cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccp6f7j
title: CCDC 631787: Experimental Crystal Structure Determination

description: Related Article: R.Naito, Y.Yonetoku, Y.Okamoto, A.Toyoshima, K.Ikeda, M.Takeuchi|2005|J.Med.Chem.|48|6597|doi:10.1021/jm050099q
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/ge8-05p-fpk
title: Panphalea commersonii Cass.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/hsq-z0d-dj3
title: Aegilops mutica Boiss.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/wp3-xwq-1vx
title: Schinus weinmanniifolius Engl.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp6f8k
title: CCDC 631788: Experimental Crystal Structure Determination

description: Related Article: R.Naito, Y.Yonetoku, Y.Okamoto, A.Toyoshima, K.Ikeda, M.Takeuchi|2005|J.Med.Chem.|48|6597|doi:10.1021/jm050099q
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/ccp6f9l
title: CCDC 631789: Experimental Crystal Structure Determination

description: Related Article: R.Naito, Y.Yonetoku, Y.Okamoto, A.Toyoshima, K.Ikeda, M.Takeuchi|2005|J.Med.Chem.|48|6597|doi:10.1021/jm050099q
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/j72-vte-eer
title: Escallonia bifida Link & Otto

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/rf8-zgt-8tj
title: Cestrum parqui L'Hér.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp3ht2
title: CCDC 628984: Experimental Crystal Structure Determination

description: Related Article: Ming-An Wang, Guang-Zhong Tu, Zu-Chao Ma, Ning Zhang, Dao-Quan Wang|2006|Chin.J.Chem.|24|205|doi:10.1002/cjoc.200690039
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/ccp6fbm
title: CCDC 631790: Experimental Crystal Structure Determination

description: Related Article: R.Naito, Y.Yonetoku, Y.Okamoto, A.Toyoshima, K.Ikeda, M.Takeuchi|2005|J.Med.Chem.|48|6597|doi:10.1021/jm050099q
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.2.2.13610.31687
title: fincrawling Microchirus ocellatus
DOI: 10.13140/rg.2.2.32694.40008
title: Phylogenetic analysis of PPRV isolates on the basis of Nucleocapsid gene sequence
DOI: 10.3535/65d-yqn-n16
title: Hypericum trichocaulon Boiss. & Heldr.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/m45-5e2-ty9
title: Tripodanthus eugenioides (Kunth) Tiegh.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/zj3-eme-ar1
title: Prestonia coalita (Vell.) Woodson

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp6fgr
title: CCDC 631794: Experimental Crystal Structure Determination

description: Related Article: Ming-An Wang, Guang-Zhong Tu, Zu-Chao Ma, Ning Zhang, Dao-Quan Wang|2006|Chin.J.Chem.|24|205|doi:10.1002/cjoc.200690039
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: 10.3535/1ys-m5c-y45
title: Calamagrostis epigejos (L.) Roth

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/7lq-60p-4ll
title: Streptocarpus glandulosissimus Engl.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/n5h-1p7-fst
title: Rapanea lorentziana Mez

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/cc9h4b7
title: CCDC 282668: Experimental Crystal Structure Determination

description: Related Article: Sun-Liang Cui, Xu-Feng Lin, Yan-Guang Wang|2006|Eur.J.Org.Chem.|2006|5174|doi:10.1002/ejoc.200600560
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/ccng5js
title: CCDC 609445: Experimental Crystal Structure Determination

description: Related Article: H.Nuss, M.Jansen|2006|Z.Naturforsch.,B:Chem.Sci.|61|1205|doi:10.1515/znb-2006-1003
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.2.2.29863.24480
title: IMPROVEMENT OF THE EFFECTIVENESS OF FUNCTIONING OF THE OCCUPATIONAL HEALTH AND SAFETY MANAGEMENT SYSTEM USING STATISTICAL ANALYSIS (ПІДВИЩЕННЯ ЕФЕКТИВНОСТІ ФУНКЦІОНУВАННЯ СИСТЕМИ УПРАВЛІННЯ ОХОРОНОЮ ПРАЦІ МЕТОДАМИ СТАТИСТИЧНОГО АНАЛІЗУ)
DOI: 10.3535/6qe-nrm-rdv
title: Cerastium luridum subsp. mediterraneum Lonsing

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/dsa-212-23w
title: Urera baccifera (L.) Gaudich.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp79y4
title: CCDC 632646: Experimental Crystal Structure Determination

description: Related Article: M.Surin, P.Samori, A.Jouaiti, N.Kyritsakas, M.W.Hosseini|2007|Angew.Chem.,Int.Ed.|46|245|doi:10.1002/anie.200603558
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: 10.3535/20k-jwa-qff
title: Schinus weinmanniifolius Engl.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/sz6-gnk-75g
title: Linaria fastigiata Chav.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/wzp-amn-7qg
title: Escallonia montevidensis (Cham. & Schltdl.) DC.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp7fz9
title: CCDC 632771: Experimental Crystal Structure Determination

description: Related Article: P.Martinetto, P.Terech, A.Grand, R.Ramasseul, E.Dooryhee, M.Anne|2006|J.Phys.Chem.B|110|15127|doi:10.1021/jp0612681
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/ccp7g0c
title: CCDC 632772: Experimental Crystal Structure Determination

description: Related Article: E.Sakuda, A.Funahashi, N.Kitamura|2006|Inorg.Chem.|45|10670|doi:10.1021/ic061435b
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.2.2.24777.65125
title: Video S7 in paper of 10.1002admi.201700684
DOI: 10.3535/2mk-8xh-q81
title: Linaria kurdica subsp. kurdica Boiss. & Hohen.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/8xa-y3r-1am
title: Blumenbachia latifolia Cambess.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/rv8-7zg-l2q
title: Escallonia vaccinioides A. St.-Hil.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp7gr3
title: CCDC 632795: Experimental Crystal Structure Determination

description: Related Article: Ching-Wen Chiu, F.P.Gabbai|2006|J.Am.Chem.Soc.|128|14248|doi:10.1021/ja0658463
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/ccp7gs4
title: CCDC 632796: Experimental Crystal Structure Determination

description: Related Article: Ching-Wen Chiu, F.P.Gabbai|2006|J.Am.Chem.Soc.|128|14248|doi:10.1021/ja0658463
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: 10.3535/1es-6ks-yc3
title: Cardiospermum grandiflorum Sw.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/h9t-t0y-pyz
title: Salix caesia Vill.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/kxd-lsr-7z5
title: Psychrogeton olgae (Regel & Schmalh.) Novopokr. ex Nevski

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5281/zenodo.8334385
title: An ECM scaffold combined with a compliant 3D printed spring-shaped reinforcement for cartilage engineering applications

description: test
DOI: 10.5517/ccp7gzb
title: CCDC 632802: Experimental Crystal Structure Determination

description: Related Article: J.S.M.Samec, A.H.Ell, J.B.Aberg, T.Privalov, L.Eriksson, J.-E.Backvall|2006|J.Am.Chem.Soc.|128|14293|doi:10.1021/ja061494o
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/ccp7h1f
title: CCDC 632804: Experimental Crystal Structure Determination

description: Related Article: Mi Hee Lim, B.A.Wong, W.H.Pitcock Junior, D.Mokshagundam, Mu-Hyun Baik, S.J.Lippard|2006|J.Am.Chem.Soc.|128|14364|doi:10.1021/ja064955e
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/ejr-431-2m4
title: Linaria armeniaca Chav.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/kwv-73p-8fq
title: Sedum laconicum subsp. insulare (Rech. f.) Greuter & Rech. f.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/ymq-mdt-g93
title: Scoparia dulcis L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp7h2g
title: CCDC 632805: Experimental Crystal Structure Determination

description: Related Article: Mi Hee Lim, B.A.Wong, W.H.Pitcock Junior, D.Mokshagundam, Mu-Hyun Baik, S.J.Lippard|2006|J.Am.Chem.Soc.|128|14364|doi:10.1021/ja064955e
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/ccp7h3h
title: CCDC 632806: Experimental Crystal Structure Determination

description: Related Article: V.F.Kuznetsov, K.Abdur-Rashid, A.J.Lough, D.G.Gusev|2006|J.Am.Chem.Soc.|128|14388|doi:10.1021/ja065249g
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.2.2.23434.16328
title: Physical + Chemical + Biological characteristics of an industrial wastewater taken from the influent, effluent and within an oxidation ditch serving Starch and Dextrin Factory (at Hashimiya/ Babylon/Iraq).
DOI: 10.3535/1fp-ebc-yvz
title: Prunus myrtifolia (L.) Urb.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/kly-he8-lmx
title: Baccharis L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5281/zenodo.8334384
title: An ECM scaffold combined with a compliant 3D printed spring-shaped reinforcement for cartilage engineering applications

description: test
DOI: 10.5517/ccp7h4j
title: CCDC 632807: Experimental Crystal Structure Determination

description: Related Article: V.F.Kuznetsov, K.Abdur-Rashid, A.J.Lough, D.G.Gusev|2006|J.Am.Chem.Soc.|128|14388|doi:10.1021/ja065249g
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/ccp7h5k
title: CCDC 632808: Experimental Crystal Structure Determination

description: Related Article: V.F.Kuznetsov, K.Abdur-Rashid, A.J.Lough, D.G.Gusev|2006|J.Am.Chem.Soc.|128|14388|doi:10.1021/ja065249g
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/g5a-6qw-7l5
title: Bidens tripartitus L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/jwy-yj5-07h
title: Justicia comata Vell. ex Nees

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/rdf-e9s-tte
title: Urochloa reptans (L.) Stapf

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp7h6l
title: CCDC 632809: Experimental Crystal Structure Determination

description: Related Article: T.Kitagawa, A.Dey, P.Lugo-Mas, J.B.Benedict, W.Kaminsky, E.Solomon, J.A.Kovacs|2006|J.Am.Chem.Soc.|128|14448|doi:10.1021/ja064870d
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.2.2.32871.34729
title: Blue fluorescence emissions from Nepenthes
DOI: 10.3535/3yf-r9r-c3d
title: Citronella paniculata (Mart.) R. A. Howard

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/4h5-z9w-31y
title: Alternanthera paronychioides A. St.-Hil.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/m47-khd-nmq
title: Tragopogon balcanicus Velen.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp7hm0
title: CCDC 632822: Experimental Crystal Structure Determination

description: Related Article: D.Yamazaki, T.Nishinaga, N.Tanino, K.Komatsu|2006|J.Am.Chem.Soc.|128|14470|doi:10.1021/ja065995l
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/ccp7hn1
title: CCDC 632823: Experimental Crystal Structure Determination

description: Related Article: D.Yamazaki, T.Nishinaga, N.Tanino, K.Komatsu|2006|J.Am.Chem.Soc.|128|14470|doi:10.1021/ja065995l
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: 10.3535/11q-0ag-pyx
title: Polygala lancifolia A. St.-Hil. & Moq.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/ga8-3bx-6lc
title: Escallonia montevidensis (Cham. & Schltdl.) DC.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/w1c-hsx-rtz
title: Ageratum conyzoides L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/cc9xtvv
title: CCDC 295828: Experimental Crystal Structure Determination

description: Related Article: Chuan-Feng Wang, Zhen-Yu Zhu, Xi-Geng Zhou, Lin-Hong Weng, Quan-Sheng Shen, Yan-Gang Yan|2006|Inorg.Chem.Commun.|9|1326|doi:10.1016/j.inoche.2006.08.018
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/ccp7hp2
title: CCDC 632824: Experimental Crystal Structure Determination

description: Related Article: D.Yamazaki, T.Nishinaga, N.Tanino, K.Komatsu|2006|J.Am.Chem.Soc.|128|14470|doi:10.1021/ja065995l
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/h94-2m0-kex
title: Byttneria australis A. St.-Hil.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/t1z-4r2-h6c
title: Lithraea brasiliensis Marchand

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnjz6b
title: CCDC 612132: Experimental Crystal Structure Determination

description: Related Article: Dao Zhang, Guo-Xin Jin|2006|Inorg.Chem.Commun.|9|1322|doi:10.1016/j.inoche.2006.08.017
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/ccnkk80
title: CCDC 612692: Experimental Crystal Structure Determination

description: Related Article: M.Westerhausen, G.Sapelza, P.Mayer|2006|Inorg.Chem.Commun.|9|1319|doi:10.1016/j.inoche.2006.08.014
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.2.2.16146.56007
title: Presentation 'A.Egypt.J.Aquat.Biol.&Fish.2011'
DOI: 10.3535/fsr-nzy-wdf
title: Calamagrostis epigejos (L.) Roth

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/hcc-1fz-9hr
title: Baccharis elaegnoides Steud. ex Baker

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/z6x-kf3-1hz
title: Kickxia elatine subsp. crinita (Mabille) Greuter

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/cc9zdn9
title: CCDC 297341: Experimental Crystal Structure Determination

description: Related Article: A.A.Soudi, A.Morsali, S.Moazzenchi|2006|Inorg.Chem.Commun.|9|1259|doi:10.1016/j.inoche.2006.08.003
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.