0  B12R1.43  N[C@@H](Cc1ccccc1)C(=O)O 63-91-2 [0,0,1,0,0,0|0,0,2]=3
1  B12R1.43  O=C(O)C(=O)CC1=CC=CC=C1 156-06-9 [0,0,1,0,0,0|1,0,1]=3
2  B12R1.43  O=C(O)C(O)CC1=CC=CC=C1 828-01-3 [0,0,1,0,0,0|1,0,2]=4
3  B12R1.43  O=C(O)[C@H](O)CC1=CC=CC=C1 20312-36-1 [0,0,1,0,0,0|1,0,2]=4
4  B12R1.43  [C@H](O)(CC1=CC=CC=C1)C(=O)O 7326-19-4 [0,0,1,0,0,0|1,0,2]=4
5  B12R1.125  O=C(O)CCC1=CC=CC=C1O 495-78-3 [0,0,1,0,0,0|1,0,2]=4
6  B14R2.781  O=C(O)C1=NC2=C(C=CC=C2)C=C1 93-10-7 [0,0,0,0,0,1|0,0,1]=2
7  B11R1.91  O=C(O)CCC1=CC=CC=C1 501-52-0 [1,0,1,0,0,0|0,0,2]=4
8  B11R1.91  O=C(O)\C=C\c1ccccc1 140-10-3 [1,0,1,0,0,0|0,0,0]=2
9  B13R1.133  N[C@@H](Cc1ccc(O)cc1)C(=O)O 60-18-4 [0,1,1,0,0,0|0,0,2]=4
10  B13R1.133  O=C(O)C(=O)CC1=CC=C(O)C=C1 156-39-8 [0,1,1,0,0,0|1,0,1]=4
11  B15R2.627  O=C(O)c1ccc2ccccc2c1O 86-48-6 [0,1,0,0,0,1|1,0,0]=3
12  B15R2.14951  O=C(O)C1=CC(=O)C2=CC=CC=C2N1 492-27-3 [0,1,0,0,0,1|0,0,0]=2
13  B11R1.36  O=C(O)C(O)C1=CC=CC=C1 611-71-2 [0,0,1,0,1,0|1,0,1]=4
14  B11R1.36  O=C(O)[C@@H](O)C1=CC=CC=C1 90-64-2 [0,0,1,0,1,0|1,0,1]=4
15  B11R1.86  O=C(O)CC1=CC=CC=C1O 614-75-5 [0,0,1,0,1,0|1,0,1]=4