cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1272992
title: Materials Data on NdNi4B by Materials Project

description: NdNi4B crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. there are two inequivalent Nd sites. In the first Nd site, Nd is bonded in a 12-coordinate geometry to twelve equivalent Ni and six equivalent B atoms. All Nd–Ni bond lengths are 2.91 Å. All Nd–B bond lengths are 2.92 Å. In the second Nd site, Nd is bonded in a distorted hexagonal planar geometry to six equivalent Ni atoms. All Nd–Ni bond lengths are 2.92 Å. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 12-coordinate geometry to three equivalent Nd and six equivalent Ni atoms. All Ni–Ni bond lengths are 2.51 Å. In the second Ni site, Ni is bonded in a distorted L-shaped geometry to two equivalent Nd, two equivalent Ni, and two equivalent B atoms. Both Ni–B bond lengths are 2.05 Å. B is bonded in a 6-coordinate geometry to three equivalent Nd and six equivalent Ni atoms.
DOI: 10.17188/1272993
title: Materials Data on Er4InIr by Materials Project

description: Er4IrIn crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are three inequivalent Er sites. In the first Er site, Er is bonded in a 4-coordinate geometry to two equivalent Ir and two equivalent In atoms. Both Er–Ir bond lengths are 3.44 Å. Both Er–In bond lengths are 3.22 Å. In the second Er site, Er is bonded in a 3-coordinate geometry to three equivalent Ir and three equivalent In atoms. All Er–Ir bond lengths are 2.82 Å. All Er–In bond lengths are 3.42 Å. In the third Er site, Er is bonded in a distorted bent 150 degrees geometry to two equivalent Ir and two equivalent In atoms. Both Er–Ir bond lengths are 2.79 Å. Both Er–In bond lengths are 3.45 Å. Ir is bonded in a 6-coordinate geometry to nine Er atoms. In is bonded in a 12-coordinate geometry to nine Er and three equivalent In atoms. All In–In bond lengths are 3.19 Å.
DOI: 10.17188/1272994
title: Materials Data on CeIn7Pt2 by Materials Project

description: CePt2In7 crystallizes in the triclinic P1 space group. The structure is three-dimensional. Ce is bonded to twelve In atoms to form a mixture of face and corner-sharing CeIn12 cuboctahedra. There are a spread of Ce–In bond distances ranging from 3.24–3.41 Å. There are two inequivalent Pt sites. In the first Pt site, Pt is bonded in a body-centered cubic geometry to eight In atoms. There are a spread of Pt–In bond distances ranging from 2.80–2.86 Å. In the second Pt site, Pt is bonded in a body-centered cubic geometry to eight In atoms. There are a spread of Pt–In bond distances ranging from 2.80–2.87 Å. There are seven inequivalent In sites. In the first In site, In is bonded in a 2-coordinate geometry to two equivalent Ce and two equivalent Pt atoms. In the second In site, In is bonded in a 2-coordinate geometry to two equivalent Ce and two equivalent Pt atoms. In the third In site, In is bonded in a 2-coordinate geometry to two equivalent Ce and two equivalent Pt atoms. In the fourth In site, In is bonded in a distorted rectangular see-saw-like geometry to four equivalent Ce atoms. In the fifth In site, In is bonded to four Pt atoms to form a mixture of edge and corner-sharing InPt4 tetrahedra. In the sixth In site, In is bonded in a 2-coordinate geometry to two equivalent Ce and two equivalent Pt atoms. In the seventh In site, In is bonded to four Pt atoms to form a mixture of edge and corner-sharing InPt4 tetrahedra.
DOI: 10.17188/1272996
title: Materials Data on NaLiV2O6 (SG:15) 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: 10.6084/m9.figshare.13019798.v1
title: Botanical Survey in Mahale, Tanzania - Trees 100x5m plots.xlsx

description: This dataset corresponds to research conducted in Mahale Mountains National Park, Tanzania, and was collection in conjunction with a wildlife survey of the park. Data were collected along 102 transect across 13 survey sites. All trees at 10 cm DBH and higher were recorded within 100x5 m plots that were equally spaced along line transects. This research was conducted from March-2018 thru January-2019.<br>
DOI: 10.17188/1272997
title: Materials Data on KLiSO4 by Materials Project

description: LiKSO4 crystallizes in the hexagonal P6_3 space group. The structure is three-dimensional. K1+ is bonded in a distorted q6 geometry to nine O2- atoms. There are a spread of K–O bond distances ranging from 2.89–3.02 Å. Li1+ is bonded to four O2- atoms to form LiO4 tetrahedra that share corners with four equivalent SO4 tetrahedra. There is one shorter (1.95 Å) and three longer (1.96 Å) Li–O bond length. S6+ is bonded to four O2- atoms to form SO4 tetrahedra that share corners with four equivalent LiO4 tetrahedra. All S–O bond lengths are 1.49 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to two equivalent K1+, one Li1+, and one S6+ atom. In the second O2- site, O2- is bonded in a linear geometry to three equivalent K1+, one Li1+, and one S6+ atom.
DOI: 10.17188/1272998
title: Materials Data on DyAgGe by Materials Project

description: DyAgGe crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Dy is bonded in a 11-coordinate geometry to six equivalent Ag and five Ge atoms. There are two shorter (3.19 Å) and four longer (3.35 Å) Dy–Ag bond lengths. There are one shorter (2.99 Å) and four longer (3.02 Å) Dy–Ge bond lengths. Ag is bonded in a 12-coordinate geometry to six equivalent Dy, two equivalent Ag, and four Ge atoms. Both Ag–Ag bond lengths are 3.10 Å. There are two shorter (2.74 Å) and two longer (2.77 Å) Ag–Ge bond lengths. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to three equivalent Dy and six equivalent Ag atoms. In the second Ge site, Ge is bonded in a 9-coordinate geometry to six equivalent Dy and three equivalent Ag atoms.
DOI: 10.17188/1272999
title: Materials Data on K2NaV5H10O19 (SG: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: 10.17188/1273000
title: Materials Data on Hf2Al4C5 by Materials Project

description: Hf2Al4C5 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Hf4+ is bonded to six C4- atoms to form HfC6 octahedra that share corners with three equivalent HfC6 octahedra, corners with three equivalent AlC4 tetrahedra, edges with nine equivalent HfC6 octahedra, and edges with three equivalent AlC4 tetrahedra. The corner-sharing octahedral tilt angles are 0°. There are three shorter (2.34 Å) and three longer (2.36 Å) Hf–C bond lengths. There are two inequivalent Al3+ sites. In the first Al3+ site, Al3+ is bonded to four C4- atoms to form AlC4 tetrahedra that share corners with three equivalent HfC6 octahedra, corners with six equivalent AlC4 tetrahedra, corners with four equivalent AlC4 trigonal pyramids, and edges with three equivalent HfC6 octahedra. The corner-sharing octahedral tilt angles are 10°. There are one shorter (1.94 Å) and three longer (2.14 Å) Al–C bond lengths. In the second Al3+ site, Al3+ is bonded to four equivalent C4- atoms to form a mixture of edge and corner-sharing AlC4 trigonal pyramids. There are three shorter (1.95 Å) and one longer (2.18 Å) Al–C bond lengths. There are three inequivalent C4- sites. In the first C4- site, C4- is bonded to three equivalent Hf4+ and three equivalent Al3+ atoms to form CHf3Al3 octahedra that share corners with three equivalent CHf6 octahedra, corners with three equivalent CAl5 trigonal bipyramids, and edges with nine CHf3Al3 octahedra. The corner-sharing octahedral tilt angles are 1°. In the second C4- site, C4- is bonded to six equivalent Hf4+ atoms to form a mixture of edge and corner-sharing CHf6 octahedra. The corner-sharing octahedral tilt angles are 1°. In the third C4- site, C4- is bonded to five Al3+ atoms to form CAl5 trigonal bipyramids that share corners with three equivalent CHf3Al3 octahedra, corners with six equivalent CAl5 trigonal bipyramids, and edges with three equivalent CAl5 trigonal bipyramids. The corner-sharing octahedral tilt angles are 64°.
DOI: 10.17188/1273001
title: Materials Data on Rb by Materials Project

description: Rb is alpha La structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Rb sites. In the first Rb site, Rb is bonded to twelve Rb atoms to form a mixture of edge, corner, and face-sharing RbRb12 cuboctahedra. There are six shorter (5.05 Å) and six longer (5.08 Å) Rb–Rb bond lengths. In the second Rb site, Rb is bonded to twelve Rb atoms to form a mixture of edge, corner, and face-sharing RbRb12 cuboctahedra. All Rb–Rb bond lengths are 5.08 Å.
DOI: 10.17188/1273002
title: Materials Data on Ce2Ga12Ni by Materials Project

description: Ce2NiGa12 crystallizes in the tetragonal P4/nbm space group. The structure is three-dimensional. Ce is bonded in a 6-coordinate geometry to fourteen Ga atoms. There are a spread of Ce–Ga bond distances ranging from 3.17–3.37 Å. Ni is bonded in a body-centered cubic geometry to eight equivalent Ga atoms. All Ni–Ga bond lengths are 2.50 Å. There are four inequivalent Ga sites. In the first Ga site, Ga is bonded in a 4-coordinate geometry to one Ce and three Ga atoms. There are one shorter (2.59 Å) and two longer (2.62 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a 9-coordinate geometry to four equivalent Ce and five Ga atoms. The Ga–Ga bond length is 2.43 Å. In the third Ga site, Ga is bonded in a 2-coordinate geometry to two equivalent Ce, two equivalent Ni, and seven Ga atoms. There are a spread of Ga–Ga bond distances ranging from 2.61–3.02 Å. In the fourth Ga site, Ga is bonded in a 9-coordinate geometry to four equivalent Ce and five Ga atoms.
DOI: 10.17188/1273003
title: Materials Data on YMg by Materials Project

description: MgY is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Mg is bonded in a body-centered cubic geometry to eight equivalent Y atoms. All Mg–Y bond lengths are 3.29 Å. Y is bonded in a body-centered cubic geometry to eight equivalent Mg atoms.
DOI: 10.17188/1273004
title: Materials Data on SrV4(AgO6)2 (SG:125) 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: 10.17188/1273005
title: Materials Data on Li6Mn5SbO12 (SG:12) 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: 10.17188/1273006
title: Materials Data on Li4Cu3WO8 (SG: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: 10.17188/1273007
title: Materials Data on NaNi2O3 (SG:164) 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: 10.17188/1273008
title: Materials Data on UNiH14O9F4 (SG:14) 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: 10.17188/1273009
title: Materials Data on K3EuSi3(HO5)2 by Materials Project

description: K3EuSi3(HO5)2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent K1+ sites. In the first K1+ site, K1+ is bonded in a 1-coordinate geometry to two equivalent H1+ and nine O2- atoms. Both K–H bond lengths are 2.98 Å. There are a spread of K–O bond distances ranging from 2.74–3.37 Å. In the second K1+ site, K1+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of K–O bond distances ranging from 2.79–3.04 Å. Eu3+ is bonded to six O2- atoms to form EuO6 octahedra that share corners with six SiO4 tetrahedra. There are a spread of Eu–O bond distances ranging from 2.26–2.47 Å. There are two inequivalent Si4+ sites. In the first Si4+ site, Si4+ is bonded to four O2- atoms to form SiO4 tetrahedra that share corners with two equivalent EuO6 octahedra and corners with two equivalent SiO4 tetrahedra. The corner-sharing octahedra tilt angles range from 4–55°. There are a spread of Si–O bond distances ranging from 1.60–1.67 Å. In the second Si4+ site, Si4+ is bonded to four O2- atoms to form SiO4 tetrahedra that share corners with two equivalent EuO6 octahedra and a cornercorner with one SiO4 tetrahedra. The corner-sharing octahedra tilt angles range from 42–48°. There are a spread of Si–O bond distances ranging from 1.61–1.69 Å. H1+ is bonded in a single-bond geometry to one K1+ and one O2- atom. The H–O bond length is 1.01 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to three K1+, one Eu3+, and one Si4+ atom. In the second O2- site, O2- is bonded in a 3-coordinate geometry to one K1+, one Eu3+, and one Si4+ atom. In the third O2- site, O2- is bonded in a 2-coordinate geometry to two K1+ and two Si4+ atoms. In the fourth O2- site, O2- is bonded in a 2-coordinate geometry to two equivalent K1+, one Eu3+, and one Si4+ atom. In the fifth O2- site, O2- is bonded in a distorted water-like geometry to three equivalent K1+, one Si4+, and one H1+ atom. In the sixth O2- site, O2- is bonded in a 1-coordinate geometry to two K1+, one Eu3+, and one Si4+ atom.
DOI: 10.17188/1273010
title: Materials Data on La2Ga12Ni by Materials Project

description: La2NiGa12 crystallizes in the tetragonal P4/nbm space group. The structure is three-dimensional. La is bonded in a 6-coordinate geometry to fourteen Ga atoms. There are a spread of La–Ga bond distances ranging from 3.22–3.41 Å. Ni is bonded in a body-centered cubic geometry to eight equivalent Ga atoms. All Ni–Ga bond lengths are 2.53 Å. There are four inequivalent Ga sites. In the first Ga site, Ga is bonded in a 9-coordinate geometry to four equivalent La and five Ga atoms. There are one shorter (2.50 Å) and four longer (2.66 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a 2-coordinate geometry to two equivalent La, two equivalent Ni, and three Ga atoms. The Ga–Ga bond length is 2.62 Å. In the third Ga site, Ga is bonded in a 9-coordinate geometry to four equivalent La and five Ga atoms. All Ga–Ga bond lengths are 2.64 Å. In the fourth Ga site, Ga is bonded in a 4-coordinate geometry to one La and three Ga atoms. The Ga–Ga bond length is 2.57 Å.
DOI: 10.17188/1273011
title: Materials Data on Ce2Ga12Cu by Materials Project

description: Ce2CuGa12 crystallizes in the tetragonal P4/nbm space group. The structure is three-dimensional. Ce is bonded in a 10-coordinate geometry to fourteen Ga atoms. There are a spread of Ce–Ga bond distances ranging from 3.20–3.42 Å. Cu is bonded in a body-centered cubic geometry to eight equivalent Ga atoms. There are four shorter (2.54 Å) and four longer (2.55 Å) Cu–Ga bond lengths. There are four inequivalent Ga sites. In the first Ga site, Ga is bonded in a 4-coordinate geometry to one Ce and six Ga atoms. There are a spread of Ga–Ga bond distances ranging from 2.59–3.04 Å. In the second Ga site, Ga is bonded in a 9-coordinate geometry to four equivalent Ce and five Ga atoms. There are one shorter (2.45 Å) and four longer (2.62 Å) Ga–Ga bond lengths. In the third Ga site, Ga is bonded in a 9-coordinate geometry to four equivalent Ce and five Ga atoms. In the fourth Ga site, Ga is bonded in a 2-coordinate geometry to two equivalent Ce, two equivalent Cu, and three Ga atoms. The Ga–Ga bond length is 2.64 Å.
DOI: 10.15468/mf6njf
title: Contributions to the knowledge of southern South American species of Astylus Laporte, 1836 (Coleoptera: Melyridae). Re-describing Astylus vittaticollis (Blanchard, 1843) and A. patagonicus (Blanchard, 1843)

description: This dataset contains the digitized treatments in Plazi based on the original journal article Estrada, Patricia (2020): Contributions to the knowledge of southern South American species of Astylus Laporte, 1836 (Coleoptera: Melyridae). Re-describing Astylus vittaticollis (Blanchard, 1843) and A. patagonicus (Blanchard, 1843). Zootaxa 4845 (1): 119-126, DOI: https://doi.org/10.11646/zootaxa.4845.1.9
DOI: 10.17188/1273012
title: Materials Data on Cs3Bi by Materials Project

description: BiCs3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Cs sites. In the first Cs site, Cs is bonded to four equivalent Cs and four equivalent Bi atoms to form a mixture of distorted edge, corner, and face-sharing CsCs4Bi4 tetrahedra. All Cs–Cs bond lengths are 4.13 Å. All Cs–Bi bond lengths are 4.13 Å. In the second Cs site, Cs is bonded in a body-centered cubic geometry to eight equivalent Cs atoms. Bi is bonded in a body-centered cubic geometry to eight equivalent Cs atoms.
DOI: 10.17188/1273014
title: Materials Data on CsIrO3 by Materials Project

description: CsIrO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Cs1+ is bonded to twelve equivalent O2- atoms to form CsO12 cuboctahedra that share corners with twelve equivalent CsO12 cuboctahedra, faces with six equivalent CsO12 cuboctahedra, and faces with eight equivalent IrO6 octahedra. All Cs–O bond lengths are 2.89 Å. Ir5+ is bonded to six equivalent O2- atoms to form IrO6 octahedra that share corners with six equivalent IrO6 octahedra and faces with eight equivalent CsO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ir–O bond lengths are 2.05 Å. O2- is bonded to four equivalent Cs1+ and two equivalent Ir5+ atoms to form a mixture of distorted corner, edge, and face-sharing OCs4Ir2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.
DOI: 10.17188/1273015
title: Materials Data on Li5AgF8 by Materials Project

description: Li5AgF8 is Spinel-like structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded to four F1- atoms to form LiF4 tetrahedra that share corners with three equivalent AgF6 octahedra and corners with nine equivalent LiF6 octahedra. The corner-sharing octahedra tilt angles range from 52–63°. There is one shorter (1.89 Å) and three longer (1.97 Å) Li–F bond length. In the second Li1+ site, Li1+ is bonded to six F1- atoms to form LiF6 octahedra that share corners with six equivalent LiF4 tetrahedra, edges with two equivalent AgF6 octahedra, and edges with four equivalent LiF6 octahedra. There are two shorter (2.00 Å) and four longer (2.12 Å) Li–F bond lengths. Ag3+ is bonded to six equivalent F1- atoms to form AgF6 octahedra that share corners with six equivalent LiF4 tetrahedra and edges with six equivalent LiF6 octahedra. All Ag–F bond lengths are 2.11 Å. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a rectangular see-saw-like geometry to three Li1+ and one Ag3+ atom. In the second F1- site, F1- is bonded to four Li1+ atoms to form distorted corner-sharing FLi4 trigonal pyramids.
DOI: 10.17188/1273016
title: Materials Data on NaUO3 by Materials Project

description: NaUO3 is Orthorhombic Perovskite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Na1+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Na–O bond distances ranging from 2.43–2.96 Å. U5+ is bonded to six O2- atoms to form corner-sharing UO6 octahedra. The corner-sharing octahedral tilt angles are 31°. There are four shorter (2.16 Å) and two longer (2.17 Å) U–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Na1+ and two equivalent U5+ atoms. In the second O2- site, O2- is bonded to two equivalent Na1+ and two equivalent U5+ atoms to form distorted corner-sharing ONa2U2 tetrahedra.
DOI: 10.17188/1273017
title: Materials Data on NdTl(MoO4)2 (SG:126) 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: 10.17188/1273018
title: Materials Data on W by Materials Project

description: W is Copper structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. W is bonded to twelve equivalent W atoms to form a mixture of edge, corner, and face-sharing WW12 cuboctahedra. All W–W bond lengths are 2.86 Å.
DOI: 10.17188/1273019
title: Materials Data on H2 (SG:139) 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: 10.17188/1273020
title: Materials Data on CaFeO3 by Materials Project

description: CaFeO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ca is bonded to twelve equivalent O atoms to form CaO12 cuboctahedra that share corners with twelve equivalent CaO12 cuboctahedra, faces with six equivalent CaO12 cuboctahedra, and faces with eight equivalent FeO6 octahedra. All Ca–O bond lengths are 2.71 Å. Fe is bonded to six equivalent O atoms to form FeO6 octahedra that share corners with six equivalent FeO6 octahedra and faces with eight equivalent CaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Fe–O bond lengths are 1.92 Å. O is bonded to four equivalent Ca and two equivalent Fe atoms to form a mixture of distorted edge, face, and corner-sharing OCa4Fe2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.
DOI: 10.17188/1273021
title: Materials Data on LiC6 by Materials Project

description: LiC6 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Li1+ is bonded to twelve equivalent C+0.17- atoms to form face-sharing LiC12 cuboctahedra. All Li–C bond lengths are 2.36 Å. C+0.17- is bonded in a 5-coordinate geometry to two equivalent Li1+ and three equivalent C+0.17- atoms. All C–C bond lengths are 1.44 Å.
DOI: 10.17188/1273022
title: Materials Data on C4O3 by Materials Project

description: OC4O2 crystallizes in the trigonal R3 space group. The structure is zero-dimensional and consists of thirty-six formic anhydride molecules and seventy-two methane molecules.