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note
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A modified version of VAMP 4.3 has been used for the PECI calculations because VAMPS. S1 computes erroneous values of the transition dipole moment and oscillator strength.
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note
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The author has deposited atomic coordinates for 3 and 5 with the Cambridge Crystallographic Data Centre. The coordinates can be obtained, on request, from the Director, Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge, CB2 1EZ, UK.
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