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46
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0347436643
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Atomic coordinates, bond lengths and angles, and thermal parameters have been deposited at the Cambridge Crystallographic Data Centre (CCDC). For details of the deposition scheme, see 'Instructions for authors', J. Chem. Soc., Perkin Trans. 2, 1997, Issue 1. Any request to the CCDC for this material should quote the full literature citation and the reference number 100082.
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49
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85087249102
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note
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bs is quite different for the MM-2 force-field structure and X-ray crystal structure.
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