cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccn6cls
title: CCDC 601945: Experimental Crystal Structure Determination

description: Related Article: Wing-Kit Lo, Wai-Kwok Wong, Wai-Yeung Wong, Jianping Guo, Kai-Tai Yeung, Yuen-Kit Cheng, Xiaoping Yang, R.A.Jones|2006|Inorg.Chem.|45|9315|doi:10.1021/ic0610177
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/ccp4gv3
title: CCDC 629915: Experimental Crystal Structure Determination

description: Related Article: Y.-F.Liu, H.-T.Xia, S.-P.Yang, D.-Q.Wang|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5908|doi:10.1107/S1600536806049580
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.2.2.18903.16800
title: Toolbox for ordinal-patterns-based analysis (beta-version)
DOI: 10.3535/klw-7c7-spn
title: Lepidium graminifolium L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/kwb-5xh-wlt
title: Neotinea Rchb. f.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/lsh-mvj-3qa
title: Orchis Tourn. ex L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccn6cmt
title: CCDC 601946: Experimental Crystal Structure Determination

description: Related Article: Wing-Kit Lo, Wai-Kwok Wong, Wai-Yeung Wong, Jianping Guo, Kai-Tai Yeung, Yuen-Kit Cheng, Xiaoping Yang, R.A.Jones|2006|Inorg.Chem.|45|9315|doi:10.1021/ic0610177
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: 10.3535/0e5-x60-m6p
title: Timonius affinis A. Gray

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/de0-wn3-mnh
title: Artemisia L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/rh3-z9k-3v2
title: Narcissus bulbocodium L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccn6cnv
title: CCDC 601947: Experimental Crystal Structure Determination

description: Related Article: Wing-Kit Lo, Wai-Kwok Wong, Wai-Yeung Wong, Jianping Guo, Kai-Tai Yeung, Yuen-Kit Cheng, Xiaoping Yang, R.A.Jones|2006|Inorg.Chem.|45|9315|doi:10.1021/ic0610177
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/ccn6cpw
title: CCDC 601948: Experimental Crystal Structure Determination

description: Related Article: Wing-Kit Lo, Wai-Kwok Wong, Wai-Yeung Wong, Jianping Guo, Kai-Tai Yeung, Yuen-Kit Cheng, Xiaoping Yang, R.A.Jones|2006|Inorg.Chem.|45|9315|doi:10.1021/ic0610177
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.2.2.24041.19041
title: NUMERICAL SOLUTIONS OF HEAT AND MASS TRANSFER EFFECTS OF AN UNSTEADY MHD FREE CONVECTIVE FLOW PAST AN INFINITE VERTICAL PLATE WITH CONSTANT SUCTION
DOI: 10.3535/1ys-3cy-bh1
title: Hieracium bifidum Kit. ex Hornem.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/4dq-kg3-aj1
title: Elaeocarpus L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccn6cqx
title: CCDC 601949: Experimental Crystal Structure Determination

description: Related Article: Wing-Kit Lo, Wai-Kwok Wong, Wai-Yeung Wong, Jianping Guo, Kai-Tai Yeung, Yuen-Kit Cheng, Xiaoping Yang, R.A.Jones|2006|Inorg.Chem.|45|9315|doi:10.1021/ic0610177
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.2.2.13136.00002
title: Worlds of Journalism Study: Serbia (country report)
DOI: 10.3535/318-032-m9v
title: Arenaria ciliata L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/6ql-a4f-qm3
title: Quercus suber L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/bkd-pwp-kt4
title: Gnaphalium unionis Sch. Bip. ex Oliv. & Hiern

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnfb7m
title: CCDC 608630: Experimental Crystal Structure Determination

description: Related Article: Weijie Teng, M.Guino-o, J.Hitzbleck, U.Englich, K.Ruhlandt-Senge|2006|Inorg.Chem.|45|9531|doi:10.1021/ic061119x
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/ccnfb8n
title: CCDC 608631: Experimental Crystal Structure Determination

description: Related Article: Weijie Teng, M.Guino-o, J.Hitzbleck, U.Englich, K.Ruhlandt-Senge|2006|Inorg.Chem.|45|9531|doi:10.1021/ic061119x
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: 10.3535/21l-lnn-m7t
title: Muscari matritense Ruíz Rejón, Pascual, C. Ruíz Rejón, Valdés & J. L. Oliv.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/eta-k6c-4r5
title: Lannea triphylla (Hochst. ex A. Rich.) Engl.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/vwn-gl0-qct
title: Scilla verna subsp. verna Huds.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnfb9p
title: CCDC 608632: Experimental Crystal Structure Determination

description: Related Article: Weijie Teng, M.Guino-o, J.Hitzbleck, U.Englich, K.Ruhlandt-Senge|2006|Inorg.Chem.|45|9531|doi:10.1021/ic061119x
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/ccnfbbq
title: CCDC 608633: Experimental Crystal Structure Determination

description: Related Article: Weijie Teng, M.Guino-o, J.Hitzbleck, U.Englich, K.Ruhlandt-Senge|2006|Inorg.Chem.|45|9531|doi:10.1021/ic061119x
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: 10.3535/5qz-ewj-bdr
title: Ruscus aculeatus L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/ar1-sv7-tm4
title: Orchis Tourn. ex L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnfbcr
title: CCDC 608634: Experimental Crystal Structure Determination

description: Related Article: Weijie Teng, M.Guino-o, J.Hitzbleck, U.Englich, K.Ruhlandt-Senge|2006|Inorg.Chem.|45|9531|doi:10.1021/ic061119x
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: 10.3535/5cc-78f-s2z
title: Ophrys speculum Link

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/mhc-cgx-vlq
title: Plantago bellardii All.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/s9m-dkv-ak3
title: Muscari atlanticum Boiss. & Reut.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnfbds
title: CCDC 608635: Experimental Crystal Structure Determination

description: Related Article: Weijie Teng, M.Guino-o, J.Hitzbleck, U.Englich, K.Ruhlandt-Senge|2006|Inorg.Chem.|45|9531|doi:10.1021/ic061119x
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/ccp4g2b
title: CCDC 629891: Experimental Crystal Structure Determination

description: Related Article: Shou-Xin Liu, Jian-Rong Han, Xiao-Li Zhen, Xia Tian|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5643|doi:10.1107/S160053680604863X
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: 10.3535/8pe-tbb-w2b
title: Helictochloa blaui (Asch. & Janka) Romero Zarco

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/f8f-1sy-l70
title: Lythrum hyssopifolia L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/q0v-c0n-6hv
title: Rhus thyrsiflora Balf. f.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp4g3c
title: CCDC 629892: Experimental Crystal Structure Determination

description: Related Article: Dong-Chuan Wang, Xiao-Jun Peng, Ai-Jun Cui, Cheng He, Jiang-Li Fan|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5789|doi:10.1107/S1600536806049336
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: 10.3535/7ta-f3z-tjf
title: Rhinanthus glacialis Personnat

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/asr-swl-7rd
title: Sporobolus R. Br.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/z93-snd-dm1
title: Hornungia alpina subsp. alpina (L.) O. Appel

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp4g4d
title: CCDC 629893: Experimental Crystal Structure Determination

description: Related Article: Wei-Lin Ding, Zhi-Tao Xing, Pin-Liang Wang, Hai-Bo Wang, Yong-Mei Shen|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5840|doi:10.1107/S1600536806049361
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/ccp4g5f
title: CCDC 629894: Experimental Crystal Structure Determination

description: Related Article: Xiao-Li Zhen, Jian-Rong Han, Xia Tian, Zhen-Chao Li, Shou-Xin Liu|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5763|doi:10.1107/S1600536806049312
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: 10.3535/4wm-7jv-d36
title: Taraxacum Weber

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/kmh-phf-1s5
title: Catapodium rigidum (L.) C. E. Hubb.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/t0b-86t-xq0
title: Galium L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp4g6g
title: CCDC 629895: Experimental Crystal Structure Determination

description: Related Article: Shou-Xin Liu, Jian-Rong Han, Xiao-Li Zhen, Xia Tian|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5765|doi:10.1107/S1600536806049324
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/ccp4g7h
title: CCDC 629896: Experimental Crystal Structure Determination

description: Related Article: Chuan-Bi Li, Yan-Wei Li, Wei Fang, Bo Liu|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|m3541|doi:10.1107/S1600536806049592
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: 10.3535/09t-rxy-73v
title: Medicago marina L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/wbz-d9g-pj5
title: Primula wulfeniana Schott

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp4g8j
title: CCDC 629897: Experimental Crystal Structure Determination

description: Related Article: Xiao-Li Zhen, Jian-Rong Han, Qun-Tao Wang, Xia Tian, Shou-Xin Liu|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5794|doi:10.1107/S1600536806049671
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/ayk-wj4-yax
title: Genista lanuginosa Spach

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/elr-0xr-j5y
title: Plantago L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/pj7-493-cfd
title: Rhamnus fallax Boiss.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp4g9k
title: CCDC 629898: Experimental Crystal Structure Determination

description: Related Article: Zhi-Ke Lu, Shen Li, Peng-Mian Huang|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5830|doi:10.1107/S1600536806049993
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/ccp4gbl
title: CCDC 629899: Experimental Crystal Structure Determination

description: Related Article: Heng-Yu Qian, Xiu-Ling Cui|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|m3435|doi:10.1107/S1600536806048471
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: 10.3535/25g-szy-7m8
title: Pancratium maritimum L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/nqn-vvz-wzs
title: Dorycnium herbaceum Vill.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/z3x-sjs-t3a
title: Gentiana purpurea L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp4gcm
title: CCDC 629900: Experimental Crystal Structure Determination

description: Related Article: Huan-Yu Wang, Shan Gao, Jing-Gui Zhao, S.W.Ng|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|m3298|doi:10.1107/S1600536806047532
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: 10.3535/2lg-ygs-345
title: Acalypha indica L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/60d-mbn-bdh
title: Ranunculus traunfellneri Hoppe

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/sg6-px4-mx2
title: Selaginella lechleri Hieron.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccnw8rj
title: CCDC 622038: Experimental Crystal Structure Determination

description: Related Article: Xiang-Chao Zeng|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5505|doi:10.1107/S1600536806046289
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/ccp4gpy
title: CCDC 629910: Experimental Crystal Structure Determination

description: Related Article: A.E.Koziol, Z.Chilmonczyk, J.Cybulski|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5616|doi:10.1107/S1600536806047726
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: 10.3535/0d6-sg8-9mp
title: Bupleurum commutatum Boiss. & Balansa

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/c9l-trq-t60
title: Gentianella glenniae J. S. Pringle

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/zzn-jfa-vgg
title: Polypogon maritimus Willd.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp4gqz
title: CCDC 629911: Experimental Crystal Structure Determination

description: Related Article: C.M.Forsyth, S.J.Langford, K.A.Lee|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5654|doi:10.1107/S1600536806047738
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/ccp4gr0
title: CCDC 629912: Experimental Crystal Structure Determination

description: Related Article: Xin-Hong Chang|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|o5699|doi:10.1107/S1600536806048677
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: 10.3535/8ec-cfz-j7z
title: Anemia pinnata Sehnem

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/bj6-lsn-gm5
title: Vernonia pteropoda Oliv. & Hiern

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.3535/qk3-l58-4an
title: Calendula L.

description: Digital Specimen for the physical specimen hosted at Natural History Museum Vienna.
DOI: 10.5517/ccp4gs1
title: CCDC 629913: Experimental Crystal Structure Determination

description: Related Article: Guang Chen|2006|Acta Crystallogr.,Sect.E:Struct.Rep.Online|62|m3383|doi:10.1107/S1600536806048653
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.