cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5281/zenodo.7199162
title: Dataset: Economical Accommodations for Neurodivergent Students in Software Engineering Education: Experiences from an Intervention in Four Undergraduate Courses

description: This dataset contains anonymised raw data and examples of accommodations made for neurodiverse students in four undergraduate courses in Computer Science and Software Engineering programmes. The dataset is published as a part of a book chapter in which we report the accommodations. Overall guidelines we followed, including their sources, are contained in <strong>guidelines.md.</strong> The raw data for the two surveys is contained in the two Excel files <strong>survey1.xlsx</strong> and <strong>survey2.xlsx</strong>. Free-text answers have been aggregated by neurodiverse and neurotypical students and anonymised, and are available in the files<strong> survey1_freetext_neurodiverse.txt, survey1_freetext_neurotypical.txt, survey2_freetext_neurodiverse.txt, </strong>and<strong> survey2_freetext_neurotypical.txt.</strong> The remaining files are examples of the adapted lecture slides and assignment texts. Here, files starting with WEBcourse are from a mandatory undergraduate course on web development, while files starting with SEcourse are from a mandatory undergraduate course giving an overview of Software Engineering.
DOI: 10.5281/zenodo.7199161
title: Dataset: Economical Accommodations for Neurodivergent Students in Software Engineering Education: Experiences from an Intervention in Four Undergraduate Courses

description: This dataset contains anonymised raw data and examples of accommodations made for neurodiverse students in four undergraduate courses in Computer Science and Software Engineering programmes. The dataset is published as a part of a book chapter in which we report the accommodations. Overall guidelines we followed, including their sources, are contained in <strong>guidelines.md.</strong> The raw data for the two surveys is contained in the two Excel files <strong>survey1.xlsx</strong> and <strong>survey2.xlsx</strong>. Free-text answers have been aggregated by neurodiverse and neurotypical students and anonymised, and are available in the files<strong> survey1_freetext_neurodiverse.txt, survey1_freetext_neurotypical.txt, survey2_freetext_neurodiverse.txt, </strong>and<strong> survey2_freetext_neurotypical.txt.</strong> The remaining files are examples of the adapted lecture slides and assignment texts. Here, files starting with WEBcourse are from a mandatory undergraduate course on web development, while files starting with SEcourse are from a mandatory undergraduate course giving an overview of Software Engineering.
DOI: 10.6084/m9.figshare.19666531.v1
title: Hemophagocytic Lymphohistiocytosis Syndrome Secondary to Disseminated Histoplasmosis in a Presumably Immunocompetent Adolescent: A Novel Case

description: Hemophagocytic Lymphohistiocytosis Syndrome Secondary to Disseminated Histoplasmosis in a Presumably Immunocompetent Adolescent: A Novel Case
DOI: 10.5281/zenodo.7199122
title: Burke and Gambhir, 2022_ECC_DATASET

description: This dataset contains the Marginal abatement cost curve data for different Greenhouse Gas Removal Options for the journal article Burke and Gambhir, 2022 published in Energy and Climate Change
DOI: 10.5281/zenodo.7199121
title: Burke and Gambhir, 2022_ECC_DATASET

description: This dataset contains the Marginal abatement cost curve data for different Greenhouse Gas Removal Options for the journal article Burke and Gambhir, 2022 published in Energy and Climate Change
DOI: 10.5281/zenodo.7196007
title: Formation of c-C6H5CN ice using the SPACE TIGER experimental setup

description: Benzonitrile (c-C6H5CN) has been recently detected in cold and dense regions of the interstellar medium (ISM), where it has been used as a signpost of a rich aromatic organic chemistry that might lead to the production of polycyclic aromatic hydrocarbons (PAHs). One possible origin of this benzonitrile is interstellar ice chemistry involving benzene (c-C6H6) and nitrile molecules (organic molecules containing the −C≡N group). We have addressed the plausibility of this c-C6H5CN formation pathway through laboratory experiments using the SPACE TIGER experimental setup. We have irradiated c-C6H6:CH3CN ice mixtures with 2 keV electrons (Experiments 3-5) and Ly-alpha photons (Experiment 6), and compared the results with those obtained after 2 keV electron irradiation of c-C6H6 (Experiment 1) and CH3CN (Experiment 2) ices. In addition, we have also irradiated H2O:c-C6H6:CH3CN (Experiments 7 and 8), and CO:c-C6H6:CH3CN (Experiments 9 and 10) ice mixtures with both, 2 keV electrons (Experiments 7 and 9) and Ly-alpha photons (Experiments 8 and 10). The results of these experiments are presented in https://doi.org/10.48550/arXiv.2210.03827
description: This work was supported by a grant from the Simons Foundation (686302, KO) and an award from the Simons Foundation (321183FY19, KO).
DOI: 10.5281/zenodo.7196006
title: Formation of c-C6H5CN ice using the SPACE TIGER experimental setup

description: Benzonitrile (c-C6H5CN) has been recently detected in cold and dense regions of the interstellar medium (ISM), where it has been used as a signpost of a rich aromatic organic chemistry that might lead to the production of polycyclic aromatic hydrocarbons (PAHs). One possible origin of this benzonitrile is interstellar ice chemistry involving benzene (c-C6H6) and nitrile molecules (organic molecules containing the −C≡N group). We have addressed the plausibility of this c-C6H5CN formation pathway through laboratory experiments using the SPACE TIGER experimental setup. We have irradiated c-C6H6:CH3CN ice mixtures with 2 keV electrons (Experiments 3-5) and Ly-alpha photons (Experiment 6), and compared the results with those obtained after 2 keV electron irradiation of c-C6H6 (Experiment 1) and CH3CN (Experiment 2) ices. In addition, we have also irradiated H2O:c-C6H6:CH3CN (Experiments 7 and 8), and CO:c-C6H6:CH3CN (Experiments 9 and 10) ice mixtures with both, 2 keV electrons (Experiments 7 and 9) and Ly-alpha photons (Experiments 8 and 10). The results of these experiments are presented in https://doi.org/10.48550/arXiv.2210.03827
description: This work was supported by a grant from the Simons Foundation (686302, KO) and an award from the Simons Foundation (321183FY19, KO).
DOI: 10.15482/usda.adc/1528086
title: Data and code from: Cover crop and crop rotation effects on tissue and soil population dynamics of Macrophomina phaseolina and yield in no-till system

description: This dataset contains all code and data necessary to reproduce the analyses in the manuscript:
Mengistu, A., Read, Q. D. Cover crop and crop rotation effects on tissue and soil population dynamics of Macrophomina phaseolina and yield in no-till system. (Citation will be updated upon final acceptance of manuscript)
The .zip archive cropping-systems-0.0.zip contains data and code files.
Data

Quentin combined data with Yld 2011-2015.xlsx: MS Excel spreadsheet with all data averaged by experimental plot
Fred Allen combined data with Yld 2011-2015.xlsx: MS Excel spreadsheet with data at the individual plant level

Code

cropping_system_analysis_v2.1.Rmd: RMarkdown notebook with the majority of the data processing, analysis, and visualization code
marginal_means_byyear.Rmd: RMarkdown notebook with additional analyses producing estimated marginal means for individual years
equations.Rmd: RMarkdown notebook with formatted equations
formatted_figs.R: R script to produce figures formatted exactly as they appear in the manuscript

The Rproject file cropping-systems.Rproj is used to organize the RStudio project. Scripts and notebooks used in older versions of the analysis are found in the testing/ subdirectory.
DOI: 10.17045/sthlmuni.17032511
title: Village landscapes classified into social-ecological patches

description: The following .tif files are named with village name and year, and are raster files where we have classified each 100x100 meter cell of the village landscapes into SEPs through a visual, manual interpretation of aerial photographs and satellite images in ArcGIS 10.3 software (ESRI 2013). <br>These files are read and analyzed using the <i>R code for analysis of historic generation of ecosystem services in village landscapes </i>[https://doi.org/10.17045/sthlmuni.19144616] and <i>Tables for calculating change in generation of ecosystem services over time</i> [https://doi.org/10.17045/sthlmuni.17032724]<br>
DOI: 10.17045/sthlmuni.17032511.v1
title: Village landscapes classified into social-ecological patches

description: The following .tif files are named with village name and year, and are raster files where we have classified each 100x100 meter cell of the village landscapes into SEPs through a visual, manual interpretation of aerial photographs and satellite images in ArcGIS 10.3 software (ESRI 2013). <br>These files are read and analyzed using the <i>R code for analysis of historic generation of ecosystem services in village landscapes </i>[https://doi.org/10.17045/sthlmuni.19144616] and <i>Tables for calculating change in generation of ecosystem services over time</i> [https://doi.org/10.17045/sthlmuni.17032724]<br>
DOI: 10.6084/m9.figshare.16760737
title: Data for: Impact of a Scratch programming intervention on student engagement in a Nigerian polytechnic first-year class: verdict from the observers

description: This dataset contains ratings by five computer science educators of the level of engagement they observed during the weekly 2-hour constructionist Scratch programming class, involving first-year CS students in a North central Nigerian polytechnic. The observers employed a 20-item observation protocol.
DOI: 10.6084/m9.figshare.16760737.v1
title: CS1ScratchClassObservationRatings

description: This dataset contains ratings by five computer science educators of the level of engagement they observed during the weekly 2-hour constructionist Scratch programming class, involving first-year CS students in a North central Nigerian polytechnic. The observers employed a 20-item observation protocol.
DOI: 10.6084/m9.figshare.16760737.v2
title: Data for: Impact of a Scratch programming intervention on student engagement in a Nigerian polytechnic first-year class: verdict from the observers

description: This dataset contains ratings by five computer science educators of the level of engagement they observed during the weekly 2-hour constructionist Scratch programming class, involving first-year CS students in a North central Nigerian polytechnic. The observers employed a 20-item observation protocol.
DOI: 10.6084/m9.figshare.20444769.v1
title: original data_BAV paper.zip

description: Congenital bicuspid aortic valve (cBAV) develops calcification and stenotic obstruction early compared with degenerative tricuspid aortic valve (dTAV), which requires surgical intervention. Here we report a comparative study of patients with cBAV or dTAV to identify risk factors associated with the rapid development of calcified bicuspid valves.
DOI: 10.5281/zenodo.7199198
title: Karamaneas et al., 2022_PSET_DATASET

description: This dataset contains the data used and calculations performed for conducting the analysis, including the answers provided by regional stakeholders for the assessment of SDGs<em> </em>for the book chapter Karamaneas et al., 2022 published in Palgrave Handbook of Zero Carbon Energy Systems and Energy Transitions. Palgrave Studies in Energy Transitions.
DOI: 10.48420/21334872.v1
title: UV-Visible Spectroscopy for concentration calculation

description: Establish a calibration curve of Ti3C2 MXene for UV-Visible spectroscopy
DOI: 10.6084/m9.figshare.20444769.v2
title: original data_BAV paper.zip

description: Congenital bicuspid aortic valve (cBAV) develops calcification and stenotic obstruction early compared with degenerative tricuspid aortic valve (dTAV), which requires surgical intervention. Here we report a comparative study of patients with cBAV or dTAV to identify risk factors associated with the rapid development of calcified bicuspid valves.
DOI: 10.5281/zenodo.7199233
title: [IO Islamic 3496] طوطى نامه

description: <strong>Ṭûṭinâma</strong><strong>.</strong> <strong>This manuscript is now IO Islamic 743 in the India Office collections.</strong> <strong>[metadata:</strong> <strong>Hermann Ethé</strong><strong><em>, </em></strong><strong><em>Catalogue of Persian Manuscripts in the Library of the India Office,</em></strong> <strong>2 vols. (Oxford: India Office, 1903): volume 1,</strong> <strong>number 3496 here with notations and hyperlinks].</strong> 743 Ṭûṭinâma (طوطى نامه). The older and larger version of the famous ‘Tales of a Parrot,’ by Ḍiyâi Nakhshabî (or Ḍiyâ-aldîn Nakhshabî), containing fifty-two stories, and composed A.H. 730 (A.D. 1330); comp. Bodleian Cat., Nos. 444-448; Rieu ii. p. 753; W. Pertsch, Berlin Cat., p. 985, and Zeitschrift der D. M. G., vol. xxi. p. 505 sq.; J. Aumer, pp. 53 and 54; Cat. Codd. Or. Lugd. Bat. i. pp. 355 and 356; Göttinger Gelehrte Anzeigen, 1858, p. 529, etc. Translated into English by M. Gerrans, London, 1792. On the Turkish version see W. Pertsch, Berlin Turkish Cat., p. 439. Beginning:الحمد لله ربّ العالمين و العاقبة للمتّقين و الصلوات الخ. The usual beginning of most other copies (but with the omission of the first two words, مناجات بحضرت) appears here on fol. 2<sup>a</sup>: رازق النعاب فى عشّه الخ. The book concludes on fol. 242<sup>b</sup>. On fol. 243<sup>a</sup> the date is given, viz. 4th of Jumâdâ-alûlâ, in the first year of ‘Âlamgîr’s reign (=A.H. 1069, A.D. 1659, Jan. 28). On ff. 243<sup>b</sup>-245<sup>a</sup> a ḳaṣîdah by Shâh Ni’mat Walî-allâh (or more commonly Ni’mat-allâh Walî, who died A.H. 834=A.D. 1431, see Rieu ii. p. 634<sup>b</sup>) and some arithmetical tables are added. Many pages slightly injured. No. 3496, olim 8. J. 26, ff, 245, ll. 15-19; Nasta’lîḳ ; ff. 1-6, 33-36, 39-42, 181, 188-245 supplied by various other hands; size, 8<sup>7/8</sup> in. by 5 ½ in.
DOI: 10.5281/zenodo.7199232
title: [IO Islamic 3496] طوطى نامه

description: <strong>Ṭûṭinâma</strong><strong>.</strong> <strong>This manuscript is now IO Islamic 743 in the India Office collections.</strong> <strong>[metadata:</strong> <strong>Hermann Ethé</strong><strong><em>, </em></strong><strong><em>Catalogue of Persian Manuscripts in the Library of the India Office,</em></strong> <strong>2 vols. (Oxford: India Office, 1903): volume 1,</strong> <strong>number 3496 here with notations and hyperlinks].</strong> 743 Ṭûṭinâma (طوطى نامه). The older and larger version of the famous ‘Tales of a Parrot,’ by Ḍiyâi Nakhshabî (or Ḍiyâ-aldîn Nakhshabî), containing fifty-two stories, and composed A.H. 730 (A.D. 1330); comp. Bodleian Cat., Nos. 444-448; Rieu ii. p. 753; W. Pertsch, Berlin Cat., p. 985, and Zeitschrift der D. M. G., vol. xxi. p. 505 sq.; J. Aumer, pp. 53 and 54; Cat. Codd. Or. Lugd. Bat. i. pp. 355 and 356; Göttinger Gelehrte Anzeigen, 1858, p. 529, etc. Translated into English by M. Gerrans, London, 1792. On the Turkish version see W. Pertsch, Berlin Turkish Cat., p. 439. Beginning:الحمد لله ربّ العالمين و العاقبة للمتّقين و الصلوات الخ. The usual beginning of most other copies (but with the omission of the first two words, مناجات بحضرت) appears here on fol. 2<sup>a</sup>: رازق النعاب فى عشّه الخ. The book concludes on fol. 242<sup>b</sup>. On fol. 243<sup>a</sup> the date is given, viz. 4th of Jumâdâ-alûlâ, in the first year of ‘Âlamgîr’s reign (=A.H. 1069, A.D. 1659, Jan. 28). On ff. 243<sup>b</sup>-245<sup>a</sup> a ḳaṣîdah by Shâh Ni’mat Walî-allâh (or more commonly Ni’mat-allâh Walî, who died A.H. 834=A.D. 1431, see Rieu ii. p. 634<sup>b</sup>) and some arithmetical tables are added. Many pages slightly injured. No. 3496, olim 8. J. 26, ff, 245, ll. 15-19; Nasta’lîḳ ; ff. 1-6, 33-36, 39-42, 181, 188-245 supplied by various other hands; size, 8<sup>7/8</sup> in. by 5 ½ in.
DOI: 10.5281/zenodo.7199239
title: [IO Islamic 3367] طوطى نامه

description: <strong>Ṭûṭinâma</strong><strong>.</strong> <strong>This manuscript is now IO Islamic 744 in the India Office collections.</strong> <strong>[metadata:</strong> <strong>Hermann Ethé</strong><strong><em>, </em></strong><strong><em>Catalogue of Persian Manuscripts in the Library of the India Office,</em></strong> <strong>2 vols. (Oxford: India Office, 1903): volume 1,</strong> <strong>number 3367 here with notations and hyperlinks].</strong> 744 Another copy of the same. Beginning as usual: مناجات بحضرت رازق الخ. Dated the 23rd of Shawwâl, A.H. 1137 (A.D. 1725, July 5). Occasional corrections on the margin. On the last page there appears the fragment of a letter, written by Mirzâ ‘Alî Ḳulibeg, the son of ‘Alî-marwân-khân, to ‘Umdat-i-Umarâi Rafi’-alshân Nawwâb Muḥammad Amînkhân, (who is probably identical with Muḥammad Amînkhân, son of Mîr Jumlah, who died A.H. 1093=A.D. 1682). No. 3367, olim 8. J. 28, ff. 263, ll. 15; very unequal Nasta’lîḳ; size, 8<sup>1/8</sup> in. by 4<sup>5/8</sup> in.
DOI: 10.5281/zenodo.7199238
title: [IO Islamic 3367] طوطى نامه

description: <strong>Ṭûṭinâma</strong><strong>.</strong> <strong>This manuscript is now IO Islamic 744 in the India Office collections.</strong> <strong>[metadata:</strong> <strong>Hermann Ethé</strong><strong><em>, </em></strong><strong><em>Catalogue of Persian Manuscripts in the Library of the India Office,</em></strong> <strong>2 vols. (Oxford: India Office, 1903): volume 1,</strong> <strong>number 3367 here with notations and hyperlinks].</strong> 744 Another copy of the same. Beginning as usual: مناجات بحضرت رازق الخ. Dated the 23rd of Shawwâl, A.H. 1137 (A.D. 1725, July 5). Occasional corrections on the margin. On the last page there appears the fragment of a letter, written by Mirzâ ‘Alî Ḳulibeg, the son of ‘Alî-marwân-khân, to ‘Umdat-i-Umarâi Rafi’-alshân Nawwâb Muḥammad Amînkhân, (who is probably identical with Muḥammad Amînkhân, son of Mîr Jumlah, who died A.H. 1093=A.D. 1682). No. 3367, olim 8. J. 28, ff. 263, ll. 15; very unequal Nasta’lîḳ; size, 8<sup>1/8</sup> in. by 4<sup>5/8</sup> in.
DOI: 10.5281/zenodo.7199248
title: [IO Islamic 1587] طوطى نامه

description: <strong>Ṭûṭinâma</strong><strong>.</strong> <strong>This manuscript is now IO Islamic 745 in the India Office collections.</strong> <strong>[metadata:</strong> <strong>Hermann Ethé</strong><strong><em>, </em></strong><strong><em>Catalogue of Persian Manuscripts in the Library of the India Office,</em></strong> <strong>2 vols. (Oxford: India Office, 1903): volume 1,</strong> <strong>number 1587 here with notations and hyperlinks].</strong> 745 The same. Beginning as in No. 3496 (743 above):الحمد لله ربّ العالمين و العاقبة للمتّقين و الصلوات على نبىّ محمّد و آله اجمعين ، ميگويد قائل اين رسائل الخ. This copy, which is dated the 18th of Sha’bân, in the twenty-sixth year of Shâh ‘Âlam’s reign (=A.H. 1198, A.D. 1784, July 7), contains only fifty-one stories (the second and third not being separated from one another). No. 1587, ff. 217, ll. 15; Nasta’lîḳ; size, 9¼ in. By 5¾ in.
DOI: 10.5281/zenodo.7199247
title: [IO Islamic 1587] طوطى نامه

description: <strong>Ṭûṭinâma</strong><strong>.</strong> <strong>This manuscript is now IO Islamic 745 in the India Office collections.</strong> <strong>[metadata:</strong> <strong>Hermann Ethé</strong><strong><em>, </em></strong><strong><em>Catalogue of Persian Manuscripts in the Library of the India Office,</em></strong> <strong>2 vols. (Oxford: India Office, 1903): volume 1,</strong> <strong>number 1587 here with notations and hyperlinks].</strong> 745 The same. Beginning as in No. 3496 (743 above):الحمد لله ربّ العالمين و العاقبة للمتّقين و الصلوات على نبىّ محمّد و آله اجمعين ، ميگويد قائل اين رسائل الخ. This copy, which is dated the 18th of Sha’bân, in the twenty-sixth year of Shâh ‘Âlam’s reign (=A.H. 1198, A.D. 1784, July 7), contains only fifty-one stories (the second and third not being separated from one another). No. 1587, ff. 217, ll. 15; Nasta’lîḳ; size, 9¼ in. By 5¾ in.
DOI: 10.5281/zenodo.7038984
title: FiPy Implementation of BM 8a

description: FiPy implementation of benchmark 8a
DOI: 10.5281/zenodo.7083462
title: FiPy Implementation of BM 8a

description: FiPy implementation of benchmark 8a
DOI: 10.5281/zenodo.7199074
title: FiPy Implementation of BM 8a

description: FiPy implementation of benchmark 8a
DOI: 10.5281/zenodo.7199155
title: FiPy Implementation of BM 8a

description: FiPy implementation of benchmark 8a
DOI: 10.5281/zenodo.7199269
title: Amazon Spot Service Price History (2018-2022.05)

description: The price history of Amazon's spot services. Amazon only allows to download the most recent 2-month or 3-month data, so the data are saved in separated files with overlaps.
DOI: 10.5281/zenodo.7199268
title: Amazon Spot Service Price History (2018-2022.05)

description: The price history of Amazon's spot services. Amazon only allows to download the most recent 2-month or 3-month data, so the data are saved in separated files with overlaps.
DOI: 10.6084/m9.figshare.21218372.v3
title: Spatial Cooperative Simulation of Land Use-Population-Economy in the Guangdong-Hong Kong-Macao Greater Bay Area, China

description: driving_factor:Store the driver factor needed for the experiment development_probability:A file containing the development probabilities of the different elements generated by the model original_data:Storage of original element files (2010, 2020) simulated_data:File of elements for storing simulations (2020) predicted_data:Storage of forecast elements document (2030)
DOI: 10.15124/8f3393d5-9eeb-45e2-bbc7-b854334dbb12
title: Harnessing polarisation transfer to indazole and imidazole through signal amplification by reversible exchange to improve their NMR detectabilityQ1

description: The signal amplification by reversible exchange (SABRE) approach has been used to hyperpolarise the substrates indazole and imidazole in the presence of the co-ligand acetonitrile through the action of the precataysts [IrCl(COD)(IMes)] and [IrCl(COD) (SIMes)]. 2H-labelled forms of these catalysts were also examined.
DOI: 10.15124/5e44a9c2-c968-42c9-b8f0-885a552bafa0
title: Achieving High Levels of NMR-Hyperpolarization in Aqueous Media With Minimal Catalyst Contamination via SABRE

description: NMR and MRI data
DOI: 10.15124/4a012088-7b46-4dcb-96eb-a1a78e8ffa96
title: Illustration of a simple route to generate strong carbon-13 NMR signals that are detectable for several minutes

description: NMR data
DOI: 10.15124/6e34c91a-3e04-4cb8-b0e2-efe9b440ce95
title: First-principles prediction of the morphology of L10 FePt nanoparticles supported on Mg(Ti)O for heat-assisted magnetic recording applications

description: Structures, input and output files for calculations on L10 FePt nanoparticles supported on Mg(Ti)O
DOI: 10.5517/ccdc.csd.cc1yz615
title: CCDC 1816477: Experimental Crystal Structure Determination

description: Related Article: Rui-Lian Lin, Yong-Ping Dong, Min Tang, Zhichang Liu, Zhu Tao, Jing-Xin Liu|2020|Inorg.Chem.|59|3850|doi:10.1021/acs.inorgchem.9b03499
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/ccdc.csd.cc1yz626
title: CCDC 1816478: Experimental Crystal Structure Determination

description: Related Article: Rui-Lian Lin, Yong-Ping Dong, Min Tang, Zhichang Liu, Zhu Tao, Jing-Xin Liu|2020|Inorg.Chem.|59|3850|doi:10.1021/acs.inorgchem.9b03499
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.