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Specifies that each odata entry gives the centre of mass coordinates
of a rigid water molecule to be described by a TIPS potential[38] of type 1, 2, 3 or 4.
In this case an additional file named Euler must exist in the current working directory and
contain the appropriate Euler angles,[39,40] three per line, for the molecules specified in the odata
file. Subroutines used: h2o.
David Wales
2002-10-28