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    <description>Title: MECP_s_freq
Authors: Pérez-Soto, Raúl
Description: Frequency calculation on the MECP geometry</description>
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Authors: Pérez-Soto, Raúl
Description: Frequency calculation on the MECP geometry</description>
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Authors: Pérez-Soto, Raúl
Description: SP calculation on the singlet PES for the MECP</description>
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Authors: Pérez-Soto, Raúl
Description: SP calculation on the triplet PES for the MECP</description>
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