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Tutorial for Read/Write CIF tool (1) Select (2) Depress.

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Presentation on theme: "Tutorial for Read/Write CIF tool (1) Select (2) Depress."— Presentation transcript:

1 Tutorial for Read/Write CIF tool (1) Select (2) Depress

2 Arsenopyrite imported from Crystallography Open Database http://sdpd.univ-lemans.fr/cod/search.html (1) cut and paste from Web search (2) Depress CIF files with deficient syntax can be imported and edited into the Edit tool instead. unusual space-group symbol

3 The Toolkit got no problems with the space group

4 The distances and angles

5 Transform to conventional setting (1) Select (2) Depress Note: Z=8

6 Transformation to P21/c is proposed. Accept.

7 Z=4 (1) Select (2) Depress Lets produce a CIF file for this model

8 (1) Select (2) Depress Write a CIF file for the model in memory

9 This CIF can be cut-and-pasted into another package Arsenopyrite is now described in P21/c

10 End of Read/Write CIF tool tutorial


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