0  B18R3.4085160  CC1=CC(=O)OC2=CC3=C(C=C12)C(=CO3)C Molport-000-722-739 [0,0,0,0,0,0|0,1,0]=1
1  B18R3.4085160  CC1=CC(=S)OC2=CC3=C(C=C12)C(=CO3)C Molport-000-842-374 [0,0,0,0,0,0|0,0,0]=0
2  B19R3.7777644  CC1=CC(=O)OC2=C(C3=C(C=C12)C(=CO3)C)C Molport-002-324-903 [0,1,0,0,0,0|0,1,0]=2
3  B19R3.7777644  CC1=CC(=O)OC2=C(C3=C(C=C12)C(=O)CO3)C Molport-047-714-862 [0,1,0,0,0,0|1,1,1]=4
4  B19R3.7777644  CC1=CC(=S)OC2=C(C3=C(C=C12)C(=CO3)C)C Molport-000-854-458 [0,1,0,0,0,0|0,0,0]=1
5  B19R3.16179261  CC1=C/C(=N\O)/OC2=CC3=C(C=C12)C(=CO3)C Molport-005-909-782 [0,1,0,0,0,0|0,1,0]=2
6  B17R2.139606  COC1=C(C=C2C(=CC(=O)OC2=C1)C)OC Molport-000-722-004 [0,0,1,0,0,0|1,1,1]=4
7  B17R2.368018  C=CCOC1=CC=C2C(=CC(=O)OC2=C1)C Molport-000-248-714 [0,0,1,0,0,0|0,1,2]=4
8  B16R2.41208  CC1=CC(=O)OC2=CC(=C(C=C12)C=O)O Molport-002-512-327 [1,0,1,0,0,0|1,1,0]=4
9  B18R2.2434718  COC(=O)OC1=CC=C2C(=CC(=O)OC2=C1)C Molport-000-466-865 [0,1,1,0,0,0|1,1,0]=4
10  B18R3.950298  CC1=CC(=O)OC2=C(C3=C(C=CO3)C=C12)C Molport-001-953-750 [1,1,0,0,0,0|0,1,0]=3
11  B20R3.17309539  CCCC1=CC(=S)OC2=CC3=C(C=C12)C(=CO3)C Molport-005-923-662 [0,2,0,0,0,0|0,0,0]=2
12  B20R3.2327628  CCC1=C(C2=CC3=C(C=C2OC1=O)OC=C3C)C Molport-000-825-183 [0,2,0,0,0,0|0,1,0]=3
13  B20R3.15760200  CC1=CC(=O)OC2=C1C=C3C(=C(OC3=C2C)C)C Molport-002-519-180 [0,2,0,0,0,0|0,1,0]=3
14  B20R3.35827951  CC1=C/C(=N\N)/OC2=C(C3=C(C=C12)C(=CO3)C)C Molport-000-859-900 [0,2,0,0,0,0|1,0,0]=3
15  B20R3.35827951  CC1=C/C(=N\O)/OC2=C(C3=C(C=C12)C(=CO3)C)C Molport-005-909-892 [0,2,0,0,0,0|0,1,0]=3
16  B20R3.35820864  CC1=C/C(=N\O)/OC2=C1C=C3C(=C2)OC(=C3C)C Molport-000-844-476 [0,2,0,0,0,0|0,1,0]=3