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Re: Ambiguity in atom_site.disorder_group value -1
- To: Distribution list of the IUCr COMCIFS Core Dictionary Maintenance Group<coredmg@iucr.org>
- Subject: Re: Ambiguity in atom_site.disorder_group value -1
- From: Robert Hanson via coreDMG <coredmg@iucr.org>
- Date: Mon, 31 Oct 2022 17:19:02 -0500
- Cc: Robert Hanson <hansonr@stolaf.edu>
- In-Reply-To: <CH2PR04MB695004F3EFD4429C0D7A634DE0379@CH2PR04MB6950.namprd04.prod.outlook.com>
- References: <CAF_YUvVJnqehHZLR6pML=UA-n1j4oAmABciUhB4Ek9R+G+G7QA@mail.gmail.com><CH2PR04MB6950EEBF6DFE85F62D0B644EE0299@CH2PR04MB6950.namprd04.prod.outlook.com><CAF_YUvVrXQRqgGso-9=6dz+i=X_F_Q5vQTyEFw5WBVhOLMyzWw@mail.gmail.com><CH2PR04MB695048D4F065E88F6993FB2DE0289@CH2PR04MB6950.namprd04.prod.outlook.com><CAF_YUvVntsTd7Vo0ejsoyj4JpFkLL8Jx6mtFY93KmMREDm5XbA@mail.gmail.com><CH2PR04MB6950BAA282D7BFB2CC4426E1E0289@CH2PR04MB6950.namprd04.prod.outlook.com><CAF_YUvXRRgRW74LWAUWGLd28gHuAo7QSMQbd6jH9XDCQ2zGDQw@mail.gmail.com><74bb0ceb-c850-059d-1d73-b3f7f4732b7f@iucr.org><CH2PR04MB6950C282D5D4CA0ABA4005C8E0379@CH2PR04MB6950.namprd04.prod.outlook.com><CAF_YUvXG0s+gJjY9_+_ydX+WnLDe4p5ULHezZo0ELVvmb49D3A@mail.gmail.com><CH2PR04MB695004F3EFD4429C0D7A634DE0379@CH2PR04MB6950.namprd04.prod.outlook.com>
Understood. I will still claim it as a feature request, perhaps not fully thought out on my part (as for example, adding the translations to the symmetry operations, as for bonding. It arose because as far as I know there is no way to describe this for symmetry-equivalent disorder groups the way John points out is readily available for "standard" non-symmetry-related disorder. Just seems to me to be an omission.
I won't belabor this. If there is an official way to suggest a feature/consideration for the next update of CIF, please let me know.
Thanks for the discussion. Thanks for suggesting this list, Brian.
Bob
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- Ambiguity in atom_site.disorder_group value -1 (Robert Hanson via coreDMG)
- Re: Ambiguity in atom_site.disorder_group value -1 (Bollinger, John C via coreDMG)
- Re: Ambiguity in atom_site.disorder_group value -1 (Robert Hanson via coreDMG)
- RE: Ambiguity in atom_site.disorder_group value -1 (Bollinger, John C via coreDMG)
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