cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1685997
title: Materials Data on FeB10(H13O4)2 by Materials Project

description: Fe(H2O)6(BH)10(H2O)2 crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of forty boranediylradical molecules, four iron hexahydrate molecules, and eight water molecules.
DOI: 10.17188/1685998
title: Materials Data on Li3Co(PO4)2 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1685999
title: Materials Data on Mg6Sn2Ge by Materials Project

description: Mg6Sn2Ge is alpha bismuth trifluoride-derived structured and crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. there are four inequivalent Mg sites. In the first Mg site, Mg is bonded to three equivalent Sn and one Ge atom to form MgSn3Ge tetrahedra that share corners with sixteen MgSn3Ge tetrahedra and edges with six MgSn4 tetrahedra. All Mg–Sn bond lengths are 2.91 Å. The Mg–Ge bond length is 2.81 Å. In the second Mg site, Mg is bonded to one Sn and three equivalent Ge atoms to form a mixture of corner and edge-sharing MgSnGe3 tetrahedra. The Mg–Sn bond length is 2.92 Å. All Mg–Ge bond lengths are 2.88 Å. In the third Mg site, Mg is bonded to four equivalent Sn atoms to form a mixture of corner and edge-sharing MgSn4 tetrahedra. There are three shorter (2.90 Å) and one longer (2.91 Å) Mg–Sn bond lengths. In the fourth Mg site, Mg is bonded to one Sn and three equivalent Ge atoms to form a mixture of corner and edge-sharing MgSnGe3 tetrahedra. The Mg–Sn bond length is 2.92 Å. All Mg–Ge bond lengths are 2.88 Å. Sn is bonded in a body-centered cubic geometry to eight Mg atoms. Ge is bonded in a body-centered cubic geometry to eight Mg atoms.
DOI: 10.17188/1686000
title: Materials Data on H13C2Cl3O8 by Materials Project

description: CH7O5CCl3(H2O)3 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two chloroform molecules, six water molecules, and two CH7O5 clusters. In each CH7O5 cluster, C3+ is bonded in a bent 120 degrees geometry to two O2- atoms. Both C–O bond lengths are 1.26 Å. There are seven inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.11 Å) and one longer (1.33 Å) H–O bond length. In the second H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. In the third H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.00 Å. In the fourth H1+ site, H1+ is bonded in a distorted single-bond geometry to two O2- atoms. There is one shorter (1.01 Å) and one longer (1.64 Å) H–O bond length. In the fifth H1+ site, H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.03 Å) and one longer (1.55 Å) H–O bond length. In the sixth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.00 Å. In the seventh H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 1.00 Å. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to one C3+ and one H1+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to one C3+ atom. In the third O2- site, O2- is bonded in a trigonal planar geometry to three H1+ atoms. In the fourth O2- site, O2- is bonded in a trigonal non-coplanar geometry to three H1+ atoms. In the fifth O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to three H1+ atoms.
DOI: 10.17188/1686001
title: Materials Data on Ba2CuN2 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1686002
title: Materials Data on TiOs2 by Materials Project

description: TiOs2 is Hexagonal Laves structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ti4+ is bonded in a 12-coordinate geometry to twelve Os2- atoms. There are a spread of Ti–Os bond distances ranging from 2.98–3.03 Å. There are two inequivalent Os2- sites. In the first Os2- site, Os2- is bonded to six equivalent Ti4+ and six equivalent Os2- atoms to form a mixture of corner, edge, and face-sharing OsTi6Os6 cuboctahedra. All Os–Os bond lengths are 2.60 Å. In the second Os2- site, Os2- is bonded to six equivalent Ti4+ and six Os2- atoms to form a mixture of corner, edge, and face-sharing OsTi6Os6 cuboctahedra. There are two shorter (2.46 Å) and two longer (2.67 Å) Os–Os bond lengths.
DOI: 10.17188/1686003
title: Materials Data on FeCl4 by Materials Project

description: FeCl4 crystallizes in the orthorhombic Imma space group. The structure is one-dimensional and consists of two FeCl4 ribbons oriented in the (1, 0, 0) direction. Fe is bonded to six Cl atoms to form edge-sharing FeCl6 octahedra. There are two shorter (2.17 Å) and four longer (2.31 Å) Fe–Cl bond lengths. There are two inequivalent Cl sites. In the first Cl site, Cl is bonded in a single-bond geometry to one Fe atom. In the second Cl site, Cl is bonded in an L-shaped geometry to two equivalent Fe atoms.
DOI: 10.17188/1686004
title: Materials Data on Ca2FeWO6 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1686005
title: Materials Data on TiMoW2 by Materials Project

description: TiW2Mo crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two TiW2Mo ribbons oriented in the (1, 0, 0) direction. Ti is bonded in a linear geometry to two equivalent W atoms. Both Ti–W bond lengths are 2.30 Å. W is bonded in a linear geometry to one Ti and one Mo atom. The W–Mo bond length is 2.25 Å. Mo is bonded in a linear geometry to two equivalent W atoms.
DOI: 10.17188/1686006
title: Materials Data on CrSbPt by Materials Project

description: PtCrSb is alpha boron-derived structured and crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Cr3+ is bonded in a 7-coordinate geometry to three equivalent Pt2- and four equivalent Sb1- atoms. All Cr–Pt bond lengths are 2.60 Å. There are three shorter (2.77 Å) and one longer (2.83 Å) Cr–Sb bond lengths. Pt2- is bonded in a hexagonal planar geometry to three equivalent Cr3+ and three equivalent Sb1- atoms. All Pt–Sb bond lengths are 2.75 Å. Sb1- is bonded in a 7-coordinate geometry to four equivalent Cr3+ and three equivalent Pt2- atoms.
DOI: 10.17188/1686007
title: Materials Data on VH6C2ClO3 by Materials Project

description: VC2H6O3Cl crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two VC2H6O3Cl clusters. V5+ is bonded in a 4-coordinate geometry to three O2- and one Cl1- atom. There are a spread of V–O bond distances ranging from 1.61–1.82 Å. The V–Cl bond length is 2.23 Å. There are two inequivalent C2- sites. In the first C2- site, C2- is bonded in a tetrahedral geometry to three H1+ and one O2- atom. All C–H bond lengths are 1.10 Å. The C–O bond length is 1.43 Å. In the second C2- site, C2- is bonded in a tetrahedral geometry to three H1+ and one O2- atom. All C–H bond lengths are 1.10 Å. The C–O bond length is 1.43 Å. There are six inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the fifth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. In the sixth H1+ site, H1+ is bonded in a single-bond geometry to one C2- atom. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one V5+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one V5+ and one C2- atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one V5+ and one C2- atom. Cl1- is bonded in a single-bond geometry to one V5+ atom.
DOI: 10.17188/1686008
title: Materials Data on K2Ce(CuS2)2 by Materials Project

description: K2Ce(CuS2)2 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. K1+ is bonded in a 7-coordinate geometry to seven S2- atoms. There are a spread of K–S bond distances ranging from 3.21–3.39 Å. Ce3+ is bonded to six S2- atoms to form CeS6 octahedra that share corners with two equivalent CuS4 tetrahedra, edges with two equivalent CeS6 octahedra, and edges with four equivalent CuS4 tetrahedra. There are two shorter (2.75 Å) and four longer (2.76 Å) Ce–S bond lengths. Cu+1.50+ is bonded to four S2- atoms to form CuS4 tetrahedra that share a cornercorner with one CeS6 octahedra, corners with two equivalent CuS4 tetrahedra, edges with two equivalent CeS6 octahedra, and edges with two equivalent CuS4 tetrahedra. The corner-sharing octahedral tilt angles are 54°. There are a spread of Cu–S bond distances ranging from 2.33–2.42 Å. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded in a 7-coordinate geometry to three equivalent K1+, one Ce3+, and three equivalent Cu+1.50+ atoms. In the second S2- site, S2- is bonded in a 7-coordinate geometry to four equivalent K1+, two equivalent Ce3+, and one Cu+1.50+ atom.
DOI: 10.17188/1686012
title: Materials Data on TiCrCuS4 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1686013
title: Materials Data on TiSnRh by Materials Project

description: RhTiSn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ti is bonded to four equivalent Rh and six equivalent Sn atoms to form a mixture of distorted corner and face-sharing TiSn6Rh4 tetrahedra. All Ti–Rh bond lengths are 2.68 Å. All Ti–Sn bond lengths are 3.10 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Ti and four equivalent Sn atoms. All Rh–Sn bond lengths are 2.68 Å. Sn is bonded in a 4-coordinate geometry to six equivalent Ti and four equivalent Rh atoms.
DOI: 10.17188/1686014
title: Materials Data on HfCuAu2 by Materials Project

description: HfAu2Cu crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two HfAu2Cu ribbons oriented in the (1, 0, 0) direction. Hf is bonded in a linear geometry to two equivalent Au atoms. Both Hf–Au bond lengths are 2.58 Å. Au is bonded in a linear geometry to one Hf and one Cu atom. The Au–Cu bond length is 2.47 Å. Cu is bonded in a linear geometry to two equivalent Au atoms.
DOI: 10.17188/1686015
title: Materials Data on U2As3 by Materials Project

description: (UAs)2As crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one arsenic molecule and two UAs clusters. In each UAs cluster, U+4.50+ is bonded in a single-bond geometry to one As3- atom. The U–As bond length is 2.47 Å. As3- is bonded in a single-bond geometry to one U+4.50+ atom.
DOI: 10.17188/1686016
title: Materials Data on Al3P8NO36 by Materials Project

description: (Al3(PO4)8)2N2(O2)4 crystallizes in the monoclinic C2/c space group. The structure is two-dimensional and consists of four ammonia molecules; eight hydrogen peroxide molecules; and two Al3(PO4)8 sheets oriented in the (0, 0, 1) direction. In each Al3(PO4)8 sheet, there are two inequivalent Al sites. In the first Al site, Al is bonded to six O atoms to form AlO6 octahedra that share corners with three PO4 tetrahedra. There are a spread of Al–O bond distances ranging from 1.85–1.98 Å. In the second Al site, Al is bonded to six O atoms to form AlO6 octahedra that share corners with two equivalent PO4 tetrahedra. There are a spread of Al–O bond distances ranging from 1.86–1.95 Å. There are four inequivalent P sites. In the first P site, P is bonded to four O atoms to form PO4 tetrahedra that share corners with two AlO6 octahedra. The corner-sharing octahedra tilt angles range from 22–37°. There are a spread of P–O bond distances ranging from 1.52–1.60 Å. In the second P site, P is bonded in a trigonal planar geometry to three O atoms. There is one shorter (1.47 Å) and two longer (1.50 Å) P–O bond length. In the third P site, P is bonded to four O atoms to form PO4 tetrahedra that share corners with two equivalent AlO6 octahedra. The corner-sharing octahedra tilt angles range from 20–31°. There is two shorter (1.53 Å) and two longer (1.55 Å) P–O bond length. In the fourth P site, P is bonded in a trigonal planar geometry to three O atoms. There is one shorter (1.48 Å) and two longer (1.49 Å) P–O bond length. There are sixteen inequivalent O sites. In the first O site, O is bonded in a bent 150 degrees geometry to one Al and one P atom. In the second O site, O is bonded in a distorted bent 120 degrees geometry to one Al and one P atom. In the third O site, O is bonded in a single-bond geometry to one O atom. The O–O bond length is 1.21 Å. In the fourth O site, O is bonded in a bent 150 degrees geometry to one Al and one P atom. In the fifth O site, O is bonded in a bent 150 degrees geometry to one Al and one P atom. In the sixth O site, O is bonded in a single-bond geometry to one P and one O atom. The O–O bond length is 1.88 Å. In the seventh O site, O is bonded in a single-bond geometry to one P atom. In the eighth O site, O is bonded in a distorted bent 120 degrees geometry to one Al and one P atom. In the ninth O site, O is bonded in a bent 150 degrees geometry to one Al and one P atom. In the tenth O site, O is bonded in a water-like geometry to two O atoms. In the eleventh O site, O is bonded in a bent 150 degrees geometry to one Al and one P atom. In the twelfth O site, O is bonded in a bent 150 degrees geometry to one Al and one P atom. In the thirteenth O site, O is bonded in a single-bond geometry to one P atom. In the fourteenth O site, O is bonded in a single-bond geometry to one P atom. In the fifteenth O site, O is bonded in a single-bond geometry to one P atom. In the sixteenth O site, O is bonded in a bent 150 degrees geometry to one Al and one P atom.
DOI: 10.17188/1686017
title: Materials Data on PrMgSn by Materials Project

description: PrMgSn crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Mg is bonded to four equivalent Mg, four equivalent Pr, and four equivalent Sn atoms to form distorted MgPr4Mg4Sn4 cuboctahedra that share corners with four equivalent MgPr4Mg4Sn4 cuboctahedra, corners with four equivalent PrMg4Sn5 square pyramids, edges with eight equivalent PrMg4Sn5 square pyramids, faces with eight equivalent MgPr4Mg4Sn4 cuboctahedra, and faces with four equivalent PrMg4Sn5 square pyramids. All Mg–Mg bond lengths are 3.22 Å. All Mg–Pr bond lengths are 3.50 Å. All Mg–Sn bond lengths are 3.13 Å. Pr is bonded to four equivalent Mg and five equivalent Sn atoms to form distorted PrMg4Sn5 square pyramids that share corners with four equivalent MgPr4Mg4Sn4 cuboctahedra, corners with eight equivalent PrMg4Sn5 square pyramids, edges with eight equivalent MgPr4Mg4Sn4 cuboctahedra, edges with four equivalent PrMg4Sn5 square pyramids, faces with four equivalent MgPr4Mg4Sn4 cuboctahedra, and faces with five equivalent PrMg4Sn5 square pyramids. There are four shorter (3.25 Å) and one longer (3.33 Å) Pr–Sn bond lengths. Sn is bonded in a 9-coordinate geometry to four equivalent Mg and five equivalent Pr atoms.
DOI: 10.17188/1686018
title: Materials Data on Ni3(PO4)4 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1686019
title: Materials Data on Yb3Pa by Materials Project

description: PaYb3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pa is bonded to twelve equivalent Yb atoms to form PaYb12 cuboctahedra that share corners with twelve equivalent PaYb12 cuboctahedra, edges with twenty-four equivalent YbYb8Pa4 cuboctahedra, faces with six equivalent PaYb12 cuboctahedra, and faces with twelve equivalent YbYb8Pa4 cuboctahedra. All Pa–Yb bond lengths are 3.66 Å. Yb is bonded to four equivalent Pa and eight equivalent Yb atoms to form distorted YbYb8Pa4 cuboctahedra that share corners with twelve equivalent YbYb8Pa4 cuboctahedra, edges with eight equivalent PaYb12 cuboctahedra, edges with sixteen equivalent YbYb8Pa4 cuboctahedra, faces with four equivalent PaYb12 cuboctahedra, and faces with fourteen equivalent YbYb8Pa4 cuboctahedra. All Yb–Yb bond lengths are 3.66 Å.
DOI: 10.17188/1686022
title: Materials Data on Li2V3TeO8 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1686023
title: Materials Data on Te4Pt3 by Materials Project

description: Pt3Te4 crystallizes in the monoclinic C2/m space group. The structure is one-dimensional and consists of two Pt3Te4 ribbons oriented in the (0, 1, 0) direction. there are two inequivalent Pt+2.67+ sites. In the first Pt+2.67+ site, Pt+2.67+ is bonded in a 3-coordinate geometry to three Te2- atoms. There are two shorter (2.58 Å) and one longer (2.74 Å) Pt–Te bond lengths. In the second Pt+2.67+ site, Pt+2.67+ is bonded in a linear geometry to two equivalent Te2- atoms. Both Pt–Te bond lengths are 2.57 Å. There are two inequivalent Te2- sites. In the first Te2- site, Te2- is bonded in a 6-coordinate geometry to two Pt+2.67+ atoms. In the second Te2- site, Te2- is bonded in a distorted bent 120 degrees geometry to two equivalent Pt+2.67+ atoms.
DOI: 10.17188/1686025
title: Materials Data on AlWC2 by Materials Project

description: WAlC2 is Tungsten Carbide-derived structured and crystallizes in the orthorhombic Pmm2 space group. The structure is three-dimensional. W5+ is bonded to six C4- atoms to form distorted WC6 pentagonal pyramids that share corners with four equivalent WC6 pentagonal pyramids, corners with eight equivalent AlC6 pentagonal pyramids, edges with two equivalent WC6 pentagonal pyramids, edges with four equivalent AlC6 pentagonal pyramids, and faces with two equivalent WC6 pentagonal pyramids. There are two shorter (2.14 Å) and four longer (2.18 Å) W–C bond lengths. Al3+ is bonded to six C4- atoms to form distorted AlC6 pentagonal pyramids that share corners with four equivalent AlC6 pentagonal pyramids, corners with eight equivalent WC6 pentagonal pyramids, edges with two equivalent AlC6 pentagonal pyramids, edges with four equivalent WC6 pentagonal pyramids, and faces with two equivalent AlC6 pentagonal pyramids. There are four shorter (2.19 Å) and two longer (2.36 Å) Al–C bond lengths. There are two inequivalent C4- sites. In the first C4- site, C4- is bonded in a 6-coordinate geometry to two equivalent W5+ and four equivalent Al3+ atoms. In the second C4- site, C4- is bonded to four equivalent W5+ and two equivalent Al3+ atoms to form a mixture of distorted edge, face, and corner-sharing CAl2W4 pentagonal pyramids.
DOI: 10.17188/1686026
title: Materials Data on Zn2NiO3 by Materials Project

description: NiZn2O3 is Caswellsilverite-like structured and crystallizes in the orthorhombic Immm space group. The structure is three-dimensional. Ni2+ is bonded to six O2- atoms to form NiO6 octahedra that share corners with two equivalent NiO6 octahedra, corners with four equivalent ZnO6 octahedra, edges with two equivalent NiO6 octahedra, and edges with ten equivalent ZnO6 octahedra. The corner-sharing octahedra tilt angles range from 0–1°. There are four shorter (2.13 Å) and two longer (2.15 Å) Ni–O bond lengths. Zn2+ is bonded to six O2- atoms to form ZnO6 octahedra that share corners with two equivalent NiO6 octahedra, corners with four equivalent ZnO6 octahedra, edges with five equivalent NiO6 octahedra, and edges with seven equivalent ZnO6 octahedra. The corner-sharing octahedra tilt angles range from 0–1°. There are four shorter (2.15 Å) and two longer (2.17 Å) Zn–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to two equivalent Ni2+ and four equivalent Zn2+ atoms to form a mixture of edge and corner-sharing OZn4Ni2 octahedra. The corner-sharing octahedra tilt angles range from 0–1°. In the second O2- site, O2- is bonded to two equivalent Ni2+ and four equivalent Zn2+ atoms to form a mixture of edge and corner-sharing OZn4Ni2 octahedra. The corner-sharing octahedra tilt angles range from 0–1°.
DOI: 10.17188/1686027
title: Materials Data on TiW by Materials Project

description: TiW crystallizes in the orthorhombic Cmmm space group. The structure is two-dimensional and consists of two TiW sheets oriented in the (0, 1, 0) direction. Ti is bonded in a 4-coordinate geometry to four equivalent W atoms. All Ti–W bond lengths are 2.74 Å. W is bonded in a 4-coordinate geometry to four equivalent Ti atoms.
DOI: 10.17188/1686028
title: Materials Data on SrCu4Ag by Materials Project

description: SrAgCu4 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. Sr is bonded in a 10-coordinate geometry to four equivalent Ag and fourteen Cu atoms. All Sr–Ag bond lengths are 3.27 Å. There are a spread of Sr–Cu bond distances ranging from 3.04–3.47 Å. Ag is bonded to four equivalent Sr and eight Cu atoms to form AgSr4Cu8 cuboctahedra that share corners with eight equivalent AgSr4Cu8 cuboctahedra, corners with eight equivalent CuSr4Cu6Ag2 cuboctahedra, edges with two equivalent AgSr4Cu8 cuboctahedra, edges with eight equivalent CuSr4Cu6Ag2 cuboctahedra, faces with two equivalent AgSr4Cu8 cuboctahedra, and faces with eight equivalent CuSr4Cu6Ag2 cuboctahedra. There are four shorter (2.77 Å) and four longer (2.82 Å) Ag–Cu bond lengths. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded in a 11-coordinate geometry to three equivalent Sr, two equivalent Ag, and six Cu atoms. There are four shorter (2.50 Å) and two longer (2.76 Å) Cu–Cu bond lengths. In the second Cu site, Cu is bonded to four equivalent Sr, two equivalent Ag, and six Cu atoms to form CuSr4Cu6Ag2 cuboctahedra that share corners with four equivalent AgSr4Cu8 cuboctahedra, corners with twelve equivalent CuSr4Cu6Ag2 cuboctahedra, edges with four equivalent AgSr4Cu8 cuboctahedra, edges with six equivalent CuSr4Cu6Ag2 cuboctahedra, faces with four equivalent AgSr4Cu8 cuboctahedra, and faces with six equivalent CuSr4Cu6Ag2 cuboctahedra. Both Cu–Cu bond lengths are 2.51 Å.