0  B23R2.192709754  O=C(O)CC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I MCULE-7515478512 [0,0,0,0,0,0|0,0,0]=0
1  B22R2.8258481  O=C(O)CC1=CC(=C(C(=C1)I)OC2=CC(=C(C=C2)O)I)I MCULE-2271739200 [1,0,0,0,0,0|0,0,0]=1
2  B22R2.11517587  NCCC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I MCULE-8499806545 [1,0,0,0,0,0|1,0,1]=3
3  B22R2.23224372  O=C(O)C1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I MCULE-9501220213 [0,0,0,0,1,0|0,0,0]=1
4  B24R2.381219233  O=C(O)CCC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I MCULE-4908214466 [0,0,0,0,0,1|0,0,0]=1
5  B21R2.794740  O=C(O)CC1=CC(=C(C(=C1)I)OC2=CC=C(C=C2)O)I MCULE-4865110331 [2,0,0,0,0,0|0,0,0]=2
6  B23R2.121472824  N[C@@H](CO)CC1=CC(=C(C=C1)OC2=CC(=C(C(=C2)I)O)I)I MCULE-5207067147 [1,1,0,0,0,0|1,0,1]=4
7  B25R2.511144961  NC(CC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I)C(=O)O MCULE-5870225988 [0,1,0,0,0,1|0,0,0]=2
8  B25R2.511144961  NC(CC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I)C(=O)[O-] MCULE-4039377986 [0,1,0,0,0,1|0,0,1]=3
9  B25R2.511144961  N[C@@H](CC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I)C(=O)O MCULE-8611691549 [0,1,0,0,0,1|0,0,0]=2
10  B25R2.511144961  N[C@@H](CC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I)C(=O)O MCULE-8703089369 [0,1,0,0,0,1|0,0,0]=2
11  B25R2.511144961  N[C@@H](CC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I)C(=O)[O-] MCULE-3345050161 [0,1,0,0,0,1|0,0,1]=3
12  B25R2.511144961  N[C@@H](CC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I)C(=O)[O-] MCULE-4182060336 [0,1,0,0,0,1|0,0,1]=3
13  B25R2.511144961  N[C@H](CC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I)C(=O)O MCULE-2953264073 [0,1,0,0,0,1|0,0,0]=2
14  B25R2.511144961  N[C@H](CC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I)C(=O)O MCULE-5308768589 [0,1,0,0,0,1|0,0,0]=2
15  B25R2.511144961  N[C@H](CC1=CC(=C(C(=C1)I)OC2=CC(=C(C(=C2)I)O)I)I)C(=O)[O-] MCULE-1173589699 [0,1,0,0,0,1|0,0,1]=3
16  B21R2.361002  O=C(O)C1=CC(=C(C(=C1)I)OC2=CC(=C(C=C2)O)I)I MCULE-7719504166 [1,0,0,0,1,0|0,0,0]=2
17  B23R2.11808491  O=C(O)CCC1=CC(=C(C(=C1)I)OC2=CC(=C(C=C2)O)I)I MCULE-8440912897 [1,0,0,0,0,1|0,0,0]=2