0  B30R5.2322122053  C1(CC2C3OC3C(C1)[N+]2(C)C)OC(=O)C(O)(C4=CC=CS4)C5=CC=CS5 MCULE-2279891065 [0,0,0,0,0,0|0,0,0]=0
1  B30R5.2322122053  C1(CC2C3OC3C(C1)[N+]2(C)C)OC(=O)C(O)(C4=CC=CS4)C5=CC=CS5 MCULE-4922385900 [0,0,0,0,0,0|0,0,0]=0
2  B30R5.2322122053  [C@@H]12O[C@@H]1[C@H]3C[C@H](C[C@@H]2[N+]3(C)C)OC(=O)C(O)(C4=CC=CS4)C5=CC=CS5 MCULE-3221533232 [0,0,0,0,0,0|0,0,0]=0
3  B30R5.2322122053  [C@@H]12O[C@@H]1[C@H]3C[C@H](C[C@@H]2[N+]3(C)C)OC(=O)C(O)(C4=CC=CS4)C5=CC=CS5 MCULE-5693233602 [0,0,0,0,0,0|0,0,0]=0
4  B29R5.811453434  CN1C2CC(CC1C3C2O3)OC(=O)C(O)(C4=CC=CS4)C5=CC=CS5 MCULE-9408552838 [1,0,0,0,0,0|0,0,1]=2
5  B29R5.811453434  [C@@H]12C[C@@H](C[C@@H](N1C)[C@@H]3[C@H]2O3)OC(=O)C(O)(C4=CC=CS4)C5=CC=CS5 MCULE-6162570185 [1,0,0,0,0,0|0,0,1]=2
6  B28R4.651505205  [C@H]12C=C[C@H]([N+]1(C)C)C[C@H](C2)OC(=O)C(O)(C3=CC=CS3)C4=CC=CS4 MCULE-3469105978 [1,0,1,0,0,0|0,0,2]=4
7  B28R4.651505205  [C@H]12C=C[C@H]([N+]1(C)C)C[C@H](C2)OC(=O)C(O)(C3=CC=CS3)C4=CC=CS4 MCULE-9215451433 [1,0,1,0,0,0|0,0,2]=4