#rdkit symbol shift mult coup 29 H 3.7070448307410797 s NA 28 H 3.7070448307410797 s NA 30 H 3.7070448307410797 s NA 27 H 5.22580054894785 s NA 25 H 2.4131747483989 dd -15.4,6.2 26 H 2.30411710887466 dd -15.4,9.2 31 H 4.51912168344007 d -12.4 32 H 4.37785910338518 d -12.4 24 H 3.53037511436413 tdd 5.6,6.2,9.2 23 H 1.50814272644099 ddt -12.4,5.6,6.6 22 H 1.36248856358646 ddt -12.4,5.6,6.6 20 H 1.81225983531564 dtq -12.4,6.6,7.0 21 H 1.24318389752973 dtq -12.4,6.6,7.0 17 H 0.9246416590423913 t 7.0 18 H 0.9246416590423913 t 7.0 19 H 0.9246416590423913 t 7.0