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TSRC subblock in QUILD block
The
Transition State Reaction Coordinates that are used to construct the special
initial Hessian, should be given in the TSRC subblock
of QUILD.
Similar to the CONSTR subblock, the distances, angles, or dihedrals
should be specified, one per line, with atom numbers. The atom numbers should
refer to the atoms as they are found in the ATOMS block.
QUILD
TSRC
dist 1 2
angle 1 2 3
dihed 1 2 3 4
SUBEND
END
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