cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc2hlqvp
title: CCDC 2311913: Experimental Crystal Structure Determination

description: Related Article: Sourajit Dey Baksi, Joshua O. Aggrey, Nattamai Bhuvanesh, John A. Gladysz|2024|Organometallics|43|1041|doi:10.1021/acs.organomet.4c00098
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.cc2hlr2y
title: CCDC 2311920: Experimental Crystal Structure Determination

description: Related Article: Saeed Hosseinpoor, Mehrdad Pourayoubi, Eliška Zmeškalová, Morgane Poupon|2024|RSC Advances|14|32206|doi:10.1039/D4RA05281A
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.cc2hlr3z
title: CCDC 2311921: Experimental Crystal Structure Determination

description: Related Article: Saeed Hosseinpoor, Mehrdad Pourayoubi, Eliška Zmeškalová, Morgane Poupon|2024|RSC Advances|14|32206|doi:10.1039/D4RA05281A
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.cc2hlr40
title: CCDC 2311922: Experimental Crystal Structure Determination

description: Related Article: Saeed Hosseinpoor, Mehrdad Pourayoubi, Eliška Zmeškalová, Morgane Poupon|2024|RSC Advances|14|32206|doi:10.1039/D4RA05281A
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.cc2hlr51
title: CCDC 2311923: Experimental Crystal Structure Determination

description: Related Article: Saeed Hosseinpoor, Mehrdad Pourayoubi, Eliška Zmeškalová, Morgane Poupon|2024|RSC Advances|14|32206|doi:10.1039/D4RA05281A
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.cc2hlrkf
title: CCDC 2311935: Experimental Crystal Structure Determination

description: Related Article: Saroj Maji, Sabyasachi Halder, Ashok Kumar Sharma, Avinash Madhesiya, Tejender S. Thakur, Gautam Panda|2024|Org.Process Res.Dev.|28|754|doi:10.1021/acs.oprd.3c00469
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.cc2hlrlg
title: CCDC 2311936: Experimental Crystal Structure Determination

description: Related Article: Saroj Maji, Sabyasachi Halder, Ashok Kumar Sharma, Avinash Madhesiya, Tejender S. Thakur, Gautam Panda|2024|Org.Process Res.Dev.|28|754|doi:10.1021/acs.oprd.3c00469
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.cc2hls52
title: CCDC 2311954: Experimental Crystal Structure Determination

description: Related Article: Hien Nguyen, Thuy T.T. Luong, Ngan B. Nguyen, Hai T.H. Le, Mai Chi P, Luc Van Meervelt, Minh T. Do, Tung T. Dang|2023|Tetrahedron|142|133539|doi:10.1016/j.tet.2023.133539
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.cc2hls63
title: CCDC 2311955: Experimental Crystal Structure Determination

description: Related Article: Hien Nguyen, Thuy T.T. Luong, Ngan B. Nguyen, Hai T.H. Le, Mai Chi P, Luc Van Meervelt, Minh T. Do, Tung T. Dang|2023|Tetrahedron|142|133539|doi:10.1016/j.tet.2023.133539
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.cc2hls74
title: CCDC 2311956: Experimental Crystal Structure Determination

description: Related Article: Tongshuai Wang, Wenxiu Li, Gang Wu|2024|Angew.Chem.,Int.Ed.|63|e202406701|doi:10.1002/anie.202406701
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.cc2hls85
title: CCDC 2311957: Experimental Crystal Structure Determination

description: Related Article: Tongshuai Wang, Wenxiu Li, Gang Wu|2024|Angew.Chem.,Int.Ed.|63|e202406701|doi:10.1002/anie.202406701
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: 10.34740/kaggle/dsv/13502601
title: BITCOIN Historical Datasets 2018-2025 Binance API
DOI: 10.5517/ccdc.csd.cc2hlshd
title: CCDC 2311964: Experimental Crystal Structure Determination

description: Related Article: Eleni Arnaouti, Christina Georgiadou, Antonios G. Hatizdimitriou, Stavros Kalogiannis, George Psomas|2024|J.Inorg.Biochem.|255|112525|doi:10.1016/j.jinorgbio.2024.112525
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.cc2hlthf
title: CCDC 2311995: Experimental Crystal Structure Determination

description: Related Article: Tongshuai Wang, Wenxiu Li, Gang Wu|2024|Angew.Chem.,Int.Ed.|63|e202406701|doi:10.1002/anie.202406701
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.cc2hltc9
title: CCDC 2311991: Experimental Crystal Structure Determination

description: Related Article: Kaidi Yang, Yifen Luo, Yusheng Zhang, Kunkai Wang, Huan Huo, Zhi Yang, Bozhou Wang, Fuqiang Bi|2025|J.Mol.Struct.|1337|141959|doi:10.1016/j.molstruc.2025.141959
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.cc2hlt53
title: CCDC 2311985: Experimental Crystal Structure Determination

description: Related Article: Si‐Pei Hu, Chen‐Hui Gao, Tu‐Ming Liu, Bing‐Yang Miao, Hong‐Chen Wang, Wei Yu, Bing Han|2024|Angew.Chem.,Int.Ed.|63|e202400168|doi:10.1002/anie.202400168
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.cc2hltdb
title: CCDC 2311992: Experimental Crystal Structure Determination

description: Related Article: Kaidi Yang, Yifen Luo, Yusheng Zhang, Kunkai Wang, Huan Huo, Zhi Yang, Bozhou Wang, Fuqiang Bi|2025|J.Mol.Struct.|1337|141959|doi:10.1016/j.molstruc.2025.141959
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.cc2hlt97
title: CCDC 2311989: Experimental Crystal Structure Determination

description: Related Article: Si‐Pei Hu, Chen‐Hui Gao, Tu‐Ming Liu, Bing‐Yang Miao, Hong‐Chen Wang, Wei Yu, Bing Han|2024|Angew.Chem.,Int.Ed.|63|e202400168|doi:10.1002/anie.202400168
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.cc2hltb8
title: CCDC 2311990: Experimental Crystal Structure Determination

description: Related Article: Si‐Pei Hu, Chen‐Hui Gao, Tu‐Ming Liu, Bing‐Yang Miao, Hong‐Chen Wang, Wei Yu, Bing Han|2024|Angew.Chem.,Int.Ed.|63|e202400168|doi:10.1002/anie.202400168
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: 10.25505/fiz.icsd.cc2hltjg
title: CSD 2311996: Experimental Crystal Structure Determination

description: Related Article: Xin-Wei Zhang, Zhi-Xiang Wang, Chun-Li Hu, Ya-Feng Li, Jiang-Gao Mao, Fang Kong|2024|Inorg.Chem.|63|6067|doi:10.1021/acs.inorgchem.4c00405
description: Related Article: Xin-Wei Zhang, Zhi-Xiang Wang, Chun-Li Hu, Ya-Feng Li, Jiang-Gao Mao, Fang Kong|2024|Inorg.Chem.|63|6067|doi:10.1021/acs.inorgchem.4c00405
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2hltkh
title: CSD 2311997: Experimental Crystal Structure Determination

description: Related Article: Xin-Wei Zhang, Zhi-Xiang Wang, Chun-Li Hu, Ya-Feng Li, Jiang-Gao Mao, Fang Kong|2024|Inorg.Chem.|63|6067|doi:10.1021/acs.inorgchem.4c00405
description: Related Article: Xin-Wei Zhang, Zhi-Xiang Wang, Chun-Li Hu, Ya-Feng Li, Jiang-Gao Mao, Fang Kong|2024|Inorg.Chem.|63|6067|doi:10.1021/acs.inorgchem.4c00405
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2hltlj
title: CSD 2311998: Experimental Crystal Structure Determination

description: Related Article: Xin-Wei Zhang, Zhi-Xiang Wang, Chun-Li Hu, Ya-Feng Li, Jiang-Gao Mao, Fang Kong|2024|Inorg.Chem.|63|6067|doi:10.1021/acs.inorgchem.4c00405
description: Related Article: Xin-Wei Zhang, Zhi-Xiang Wang, Chun-Li Hu, Ya-Feng Li, Jiang-Gao Mao, Fang Kong|2024|Inorg.Chem.|63|6067|doi:10.1021/acs.inorgchem.4c00405
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2hltmk
title: CCDC 2311999: Experimental Crystal Structure Determination

description: Related Article: G. A. Smirnov,  I. A. Vatsadze,  A. M. Gerasimov,  T. K. Shkineva,  K. Yu. Suponitsky,  A. N. Pivkina,  I. L. Dalinger|2024|Izv.Akad.Nauk SSSR,Ser.Khim.|73|1352|doi:10.1007/s11172-024-4253-3
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.cc2hltnl
title: CCDC 2312000: Experimental Crystal Structure Determination

description: Related Article: G. A. Smirnov,  I. A. Vatsadze,  A. M. Gerasimov,  T. K. Shkineva,  K. Yu. Suponitsky,  A. N. Pivkina,  I. L. Dalinger|2024|Izv.Akad.Nauk SSSR,Ser.Khim.|73|1352|doi:10.1007/s11172-024-4253-3
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.cc2hltpm
title: CCDC 2312001: Experimental Crystal Structure Determination

description: Related Article: Wei-Long Shan, Huan-Huan Hou, Nian Si, Cai-Xia Wang, Guozan Yuan, Xiang Gao, Guo-Xin Jin|2024|Angew.Chem.,Int.Ed.|63|e202402198|doi:10.1002/anie.202402198
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.cc2hltqn
title: CCDC 2312002: Experimental Crystal Structure Determination

description: Related Article: Wei-Long Shan, Huan-Huan Hou, Nian Si, Cai-Xia Wang, Guozan Yuan, Xiang Gao, Guo-Xin Jin|2024|Angew.Chem.,Int.Ed.|63|e202402198|doi:10.1002/anie.202402198
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.cc2hltrp
title: CCDC 2312003: Experimental Crystal Structure Determination

description: Related Article: Wei-Long Shan, Huan-Huan Hou, Nian Si, Cai-Xia Wang, Guozan Yuan, Xiang Gao, Guo-Xin Jin|2024|Angew.Chem.,Int.Ed.|63|e202402198|doi:10.1002/anie.202402198
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.cc2hltsq
title: CCDC 2312004: Experimental Crystal Structure Determination

description: Related Article: Wei-Long Shan, Huan-Huan Hou, Nian Si, Cai-Xia Wang, Guozan Yuan, Xiang Gao, Guo-Xin Jin|2024|Angew.Chem.,Int.Ed.|63|e202402198|doi:10.1002/anie.202402198
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.cc2hlv10
title: CCDC 2312012: Experimental Crystal Structure Determination

description: Related Article: Dost Muhammad Khan, Jiaying Lv, Ruimao Hua|2024|Molecules|29|3426|doi:10.3390/molecules29143426
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.cc28ggpx
title: CCDC 2099279: Experimental Crystal Structure Determination

description: Related Article: Xin Yang, Xiang Wang, Jiachen Lin, Sophie Lim, Yujia Cao, Siyu Chen, Pingkang Xu, Chunyuhang Xu, Hongling Zheng, Kuo-Chang Fu, Chien-Liang Kuo, Dejian Huang|2022|Foods|11|1831|doi:10.3390/foods11131831
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.cc28ggqy
title: CCDC 2099280: Experimental Crystal Structure Determination

description: Related Article: Xin Yang, Xiang Wang, Jiachen Lin, Sophie Lim, Yujia Cao, Siyu Chen, Pingkang Xu, Chunyuhang Xu, Hongling Zheng, Kuo-Chang Fu, Chien-Liang Kuo, Dejian Huang|2022|Foods|11|1831|doi:10.3390/foods11131831
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.cc2hgj0j
title: CCDC 2307857: Experimental Crystal Structure Determination

description: Related Article: Evgenii Yu. Matveev, Olga S. Dontsova, Varvara V. Avdeeva, Alexey S. Kubasov, Andrey P. Zhdanov, Svetlana E. Nikiforova, Lyudmila V. Goeva, Konstantin Yu. Zhizhin, Elena A. Malinina, Nikolay T. Kuznetsov |2023|Molecules|28|8073|doi:10.3390/molecules28248073
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.cc2hlv43
title: CCDC 2312015: Experimental Crystal Structure Determination

description: Related Article: Steve Avery, Jamie M. Buske, Doris Chen, Herman Chen, Xin Chen, Andrew R. Davidson, Jean-Nicolas Desrosiers, Hanqing Dong, Noalle Fellah, David F. Fernández, John Grosso, Lu Han, Teri Hochdorfer, Amber M. Johnson, Brian P. Jones, Maciej Kalinowski, Katherine D. Launer-Felty, Jorge Lopez, Teresa Makowski, Carolyn Mastriano, Truong N. Nguyen, Nitinchandra D. Patel, Zhihui Peng, Tyler Potter, Robert P. Pritchard, Anil M. Rane, Max Reeve, Margaret C. Richins, Chase A. Salazar, John J. Salisbury, Robert Simpson, Liza Tabshey, Erin J. Tweed, Paul G. Wahome, Nancy Walsh-Sayles, Jordan A. Willie, Ethan Wood|2024|Org.Process Res.Dev.|28|4079|doi:10.1021/acs.oprd.4c00362
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.cc2hlv54
title: CCDC 2312016: Experimental Crystal Structure Determination

description: Related Article: Anna Yu. Fominykh, Pin-Wen Huang, Leonid Yu. Starostin, Paulina Kalle, Natalia E. Borisova, Wei-Qun Shi, Petr I. Matveev|2025|J.Environ. Chem. Eng.|12|114184|doi:10.1016/j.jece.2024.114184
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.cc2hlv76
title: CCDC 2312018: Experimental Crystal Structure Determination

description: Related Article: Alessandro Sayed, Massimo Cametti|2024|Chem.-Eur.J.|30|e202401464|doi:10.1002/chem.202401464
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.cc2hlv87
title: CCDC 2312019: Experimental Crystal Structure Determination

description: Related Article: Alessandro Sayed, Massimo Cametti|2024|Chem.-Eur.J.|30|e202401464|doi:10.1002/chem.202401464
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.