#rdkit symbol shift mult coup 42 H 1.66139066788655 s NA 41 H 4.16596523330284 dt 5.0,5.8 35 H 1.68124428179323 dtt 5.0,6.0,6.2 39 H 0.8431534004269577 t 7.0 40 H 0.8431534004269577 t 7.0 38 H 0.8431534004269577 t 7.0 37 H 0.771729185727355 ddq -12.4,6.0,7.0 36 H 1.57172918572736 ddq -12.4,6.0,7.0 34 H 1.06230558096981 dd -12.4,6.2 33 H 1.84720951509606 dd -12.4,6.2 24 H 1.1055504727050938 t 7.2 26 H 1.1055504727050938 t 7.2 25 H 1.1055504727050938 t 7.2 27 H 3.23403476669716 dq -14.4,7.2 28 H 2.6903934126258 dq -14.4,7.2 49 H 1.50009149130832 dd -12.4,9.6 48 H 1.9395242451967 dd -12.4,7.4 54 H 0.6781030802073781 t 7.0 53 H 0.6781030802073781 t 7.0 55 H 0.6781030802073781 t 7.0 52 H 1.18618481244282 ddq -12.4,6.0,7.0 51 H 1.66175663311985 ddq -12.4,6.0,7.0 50 H 3.00658737419945 m 6.0,7.4,9.0,9.6 29 H 4.13668801463861 d 9.0 30 H 1.068648978347056 s NA 31 H 1.068648978347056 s NA 32 H 1.068648978347056 s NA 43 H 2.25333943275389 dd -14.4,5.8 44 H 2.34126258005489 dd -14.4,5.8 46 H 3.6509911558401935 s NA 45 H 3.6509911558401935 s NA 47 H 3.6509911558401935 s NA