cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.15468/dl.n6ywcs
title: Occurrence Download

description: A dataset containing 163 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is one of (Carabus concolor Fabricius, 1792)",
 "Geometry POLYGON((-9.36035 44.71551,-10.59082 42.81152,-11.82129 36.80928,-7.69043 36.17336,-3.38379 35.88905,3.12012 38.13456,9.18457 38.20366,11.7334 37.16032,12.78809 34.74161,17.09473 33.79741, 23.15918 34.23451,30.10254 32.62087,33.2666 32.99024,35.72754 35.03,33.00293 35.53223,28.69629 35.17381,28.34473 36.31513,25.7959 37.50973,24.91699 39.90974,28.78418 40.6473,30.71777 41.17865,36.87012 45.213,38.18848 46.98025,38.71582 47.7541,39.94629 47.93107,40.20996 49.61071,37.0459 50.34546,35.72754 50.40152,33.79395 52.26816,31.68457 51.94426,31.4209 53.27835,32.56348 53.43572,30.98145 54.77535,30.89355 55.52863,28.43262 56.02295,27.20215 57.65716,27.37793 58.30949,27.90527 59.17593,29.66309 59.88894,27.6416 60.58697,31.50879 62.75473,28.78418 69.83962,30.89355 70.28912,29.22363 71.55274,21.75293 71.30079,14.28223 70.14036,11.38184 67.47492,4.87793 63.66576,-5.53711 71.52491,-10.63477 71.69129,-21.5332 67.74276,-28.56445 65.36684,-24.3457 61.35461,-9.36035 44.71551))",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "Year is greater than or equal to 1980",
 "Year is less than or equal to 2021"
 ]
}

 The dataset includes 163 records from 3 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0234610-210914110416597/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.9sufek
title: Occurrence Download

description: A dataset containing 11663 species occurrences available in GBIF matching the query:
{
 "and" : [
 {
 "or" : [
 "Country is Brazil",
 "Country is Argentina",
 "Country is Paraguay"
 ]
 },
 "OccurrenceStatus is Present",
 "TaxonKey is Pipraeidea melanonota (Vieillot, 1819)"
 ]
}

 The dataset includes 11663 records from 43 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0380015-210914110416597/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.25549/inscriptifact-ouc112017569
title: Cuneiform Tablet 1913.14.0227, Spurlock 1913.14.0227

description: [Text Description:] Administrative tablet ❧ [Text or Publication Number Note:] Spurlock 1913.14.0227; CDLI P420609 ❧ [Medium:] Clay ❧ [Script Note:] Non-Alphabetic Cuneiform ❧ [Physical Object Description:] Yellowish White (10YR 9/1.5) ❧ [Physical Object Note:] 3.6 x 3.3 x 2 cm (29g) ❧ [Physical Object Note:] Seal impressions
DOI: 10.15468/dl.ghfpme
title: Occurrence Download

description: A dataset containing 3052 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Brassica carinata A.Braun"
 ]
}

 The dataset includes 3052 records from 45 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0050306-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.jd8hkk
title: Occurrence Download

description: A dataset containing 611 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Koelreuteria elegans subsp. formosana (Hayata) F.G.Mey."
 ]
}

 The dataset includes 611 records from 67 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0016936-230530130749713/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.wjnh2c
title: Occurrence Download

description: A dataset containing 2179 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Gaultheria mucronata (L.fil.) Hook. & Arn.",
 "HasCoordinate is true"
 ]
}

 The dataset includes 2179 records from 75 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0038703-231120084113126/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.25549/inscriptifact-ouc112039982
title: Cuneiform Tablet 1913.14.1708, Spurlock 1913.14.1708

description: [Text Description:] Delivery of silver from barley ❧ [Text or Publication Number Note:] Spurlock 1913.14.1708; CDLI P421559 ❧ [Medium:] Clay ❧ [Script Note:] Non-Alphabetic Cuneiform ❧ [Physical Object Description:] Yellowish Gray (10YR 8/2) -body Dark Gray (N 4/ 12.0% R) -dark discoloration White (N 9/ 78.7% R) -light discoloration ❧ [Physical Object Note:] 5.7 x 4.1 x 2.1 cm (45 g)
DOI: 10.15468/dl.yjjwab
title: Occurrence Download

description: A dataset containing 1153 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Attila torridus P.L.Sclater, 1860"
 ]
}

 The dataset includes 1153 records from 22 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0380018-210914110416597/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.e3sadk
title: Occurrence Download

description: A dataset containing 61871 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Artamus superciliosus (Gould, 1837)"
 ]
}

 The dataset includes 61871 records from 80 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0382506-210914110416597/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.25549/inscriptifact-ouc112040127
title: Cuneiform Tablet 1913.14.1708, Spurlock 1913.14.1708

description: [Text Description:] Delivery of silver from barley ❧ [Text or Publication Number Note:] Spurlock 1913.14.1708; CDLI P421559 ❧ [Medium:] Clay ❧ [Script Note:] Non-Alphabetic Cuneiform ❧ [Physical Object Description:] Yellowish Gray (10YR 8/2) -body Dark Gray (N 4/ 12.0% R) -dark discoloration White (N 9/ 78.7% R) -light discoloration ❧ [Physical Object Note:] 5.7 x 4.1 x 2.1 cm (45 g)
DOI: 10.15468/dl.af57ss
title: Occurrence Download

description: A dataset containing 523 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Parodiophyllochloa pantricha (Hack.) Zuloaga & Morrone"
 ]
}

 The dataset includes 523 records from 81 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0059666-230530130749713/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.3wy9s6
title: Occurrence Download

description: A dataset containing 20077 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Gaultheria procumbens L.",
 "HasCoordinate is true"
 ]
}

 The dataset includes 20077 records from 134 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0038704-231120084113126/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.p7s6ft
title: Occurrence Download

description: A dataset containing 8475 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Cyphorhinus thoracicus Tschudi, 1844"
 ]
}

 The dataset includes 8475 records from 48 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0377259-210914110416597/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.25549/inscriptifact-ouc112040080
title: Cuneiform Tablet 1913.14.1708, Spurlock 1913.14.1708

description: [Text Description:] Delivery of silver from barley ❧ [Text or Publication Number Note:] Spurlock 1913.14.1708; CDLI P421559 ❧ [Medium:] Clay ❧ [Script Note:] Non-Alphabetic Cuneiform ❧ [Physical Object Description:] Yellowish Gray (10YR 8/2) -body Dark Gray (N 4/ 12.0% R) -dark discoloration White (N 9/ 78.7% R) -light discoloration ❧ [Physical Object Note:] 5.7 x 4.1 x 2.1 cm (45 g)
DOI: 10.15468/dl.c8nj9n
title: Occurrence Download

description: A dataset containing 24714529 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is one of (Magnoliopsida, Liliopsida, Gnetopsida, Cycadopsida, Cycadopsis Debey, 1848, Pinopsida, Ginkgoopsida)",
 "BasisOfRecord is one of (Specimen, Human Observation)",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "Year is greater than or equal to 2000",
 "Continent is Europe"
 ]
}

 The dataset includes 24714529 records from 158 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0050400-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.25582/data.2024-01.3006582/2550889
title: Data for EMSL Project 60580 from January 2024
DOI: 10.25582/data.2024-01.3006583/2550890
title: Data for EMSL Project 60580 from January 2024
DOI: 10.6084/m9.figshare.28765067
title: Adult male Drosophila hemolymph aqueous metabolite profiling on 7-day and 14-day High sugar diets with normal diet controls.

description: <b>Metabolomics: The samples were three replicates of Hemolymph collected from adult males flies subjected to 7- and 14- day normal or High Sugar (30% more sucrose in standard lab food). Per replicate we collected hemolymph from 30 male flies. </b>Targeted LC-MS metabolite analysis was performed on a duplex-LC-MS system composed of two Shimadzu UPLC pumps, CTC Analytics PAL HTC-xt temperature-controlled auto-sampler, and AB Sciex 6500+ Triple Quadrupole MS equipped with ESI ionization source. UPLC pumps were connected to the auto-sampler in parallel and could perform two chromatography separations independently from each other. Each sample was injected twice on two identical analytical columns (Waters XBridge BEH Amide XP), where separations were performed in hydrophilic interaction liquid chromatography (HILIC) mode. While one column was performing separation and MS data acquisition in ESI+ ionization mode, the other column was getting equilibrated for sample injection, chromatography separation, and MS data acquisition in ESI- mode. Each chromatography separation was 18 minutes (total analysis time per sample was 36 minutes). MS data acquisition was performed in multiple-reaction-monitoring (MRM) mode. LC-MS system was controlled using AB Sciex Analyst 1.6.3 software. Measured MS peaks were integrated using AB Sciex MultiQuant 3.0.3 software. Up to 158 metabolites (plus 4 spiked standards) were measured across the fly samples study set, and up to 148 metabolites (plus 34 SILISs) were measured in the hemolymph sample set. For the hemolymph set, absolute concentrations of 30 metabolites were determined. In addition to the two study samples, two sets of quality control (QC) samples were used to monitor the assay performance and data reproducibility. One QC [QC(I)] was a pooled human serum sample used to monitor system performance, and the other QC [QC(S)] was pooled study samples. This QC was used to monitor data reproducibility. Each QC sample was injected per every 10 study samples. The median CV for the fly set was 2.8%, while for the blood samples was 11.1%.
DOI: 10.25582/data.2024-01.3006589/2550891
title: Data for EMSL Project 60580 from January 2024
DOI: 10.25582/data.2024-01.3006592/2550892
title: Data for EMSL Project 60580 from January 2024
DOI: 10.15468/dl.499wag
title: Occurrence Download

description: A dataset containing 23 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Lantana camara",
 "Country is Botswana",
 "HasCoordinate is true"
 ]
}

 The dataset includes 23 records from 2 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0021695-250717081556266/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.mjkjhh
title: Occurrence Download

description: A dataset containing 12791 species occurrences available in GBIF matching the query:
{
 "and" : [
 "HasCoordinate is true",
 "TaxonKey is Flueggea virosa"
 ]
}

 The dataset includes 12791 records from 199 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0021694-250717081556266/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.aaw8dg
title: Occurrence Download

description: A dataset containing 3 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Potamogeton perfoliatus",
 "Country is New Zealand",
 "HasCoordinate is true"
 ]
}

 The dataset includes 3 records from 3 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0021698-250717081556266/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.9wcjnx
title: Occurrence Download

description: A dataset containing 1383 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Melica ciliata magnolii"
 ]
}

 The dataset includes 1383 records from 45 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0021699-250717081556266/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.6x76km
title: Occurrence Download

description: A dataset containing 989381 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Anthoxanthum odoratum"
 ]
}

 The dataset includes 989381 records from 3431 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0021572-250717081556266/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5517/cc4ng18
title: CCDC 138819: Experimental Crystal Structure Determination

description: Related Article: E.Monzani, G.Battaini, A.Perotti, L.Casella, M.Gullotti, L.Santagostini, G.Nardin, L.Randaccio, S.Geremia, P.Zanello, G.Opromolla|1999|Inorg.Chem.|38|5359|doi:10.1021/ic990397b
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4ng29
title: CCDC 138820: Experimental Crystal Structure Determination

description: Related Article: J.A.Johnson, M.M.Olmstead, A.L.Balch|1999|Inorg.Chem.|38|5379|doi:10.1021/ic9904283
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4n878
title: CCDC 138639: Experimental Crystal Structure Determination

description: Related Article: C.J.Matthews, K.Avery, Zhiqiang Xu, L.K.Thompson, Liang Zhao, D.O.Miller, K.Biradha, K.Poirier, M.J.Zaworotko, C.Wilson, A.E.Goeta, J.A.K.Howard|1999|Inorg.Chem.|38|5266|doi:10.1021/ic990598f
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4ng3b
title: CCDC 138821: Experimental Crystal Structure Determination

description: Related Article: J.A.Johnson, M.M.Olmstead, A.L.Balch|1999|Inorg.Chem.|38|5379|doi:10.1021/ic9904283
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4n889
title: CCDC 138640: Experimental Crystal Structure Determination

description: Related Article: C.J.Matthews, K.Avery, Zhiqiang Xu, L.K.Thompson, Liang Zhao, D.O.Miller, K.Biradha, K.Poirier, M.J.Zaworotko, C.Wilson, A.E.Goeta, J.A.K.Howard|1999|Inorg.Chem.|38|5266|doi:10.1021/ic990598f
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4n89b
title: CCDC 138641: Experimental Crystal Structure Determination

description: Related Article: C.J.Matthews, K.Avery, Zhiqiang Xu, L.K.Thompson, Liang Zhao, D.O.Miller, K.Biradha, K.Poirier, M.J.Zaworotko, C.Wilson, A.E.Goeta, J.A.K.Howard|1999|Inorg.Chem.|38|5266|doi:10.1021/ic990598f
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4n8bc
title: CCDC 138642: Experimental Crystal Structure Determination

description: Related Article: C.J.Matthews, K.Avery, Zhiqiang Xu, L.K.Thompson, Liang Zhao, D.O.Miller, K.Biradha, K.Poirier, M.J.Zaworotko, C.Wilson, A.E.Goeta, J.A.K.Howard|1999|Inorg.Chem.|38|5266|doi:10.1021/ic990598f
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4n8cd
title: CCDC 138643: Experimental Crystal Structure Determination

description: Related Article: C.J.Matthews, K.Avery, Zhiqiang Xu, L.K.Thompson, Liang Zhao, D.O.Miller, K.Biradha, K.Poirier, M.J.Zaworotko, C.Wilson, A.E.Goeta, J.A.K.Howard|1999|Inorg.Chem.|38|5266|doi:10.1021/ic990598f
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4nbdh
title: CCDC 138706: Experimental Crystal Structure Determination

description: Related Article: C.J.Matthews, K.Avery, Zhiqiang Xu, L.K.Thompson, Liang Zhao, D.O.Miller, K.Biradha, K.Poirier, M.J.Zaworotko, C.Wilson, A.E.Goeta, J.A.K.Howard|1999|Inorg.Chem.|38|5266|doi:10.1021/ic990598f
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4nd5b
title: CCDC 138761: Experimental Crystal Structure Determination

description: Related Article: W.S.Bryant, J.W.Jones, P.E.Mason, I.Guzei, A.L.Rheingold, F.R.Fronczek, D.S.Nagvekar, H.W.Gibson|1999|Org.Lett.|1|1001|doi:10.1021/ol990780k
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4mdy2
title: CCDC 137824: Experimental Crystal Structure Determination

description: Related Article: F.G.N.Cloke, P.B.Hitchcock, J.F.Nixon, D.J.Wilson, F.Tabellion, U.Fischbeck, F.Preuss, M.Regitz, L.Nyulaszi|1999|Chem.Commun.||2363|doi:10.1039/a907550j
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4nd6c
title: CCDC 138762: Experimental Crystal Structure Determination

description: Related Article: W.S.Bryant, J.W.Jones, P.E.Mason, I.Guzei, A.L.Rheingold, F.R.Fronczek, D.S.Nagvekar, H.W.Gibson|1999|Org.Lett.|1|1001|doi:10.1021/ol990780k
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc433t4
title: CCDC 122165: Experimental Crystal Structure Determination

description: Related Article: D.D.Ellis, P.A.Jelliss, F.G.A.Stone|1999|Chem.Commun.||2385|doi:10.1039/a907144j
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4gl27
title: CCDC 133178: Experimental Crystal Structure Determination

description: Related Article: E.A.Kretzschmar, J.Kipke, J.Sundermeyer|1999|Chem.Commun.||2381|doi:10.1039/a907525i
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc433v5
title: CCDC 122166: Experimental Crystal Structure Determination

description: Related Article: D.D.Ellis, P.A.Jelliss, F.G.A.Stone|1999|Chem.Commun.||2385|doi:10.1039/a907144j
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/cc4bxgt
title: CCDC 129656: Experimental Crystal Structure Determination

description: Related Article: C.Tejel, M.Bordonaba, M.A.Ciriano, F.J.Lahoz, L.A.Oro|1999|Chem.Commun.||2387|doi:10.1039/a907853c
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.