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  2. APPENDIX 2 XED/COSMIC ATOM TYPES XED/Cosmic Atom Types - ...

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xa2_typ.html
    8 Nov 2010: 7. 23. N sp(CN). triple. 1. Nitrile only. 8. 24. O (PO &SO).

  3. Book 2. CHANGE- Move the cursor over the book ...

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xbk2.html
    8 Nov 2010: rotation). Colours run from 1 to 24. See Book 2 page 1 'Colours' for the colour code.

  4. DOCK 2 MOLECULES: This docker brings one movable (but ...

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xbk6_dk.html
    8 Nov 2010: The sequential docking takes many hours. For 40 waters to solvate a small t-butyl ammonium cation, the batch job ran for about 24 hours on a 4000 (100MHz) SGI!

  5. MOPAC- RUN & LOOK: The inclusion of this module ...

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xbk6_mo.html
    8 Nov 2010: Orbitals are colour coded up to 24 colours before recycling.

  6. APPENDIX 5 FILE FORMATS 17.108 25 25 Ethyl Sulphonamide ...

    https://www-jmg.ch.cam.ac.uk/cil/SGTL/xed/xa5_fmt.html
    8 Nov 2010: 7 21 9 22 10 23 12 24 13 25. 6 5.174075 5.365369 1.431309 1 -0.1027. ... 16 8.635511 3.939991 -0.025040 12 0.3431. 8 9.054147 2.977788 0.946559 24 -0.2967.

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