From: li (zlee_at_ustc.edu)
Date: Sun Jan 23 2005 - 23:08:08 CST

Hi,all:
How to compute the angles (from 0 to 360 degrees) between z-axis and the first principal axis of a cone molecule when it is moving along z-axis? I have tried the orient program, but failed in extracting the vector of the first principal axis.

Thanks in advance!

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