cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccqrrnv
title: CCDC 678238: Experimental Crystal Structure Determination

description: Related Article: Michael P Bubnov , Irina A Teplova, Nikolay O Druzhkov, Georgy K Fukin, Anna V Cherkasova, Vladimir K Cherkasov|2015|J.Chem.Sci.(Bangalore,India)|127|527|doi:10.1007/s12039-015-0805-2
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: 10.13140/rg.2.2.17761.12641
title: Catalog of Regulations applicable to Renewable and Distributed Energy Resource Development at Drinking Water and Wastewater Utilities
DOI: 10.13140/rg.2.2.21845.65762
title: Adueñarse de la propia vida es el punto de partida de comprometerse con su mejoramiento
DOI: 10.3535/qdq-tbm-cht
title: Dryopteris caucasica (A. Braun) Fraser-Jenk. & Corley

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/r7j-5d7-y1f
title: Tragopogon dubius Scop.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccqrrmt
title: CCDC 678237: Experimental Crystal Structure Determination

description: Related Article: Michael P Bubnov , Irina A Teplova, Nikolay O Druzhkov, Georgy K Fukin, Anna V Cherkasova, Vladimir K Cherkasov|2015|J.Chem.Sci.(Bangalore,India)|127|527|doi:10.1007/s12039-015-0805-2
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/ccqrsw3
title: CCDC 678276: Experimental Crystal Structure Determination

description: Related Article: Hai-Xia Zhao,Jing-Xin Liu,La-Sheng Long,A.A.Bokov,Zuo-Guang Ye,Rong-Bin Huang,Lan-Sun Zheng|2012|J.Phys.Chem.C|116|14199|doi:10.1021/jp3018293
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: 10.3535/3f3-npa-97y
title: Cissus quadrangularis L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/h22-61r-jfy
title: Escallonia sellowiana DC.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/tpa-dqw-jzv
title: Poa alpina L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccqryds
title: CCDC 678416: Experimental Crystal Structure Determination

description: Related Article: R. Prabhakaran, P. Kalaivani, R. Huang, P. Poornima, V. Vijaya Padma, F. Dallemer, K. Natarajan|2013|J.Biol.Inorg.Chem.(JBIC)|18|233|doi:10.1007/s00775-012-0969-x
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/ccqryft
title: CCDC 678417: Experimental Crystal Structure Determination

description: Related Article: R. Prabhakaran, P. Kalaivani, R. Huang, P. Poornima, V. Vijaya Padma, F. Dallemer, K. Natarajan|2013|J.Biol.Inorg.Chem.(JBIC)|18|233|doi:10.1007/s00775-012-0969-x
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: 10.3535/3hf-91m-rxg
title: Solanum humile Lam.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/8dh-xh9-3n4
title: Astragalus cicer L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/l1g-mkw-r6x
title: Carex melanostachya M. Bieb. ex Willd.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccqrycr
title: CCDC 678415: Experimental Crystal Structure Determination

description: Related Article: R. Prabhakaran, P. Kalaivani, R. Huang, P. Poornima, V. Vijaya Padma, F. Dallemer, K. Natarajan|2013|J.Biol.Inorg.Chem.(JBIC)|18|233|doi:10.1007/s00775-012-0969-x
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: 10.3535/4p6-a29-jml
title: Rhamnus pallasii subsp. pallasii Fisch. & C. A. Mey.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/ayc-adm-hh8
title: Lithraea molleoides (Vell.) Engl.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/j00-ymp-fyt
title: Hieracium bauhini Schult.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccdc.csd.ccqs1l3
title: CCDC 678515: Experimental Crystal Structure Determination

description: Related Article: Igor V. Tkachenko,  Igor N. Tarabara,  Irina V. Omelchenko,  Vitalii A. Palchykov|2018|J.Heterocycl.Chem.|55|2381|doi:10.1002/jhet.3302
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/ccqjv24
title: CCDC 671586: Experimental Crystal Structure Determination

description: Related Article: S.M.S.V.Wardell, M.V.N.de Souza, J.L.Wardell, J.N.Low, C.Glidewell|2007|Acta Crystallogr.,Sect.B:Struct.Sci.|63|879|doi:10.1107/S0108768107036270
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: 10.3535/2hc-y28-qm5
title: Astragalus leptynticus Maassoumi

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/l89-7h6-pjp
title: Myriophyllum spicatum L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/pfz-dkv-djc
title: Veronica teucrium L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccq2q2k
title: CCDC 658008: Experimental Crystal Structure Determination

description: Related Article: M.Pourayoubi, S.Ghadimi, A.A.E.Valmoozi|2007|Acta Crystallogr.,Sect.E:Struct.Rep.Online|63|o4631|doi:10.1107/S1600536807055328
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/ccql1s3
title: CCDC 672755: Experimental Crystal Structure Determination

description: Related Article: D.J.Price, M.Martinez-Belmonte|2007|Acta Crystallogr.,Sect.E:Struct.Rep.Online|63|m3158|doi:10.1107/S1600536807060837
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: 10.3535/1wa-cgv-xdh
title: Verbascum propontideum Murb.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/hvs-v7y-9pc
title: Rumex bucephalophorus subsp. aegaeus Rech. f.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/n4g-2mr-fbw
title: Senna organensis (Glaz. ex Harms) H. S. Irwin & Barneby

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccqcc8p
title: CCDC 666322: Experimental Crystal Structure Determination

description: Related Article: S.Yamada, N.Uematsu, K.Yamashita|2007|J.Am.Chem.Soc.|129|12100|doi:10.1021/ja074874y
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/ccqmx4c
title: CCDC 674533: Experimental Crystal Structure Determination

description: Related Article: G.J.Reiss, S.Bajorat|2008|Acta Crystallogr.,Sect.E:Struct.Rep.Online|64|o223|doi:10.1107/S1600536807064793
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: 10.3535/5ry-vls-801
title: Polygonum aviculare subsp. depressum (Meisn.) Arcang.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/wk6-kzy-f56
title: Astragalus strictispinus Boiss.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/yp8-tyj-ztf
title: Euphorbia nicaeënsis var. lasiocarpa (Boiss.) Radcl.-Sm. & Govaerts

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccqjv46
title: CCDC 671588: Experimental Crystal Structure Determination

description: Related Article: S.M.S.V.Wardell, M.V.N.de Souza, J.L.Wardell, J.N.Low, C.Glidewell|2007|Acta Crystallogr.,Sect.B:Struct.Sci.|63|879|doi:10.1107/S0108768107036270
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/ccqjv8b
title: CCDC 671592: Experimental Crystal Structure Determination

description: Related Article: S.M.S.V.Wardell, M.V.N.de Souza, J.L.Wardell, J.N.Low, C.Glidewell|2007|Acta Crystallogr.,Sect.B:Struct.Sci.|63|879|doi:10.1107/S0108768107036270
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: 10.3535/77t-xjv-fp5
title: Achillea filipendulina Lam.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/7f9-qax-2cl
title: Fibigia clypeata (L.) Medik.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/f5f-tl7-vlp
title: Tripleurospermum Sch. Bip.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/cc7r0ml
title: CCDC 230659: Experimental Crystal Structure Determination

description: Related Article: A.Grandeury, L.Renou, F.Dufour, S.Petit, G.Gouhier, G.Coquerel|2004|J.Thermal Analysis and Calorimetry|77|377|doi:10.1023/B:JTAN.0000038979.32555.58
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/ccpdvws
title: CCDC 637976: Experimental Crystal Structure Determination

description: Related Article: J.F.Van der Maelen, E.Gutierrez-Puebla, A.Monge, S.Garcia-Granda, I.Resa, E.Carmona, M.T.Fernandez-Diaz, G.J.McIntyre, P.Pattison, H.-P.Weber|2007|Acta Crystallogr.,Sect.B:Struct.Sci.|63|862|doi:10.1107/S0108768107045880
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: 10.13140/rg.2.2.12832.81920
title: Criticar y Valorar
DOI: 10.3535/9xj-1zp-p4n
title: Potamogeton filiformis Pers.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/p2a-wxx-rgr
title: Leonotis (Pers.) R. Br.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/yw6-28t-6tp
title: Senecio carniolicus Willd.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccpd6cm
title: CCDC 637340: Experimental Crystal Structure Determination

description: Related Article: J.F.Van der Maelen, E.Gutierrez-Puebla, A.Monge, S.Garcia-Granda, I.Resa, E.Carmona, M.T.Fernandez-Diaz, G.J.McIntyre, P.Pattison, H.-P.Weber|2007|Acta Crystallogr.,Sect.B:Struct.Sci.|63|862|doi:10.1107/S0108768107045880
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/ccqcprh
title: CCDC 666647: Experimental Crystal Structure Determination

description: Related Article: Guo-Dong Yang, Jing-Cao Dai, Yun-Xia Lian, Wen-Shi Wu, Jian-Ming Lin, Sheng-Min Hu, Tian-Lu Sheng, Zhi-Yong Fu, Xin-Tao Wu|2007|Inorg.Chem.|46|7910|doi:10.1021/ic700882n
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: 10.15468/dl.nawm79
title: Occurrence Download

description: A dataset containing 6 species occurrences available in GBIF matching the query:
{
 "and" : [
 "GadmGid is USA.28_1",
 "OccurrenceStatus is Present",
 "TaxonKey is Vulpes velox"
 ]
}

 The dataset includes 6 records from 2 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0030886-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.3535/cqc-5l2-x69
title: Adiantum capillus-veneris L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/h5n-4tm-058
title: Diphasiastrum alpinum (L.) Holub

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/t7g-cdk-ae1
title: Alyssoides utriculata (L.) Medik.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnpmrp
title: CCDC 616613: Experimental Crystal Structure Determination

description: Related Article: Shu-Ping Yang, Li-Jun Han, Da-Qi Wang, Hai-Tao Xia|2007|Acta Crystallogr.,Sect.E:Struct.Rep.Online|63|o4643|doi:10.1107/S1600536807056085
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/ccqcpsj
title: CCDC 666648: Experimental Crystal Structure Determination

description: Related Article: Guo-Dong Yang, Jing-Cao Dai, Yun-Xia Lian, Wen-Shi Wu, Jian-Ming Lin, Sheng-Min Hu, Tian-Lu Sheng, Zhi-Yong Fu, Xin-Tao Wu|2007|Inorg.Chem.|46|7910|doi:10.1021/ic700882n
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: 10.3535/d53-zdm-rk2
title: Ophioglossum vulgatum L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/sq0-jhj-zkq
title: Agrostis alpina Scop.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/z8k-5d1-vrl
title: Saxifraga glabella Bertol.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccqn10d
title: CCDC 674653: Experimental Crystal Structure Determination

description: Related Article: Si-shun Kang, Hai-su Zeng, Hai-lin Li, Hai-bo Wang, Pin-liang Wang|2007|Acta Crystallogr.,Sect.E:Struct.Rep.Online|63|o4698|doi:10.1107/S1600536807057273
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: 10.3535/1vz-9kw-xpb
title: Penaeaceae Sweet ex Guill.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/g50-rk1-k0z
title: Asperula woloszczakii Korica

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/xbh-zrr-bh6
title: Artemisia maritima subsp. salina (Willd.) Nyman

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccqjv68
title: CCDC 671590: Experimental Crystal Structure Determination

description: Related Article: S.M.S.V.Wardell, M.V.N.de Souza, J.L.Wardell, J.N.Low, C.Glidewell|2007|Acta Crystallogr.,Sect.B:Struct.Sci.|63|879|doi:10.1107/S0108768107036270
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/ccqjwdh
title: CCDC 671627: Experimental Crystal Structure Determination

description: Related Article: C.Buchsbaum, M.U.Schmidt|2007|Acta Crystallogr.,Sect.B:Struct.Sci.|63|926|doi:10.1107/S0108768107050823
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: 10.3535/el9-qac-16v
title: Bornmuellera baldaccii subsp. rechingeri Greuter

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/gs4-75a-4dc
title: Leandra australis (Cham.) Cogn.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/tsb-x8f-nf5
title: Cyphostemma natalitium (Szyszył.) J. J. M. van der Merwe

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccqjv02
title: CCDC 671584: Experimental Crystal Structure Determination

description: Related Article: S.M.S.V.Wardell, M.V.N.de Souza, J.L.Wardell, J.N.Low, C.Glidewell|2007|Acta Crystallogr.,Sect.B:Struct.Sci.|63|879|doi:10.1107/S0108768107036270
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/ccql23g
title: CCDC 672765: Experimental Crystal Structure Determination

description: Related Article: R.Krupkova, J.Fabry, I.Cisarova, P.Vanek|2007|Acta Crystallogr.,Sect.E:Struct.Rep.Online|63|m3177|doi:10.1107/S1600536807060497
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: 10.3535/8nc-t09-gpv
title: Saponaria viscosa C. A. Mey.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/r98-lwb-ygr
title: Pristimera andina Miers

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/sys-91a-ajx
title: Taraxacum Weber

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccql1t4
title: CCDC 672756: Experimental Crystal Structure Determination

description: Related Article: G.B.Andreev, N.A.Budantseva, I.G.Tananaev, B.F.Myasoedov|2007|Acta Crystallogr.,Sect.E:Struct.Rep.Online|63|m3159|doi:10.1107/S1600536807061016
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.