Atom

Chalcone

Transition state

C7

0.643

0.669

O7

-0.604

-0.675

C8

–0.415

–0.879

C9

–0.039

0.310

C1'

–0.110

–0.006

C2'

0.405

0.327

O2'

–0.636

–0.675

C3'

–0.404

–0.353

C4'

0.351

0.260

O4'

–0.673

–0.650

C5'

–0.217

–0.111

C6'

–0.400

–0.432

H8

0.157

0.248

H9

0.084

–0.001

H3'

0.096

0.108

H4'

0.431

0.439

H5'

0.123

0.124

H6'

0.183

0.169