-----BEGIN PGP SIGNED MESSAGE----- Hash: SHA1 On Tuesday 01 June 2004 16:22, Miguel wrote: > The file samples/xyz/met-enkaphalin_movie.xyz contains the element symbol > 'LP' > ... > H 2.056 2.462 -4.930 > S 3.057 4.570 -4.353 > LP 3.502 4.170 -4.030 > LP 2.652 5.106 -4.475 > C 3.658 4.243 -6.025 > H 4.409 3.452 -5.958 > ... > > Do you know what this is supposed to be?
Lone pair. That's two electrons in a free orbital... e.g. O has two LPs. Egon - -- [EMAIL PROTECTED] PhD on Molecular Representation in Chemometrics Nijmegen University http://www.cac.sci.kun.nl/people/egonw/ GPG: 1024D/D6336BA6 -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.0.7 (SunOS) iD8DBQFAvJHMd9R8I9Yza6YRAoyVAJ9r9aseNV2pQoqPDKRIKOBPNELIzwCggGHL tG8O9WjdiDSP1312jBwHZ1g= =kq/t -----END PGP SIGNATURE----- ------------------------------------------------------- This SF.Net email is sponsored by: Oracle 10g Get certified on the hottest thing ever to hit the market... Oracle 10g. Take an Oracle 10g class now, and we'll give you the exam FREE. http://ads.osdn.com/?ad_id149&alloc_id�66&op=click _______________________________________________ Jmol-developers mailing list [EMAIL PROTECTED] https://lists.sourceforge.net/lists/listinfo/jmol-developers
