cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.25505/fiz.icsd.cc2lzy9v
title: CSD 2413018: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzybw
title: CSD 2413019: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzycx
title: CSD 2413020: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzydy
title: CSD 2413021: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzyfz
title: CSD 2413022: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzyg0
title: CSD 2413023: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzyh1
title: CSD 2413024: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzyj2
title: CSD 2413025: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzyk3
title: CSD 2413026: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzyl4
title: CSD 2413027: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzym5
title: CSD 2413028: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzyn6
title: CSD 2413029: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzyp7
title: CSD 2413030: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzyq8
title: CSD 2413031: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzyr9
title: CSD 2413032: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2lzysb
title: CSD 2413033: Experimental Crystal Structure Determination

description: Related Article: Osamu Ikeda, Hajime Yamamoto, Asami Sano-Furukawa, Tatsuya Sakamaki, Takahiro Kuribayashi, Yukio Noda, Akio Suzuki|2025|J.Am.Chem.Soc.|147|4005|doi:10.1021/jacs.4c11982
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.cc2m07sp
title: CSD 2413312: Experimental Crystal Structure Determination

description: Related Article: Jingjing Xu, Yan Xiao, Xiaowen Wu, Bingbing Zhang, Kui Wu|2025|Dalton Trans.|54|4903|doi:10.1039/D4DT03569K
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.cc2kwdhc
title: CSD 2379823: Experimental Crystal Structure Determination

description: Related Article: Sayantani Paul, Sangita Das, Nayim Sepay, Nilendu Basak, Bibaswan Sen, Ekramul Islam, Uttam Das, Sander van Smaalen, Sk Jahir Abbas, Sk Imran Ali|2025|Inorg.Chem.|64|2649|doi:10.1021/acs.inorgchem.4c03972
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.cc2m0h8f
title: CSD 2413544: Experimental Crystal Structure Determination

description: Related Article: Lianjie Man, Xiang Li, Tiziana Boffa Ballaran, Wenju Zhou, Julien Chantel, Adrien Néri, Ilya Kupenko, Georgios Aprilis, Alexander Kurnosov, Olivier Namur, Michael Hanfland, Nicolas Guignot, Laura Henry, Leonid Dubrovinsky, Daniel. J. Frost|2025|Nat.Commun.|16|1710|doi:10.1038/s41467-025-56220-2
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.cc2m0h9g
title: CSD 2413545: Experimental Crystal Structure Determination

description: Related Article: Lianjie Man, Xiang Li, Tiziana Boffa Ballaran, Wenju Zhou, Julien Chantel, Adrien Néri, Ilya Kupenko, Georgios Aprilis, Alexander Kurnosov, Olivier Namur, Michael Hanfland, Nicolas Guignot, Laura Henry, Leonid Dubrovinsky, Daniel. J. Frost|2025|Nat.Commun.|16|1710|doi:10.1038/s41467-025-56220-2
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.cc2l0740
title: CSD 2383501: Experimental Crystal Structure Determination

description: Related Article: Fumitaka Hayashi, Maru Kashiwazaki, Masaki Moriwaki, Tetsuya Yamada, Hiroshi Ohki, Taku Iiyama, Katsuya Teshima|2025|Inorg.Chem.|64|1711|doi:10.1021/acs.inorgchem.4c03864
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.cc2m0v0j
title: CSD 2413877: Experimental Crystal Structure Determination

description: Related Article: Zhihui Xiong, Haotian Tian, Zhixi Li, Guowei Deng, Fang Ding, Qian Wu, Mingjun Xia|2025|Dalton Trans.|54|8152|doi:10.1039/D5DT00186B
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.cc2m16ws
title: CSD 2414245: Experimental Crystal Structure Determination

description: Related Article: Jiawei Zhao, Wei Wei, Meihui Chen, Donghai An, Yanna Chen, Hongsheng Shi|2025|Inorg.Chem.|64|4161|doi:10.1021/acs.inorgchem.5c00117
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.cc2m16xt
title: CSD 2414246: Experimental Crystal Structure Determination

description: Related Article: Jiawei Zhao, Wei Wei, Meihui Chen, Donghai An, Yanna Chen, Hongsheng Shi|2025|Inorg.Chem.|64|4161|doi:10.1021/acs.inorgchem.5c00117
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.cc2m18sr
title: CSD 2414304: Experimental Crystal Structure Determination

description: Related Article: Ya-Xiang Han, Ming-Zhi Zhang, Chun-Li Hu, Jiang-Gao Mao|2025|Inorg.Chem.|64|6259|doi:10.1021/acs.inorgchem.5c00083
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.cc2lp1v6
title: CSD 2403518: Experimental Crystal Structure Determination

description: Related Article: Brenden R. Ortiz, William R. Meier, Ganesh Pokharel, Juan Chamorro, Fazhi Yang, Shirin Mozaffari, Alex Thaler, Steven J. Gomez Alvarado, Heda Zhang, David S. Parker, German D. Samolyuk, Joseph A. M. Paddison, Jiaqiang Yan, Feng Ye, Suchismita Sarker, Stephen D. Wilson, Hu Miao, David Mandrus, Michael A. McGuire|2025|J.Am.Chem.Soc.|147|5279|doi:10.1021/jacs.4c16347
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.cc2lp1w7
title: CSD 2403519: Experimental Crystal Structure Determination

description: Related Article: Brenden R. Ortiz, William R. Meier, Ganesh Pokharel, Juan Chamorro, Fazhi Yang, Shirin Mozaffari, Alex Thaler, Steven J. Gomez Alvarado, Heda Zhang, David S. Parker, German D. Samolyuk, Joseph A. M. Paddison, Jiaqiang Yan, Feng Ye, Suchismita Sarker, Stephen D. Wilson, Hu Miao, David Mandrus, Michael A. McGuire|2025|J.Am.Chem.Soc.|147|5279|doi:10.1021/jacs.4c16347
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.cc2lp1x8
title: CSD 2403520: Experimental Crystal Structure Determination

description: Related Article: Brenden R. Ortiz, William R. Meier, Ganesh Pokharel, Juan Chamorro, Fazhi Yang, Shirin Mozaffari, Alex Thaler, Steven J. Gomez Alvarado, Heda Zhang, David S. Parker, German D. Samolyuk, Joseph A. M. Paddison, Jiaqiang Yan, Feng Ye, Suchismita Sarker, Stephen D. Wilson, Hu Miao, David Mandrus, Michael A. McGuire|2025|J.Am.Chem.Soc.|147|5279|doi:10.1021/jacs.4c16347
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.cc2lp1y9
title: CSD 2403521: Experimental Crystal Structure Determination

description: Related Article: Brenden R. Ortiz, William R. Meier, Ganesh Pokharel, Juan Chamorro, Fazhi Yang, Shirin Mozaffari, Alex Thaler, Steven J. Gomez Alvarado, Heda Zhang, David S. Parker, German D. Samolyuk, Joseph A. M. Paddison, Jiaqiang Yan, Feng Ye, Suchismita Sarker, Stephen D. Wilson, Hu Miao, David Mandrus, Michael A. McGuire|2025|J.Am.Chem.Soc.|147|5279|doi:10.1021/jacs.4c16347
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.cc2lp1zb
title: CSD 2403522: Experimental Crystal Structure Determination

description: Related Article: Brenden R. Ortiz, William R. Meier, Ganesh Pokharel, Juan Chamorro, Fazhi Yang, Shirin Mozaffari, Alex Thaler, Steven J. Gomez Alvarado, Heda Zhang, David S. Parker, German D. Samolyuk, Joseph A. M. Paddison, Jiaqiang Yan, Feng Ye, Suchismita Sarker, Stephen D. Wilson, Hu Miao, David Mandrus, Michael A. McGuire|2025|J.Am.Chem.Soc.|147|5279|doi:10.1021/jacs.4c16347
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.cc2lp20d
title: CSD 2403523: Experimental Crystal Structure Determination

description: Related Article: Brenden R. Ortiz, William R. Meier, Ganesh Pokharel, Juan Chamorro, Fazhi Yang, Shirin Mozaffari, Alex Thaler, Steven J. Gomez Alvarado, Heda Zhang, David S. Parker, German D. Samolyuk, Joseph A. M. Paddison, Jiaqiang Yan, Feng Ye, Suchismita Sarker, Stephen D. Wilson, Hu Miao, David Mandrus, Michael A. McGuire|2025|J.Am.Chem.Soc.|147|5279|doi:10.1021/jacs.4c16347
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.