Th–Sn bond lengths. There are two inequivalent Co sites. In the first Co site, Co is bonded in a 9-coordinate geometry to six equivalent Th and three equivalent Sn atoms. All Co–Sn bond lengths are 2.82 Å. In the second Co site, Co is bonded in a 9-coordinate geometry to three equivalent Th and six equivalent Sn atoms. All Co–Sn bond lengths are 2.74 Å. Sn is bonded in a 12-coordinate geometry to six equivalent Th and four Co atoms.
DOI: 10.17188/1197572
title: Materials Data on PbSeO4 by Materials Project

description: PbSeO4 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Pb2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Pb–O bond distances ranging from 2.59–2.88 Å. Se6+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of Se–O bond distances ranging from 1.67–1.69 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Pb2+ and one Se6+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Pb2+ and one Se6+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Pb2+ and one Se6+ atom. In the fourth O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Pb2+ and one Se6+ atom.
DOI: 10.17188/1197573
title: Materials Data on Ce(GeRu)2 by Materials Project

description: CeRu2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ce is bonded in a 8-coordinate geometry to eight equivalent Ru and eight equivalent Ge atoms. All Ce–Ru bond lengths are 3.30 Å. All Ce–Ge bond lengths are 3.31 Å. Ru is bonded in a 4-coordinate geometry to four equivalent Ce and four equivalent Ge atoms. All Ru–Ge bond lengths are 2.45 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Ce, four equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.62 Å.
DOI: 10.17188/1197574
title: Materials Data on Sn7Ru3 by Materials Project

description: Ru3Sn7 crystallizes in the cubic Im-3m space group. The structure is three-dimensional. Ru is bonded in a 8-coordinate geometry to eight Sn atoms. There are four shorter (2.78 Å) and four longer (2.79 Å) Ru–Sn bond lengths. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 8-coordinate geometry to four equivalent Ru atoms. In the second Sn site, Sn is bonded in a 3-coordinate geometry to three equivalent Ru and four equivalent Sn atoms. There are one shorter (2.92 Å) and three longer (3.05 Å) Sn–Sn bond lengths.
DOI: 10.17188/1197575
title: Materials Data on TiCdO3 by Materials Project

description: CdTiO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one titanium molecule and one CdO3 framework. In the CdO3 framework, Cd2+ is bonded to six equivalent O2- atoms to form corner-sharing CdO6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Cd–O bond lengths are 2.05 Å. O2- is bonded in a linear geometry to two equivalent Cd2+ atoms.
DOI: 10.17188/1197576
title: Materials Data on BaGe3Pt by Materials Project

description: BaPtGe3 crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Ba is bonded in a 12-coordinate geometry to five equivalent Pt and twelve Ge atoms. There are four shorter (3.61 Å) and one longer (3.67 Å) Ba–Pt bond lengths. There are a spread of Ba–Ge bond distances ranging from 3.43–3.51 Å. Pt is bonded in a 5-coordinate geometry to five equivalent Ba and five Ge atoms. There are four shorter (2.56 Å) and one longer (2.58 Å) Pt–Ge bond lengths. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 2-coordinate geometry to four equivalent Ba, two equivalent Pt, and two equivalent Ge atoms. Both Ge–Ge bond lengths are 2.77 Å. In the second Ge site, Ge is bonded in a 1-coordinate geometry to four equivalent Ba, one Pt, and four equivalent Ge atoms.
DOI: 10.17188/1197577
title: Materials Data on Sm(FeGe)2 by Materials Project

description: SmFe2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Sm is bonded in a 8-coordinate geometry to eight equivalent Fe and eight equivalent Ge atoms. All Sm–Fe bond lengths are 3.35 Å. All Sm–Ge bond lengths are 3.11 Å. Fe is bonded to four equivalent Sm and four equivalent Ge atoms to form a mixture of distorted face, edge, and corner-sharing FeSm4Ge4 tetrahedra. All Fe–Ge bond lengths are 2.44 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Sm, four equivalent Fe, and one Ge atom. The Ge–Ge bond length is 2.58 Å.
DOI: 10.17188/1197578
title: Materials Data on YbRh2 by Materials Project

description: YbRh2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Yb is bonded in a 12-coordinate geometry to twelve equivalent Rh atoms. All Yb–Rh bond lengths are 3.11 Å. Rh is bonded to six equivalent Yb and six equivalent Rh atoms to form a mixture of corner, edge, and face-sharing RhYb6Rh6 cuboctahedra. All Rh–Rh bond lengths are 2.65 Å.
DOI: 10.17188/1197579
title: Materials Data on Nd3SnN by Materials Project

description: (Nd3Sn)2N2 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Nd3Sn framework. In the Nd3Sn framework, Nd is bonded in a linear geometry to two equivalent Sn atoms. Both Nd–Sn bond lengths are 2.92 Å. Sn is bonded to six equivalent Nd atoms to form corner-sharing SnNd6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1197580
title: Materials Data on NbRu3C by Materials Project

description: NbCRu3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Nb is bonded to twelve equivalent Ru atoms to form NbRu12 cuboctahedra that share corners with twelve equivalent NbRu12 cuboctahedra, faces with six equivalent NbRu12 cuboctahedra, and faces with eight equivalent CRu6 octahedra. All Nb–Ru bond lengths are 2.87 Å. Ru is bonded in a distorted linear geometry to four equivalent Nb and two equivalent C atoms. Both Ru–C bond lengths are 2.03 Å. C is bonded to six equivalent Ru atoms to form CRu6 octahedra that share corners with six equivalent CRu6 octahedra and faces with eight equivalent NbRu12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1197581
title: Materials Data on Ba3InRu2O9 by Materials Project

description: Ba3InRu2O9 is (Cubic) Perovskite-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Ba2+ sites. In the first Ba2+ site, Ba2+ is bonded to twelve O2- atoms to form BaO12 cuboctahedra that share corners with nine BaO12 cuboctahedra, corners with three equivalent RuO6 octahedra, faces with seven BaO12 cuboctahedra, faces with three equivalent InO6 octahedra, and faces with four equivalent RuO6 octahedra. The corner-sharing octahedral tilt angles are 14°. There are a spread of Ba–O bond distances ranging from 2.95–3.01 Å. In the second Ba2+ site, Ba2+ is bonded to twelve O2- atoms to form BaO12 cuboctahedra that share corners with twelve BaO12 cuboctahedra, faces with six equivalent BaO12 cuboctahedra, faces with two equivalent InO6 octahedra, and faces with six equivalent RuO6 octahedra. All Ba–O bond lengths are 2.96 Å. Ru+4.50+ is bonded to six O2- atoms to form RuO6 octahedra that share corners with three equivalent BaO12 cuboctahedra, corners with three equivalent InO6 octahedra, faces with seven BaO12 cuboctahedra, and a faceface with one RuO6 octahedra. The corner-sharing octahedral tilt angles are 1°. There are three shorter (1.99 Å) and three longer (2.03 Å) Ru–O bond lengths. In3+ is bonded to six equivalent O2- atoms to form InO6 octahedra that share corners with six equivalent RuO6 octahedra and faces with eight BaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 1°. All In–O bond lengths are 2.17 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted linear geometry to four Ba2+, one Ru+4.50+, and one In3+ atom. In the second O2- site, O2- is bonded in a 6-coordinate geometry to four Ba2+ and two equivalent Ru+4.50+ atoms.
DOI: 10.17188/1197582
title: Materials Data on Sr2InSbO6 by Materials Project

description: Sr2InSbO6 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Sr2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Sr–O bond distances ranging from 2.53–2.90 Å. In3+ is bonded to six O2- atoms to form InO6 octahedra that share corners with six equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 24–25°. There are four shorter (2.19 Å) and two longer (2.20 Å) In–O bond lengths. Sb5+ is bonded to six O2- atoms to form SbO6 octahedra that share corners with six equivalent InO6 octahedra. The corner-sharing octahedra tilt angles range from 24–25°. All Sb–O bond lengths are 2.02 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Sr2+, one In3+, and one Sb5+ atom. In the second O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Sr2+, one In3+, and one Sb5+ atom. In the third O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Sr2+, one In3+, and one Sb5+ atom.
DOI: 10.17188/1197583
title: Materials Data on In2HgS4 by Materials Project

description: HgIn2S4 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Hg2+ is bonded to four equivalent S2- atoms to form HgS4 tetrahedra that share corners with twelve equivalent InS6 octahedra. The corner-sharing octahedral tilt angles are 58°. All Hg–S bond lengths are 2.60 Å. In3+ is bonded to six equivalent S2- atoms to form InS6 octahedra that share corners with six equivalent HgS4 tetrahedra and edges with six equivalent InS6 octahedra. All In–S bond lengths are 2.65 Å. S2- is bonded to one Hg2+ and three equivalent In3+ atoms to form a mixture of distorted edge and corner-sharing SIn3Hg trigonal pyramids.
DOI: 10.17188/1197584
title: Materials Data on UIr by Materials Project

description: UIr crystallizes in the monoclinic P2_1 space group. The structure is three-dimensional. there are four inequivalent U sites. In the first U site, U is bonded in a 7-coordinate geometry to seven Ir atoms. There are a spread of U–Ir bond distances ranging from 2.77–3.06 Å. In the second U site, U is bonded in a 5-coordinate geometry to seven Ir atoms. There are a spread of U–Ir bond distances ranging from 2.79–3.27 Å. In the third U site, U is bonded in a 7-coordinate geometry to seven Ir atoms. There are a spread of U–Ir bond distances ranging from 2.77–3.05 Å. In the fourth U site, U is bonded in a 5-coordinate geometry to seven Ir atoms. There are a spread of U–Ir bond distances ranging from 2.80–3.26 Å. There are four inequivalent Ir sites. In the first Ir site, Ir is bonded in a 7-coordinate geometry to seven U and two Ir atoms. There are one shorter (3.08 Å) and one longer (3.18 Å) Ir–Ir bond lengths. In the second Ir site, Ir is bonded in a 5-coordinate geometry to seven U and three Ir atoms. There are one shorter (2.98 Å) and one longer (3.07 Å) Ir–Ir bond lengths. In the third Ir site, Ir is bonded in a 7-coordinate geometry to seven U and two Ir atoms. The Ir–Ir bond length is 3.20 Å. In the fourth Ir site, Ir is bonded in a 5-coordinate geometry to seven U and three Ir atoms.
DOI: 10.17188/1197585
title: Materials Data on U2Co2Sn by Materials Project

description: U2Co2Sn crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. U is bonded in a 6-coordinate geometry to six equivalent Co and four equivalent Sn atoms. There are two shorter (2.68 Å) and four longer (2.79 Å) U–Co bond lengths. All U–Sn bond lengths are 3.23 Å. Co is bonded in a 6-coordinate geometry to six equivalent U, one Co, and two equivalent Sn atoms. The Co–Co bond length is 2.80 Å. Both Co–Sn bond lengths are 2.86 Å. Sn is bonded to eight equivalent U and four equivalent Co atoms to form a mixture of distorted face and corner-sharing SnU8Co4 cuboctahedra.