<?xml version='1.0' encoding='UTF-8'?><codeBook xmlns="ddi:codebook:2_5" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="ddi:codebook:2_5 https://ddialliance.org/Specification/DDI-Codebook/2.5/XMLSchema/codebook.xsd" version="2.5"><docDscr><citation><titlStmt><titl>Replication Data for: Unexpected significance of a minor reaction pathway in daytime formation of biogenic highly oxygenated organic compounds</titl><IDNo agency="DOI">doi:10.26165/JUELICH-DATA/GLU9BW</IDNo></titlStmt><distStmt><distrbtr source="archive">Jülich DATA</distrbtr><distDate>2022-09-21</distDate></distStmt><verStmt source="DVN"><version date="2022-09-21" type="RELEASED">1</version></verStmt><biblCit>Vereecken, Luc, 2022, "Replication Data for: Unexpected significance of a minor reaction pathway in daytime formation of biogenic highly oxygenated organic compounds", https://doi.org/10.26165/JUELICH-DATA/GLU9BW, Jülich DATA, V1</biblCit></citation></docDscr><stdyDscr><citation><titlStmt><titl>Replication Data for: Unexpected significance of a minor reaction pathway in daytime formation of biogenic highly oxygenated organic compounds</titl><IDNo agency="DOI">doi:10.26165/JUELICH-DATA/GLU9BW</IDNo></titlStmt><rspStmt><AuthEnty affiliation="Forschungszentrum Jülich GmbH">Vereecken, Luc</AuthEnty></rspStmt><prodStmt/><distStmt><distrbtr source="archive">Jülich DATA</distrbtr><contact affiliation="Forschungszentrum Jülich GmbH" email="l.vereecken@fz-juelich.de">Vereecken, Luc</contact><depositr>Vereecken, Luc</depositr><depDate>2022-01-18</depDate></distStmt></citation><stdyInfo><subject><keyword>Chemistry</keyword><keyword>Earth and Environmental Sciences</keyword></subject><abstract>Quantum chemical data used for the theoretical kinetic data, including geometries and vibrational wavenumbers at the M06-2X-D3/aug-cc-pVTZ level of theory, and energies at methodologies up to CCSD(T)/aug-cc-pVTZ</abstract><sumDscr/></stdyInfo><method><dataColl><sources/></dataColl><anlyInfo/></method><dataAccs><notes type="DVN:TOU" level="dv">CC0 Waiver</notes><setAvail/><useStmt/></dataAccs><othrStdyMat><relPubl><citation><biblCit>Unexpected significance of a minor reaction pathway in daytime formation of biogenic highly oxygenated organic compounds&#xd;
H. Shen, L. Vereecken, S. Kang, I. Pullinen, H. Fuchs, D. Zhao, T. F. Mentel&#xd;
Science Advances, accepted for publication, 2022</biblCit></citation></relPubl></othrStdyMat></stdyDscr><otherMat ID="f5141" URI="https://data.fz-juelich.de/api/access/datafile/5141" level="datafile"><labl>Quantumchemical_data.txt</labl><txt>Quantum chemical data: geometries, energies, vibrational wavenumbers, rotational constants.</txt><notes level="file" type="DATAVERSE:CONTENTTYPE" subject="Content/MIME Type">text/plain</notes></otherMat></codeBook>