Parameter

Penicillin acid

Parameter

DGD

µ, D

3.571

µ, D

0.953

q С1

−0.121483

q С1

0.210

q С2

−0.131220

q O2

−0.284

q С3

−0.130831

q С3

−0.270

q С4

−0.112560

q С4

−0.030

q С5

−0.086901

q С5

−0.199

q С6

−0.110834

q С6

0.05

q С11

−0.057496

q N7

−0.469

q С14

0.082292

q S13

0.620

q N16

−0.153666

q C14

−0.429

q O17

−0.226165

q N15

0.005

q C18

−0.198795

q C16

0.351

q C19

0.341160

q O17

−0.361

q O20

−0.293519

q N18

−0.322

q C21

0.083508

q C19

−0.028

q N23

−0.277703

q C20

−0.234

q C25

0.027240

q C21

−0.022

q C27

0.322425

q C22

−0.237

q C28

−0.145945

q O29

−0.356745

q C30

−0.290921

q C32

−0.213261

q C33

−0.234911

q S40

−0.065233