0  B13R1.45  c1cc(cnc1)C(=O)NCC(=O)O XAA1010 [1,0,0,0,0,0|2,0,0]=3
1  B14R1.415  C[C@@H](C(=O)O)NC(=O)c1ccccc1 BAA0027 [1,1,0,0,0,0|1,0,0]=3
2  B14R1.415  C[C@H](C(=O)O)NC(=O)c1ccccc1 BAA0026 [1,1,0,0,0,0|1,0,0]=3
3  B14R2.2  c1ccc2c(c1)c(c[nH]2)CC(=O)O HAA8130 [0,0,0,1,1,0|2,0,0]=4
4  B16R2.36  c1ccc2c(c1)c(c[nH]2)CCCC(=O)O HAA8140 [0,0,0,1,0,1|2,0,0]=4
5  B16R2.12  c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N HAA1136 [0,1,0,1,0,0|2,0,0]=4
6  B16R2.12  c1ccc2c(c1)c(c[nH]2)C[C@H](C(=O)O)N HAA1057 [0,1,0,1,0,0|2,0,0]=4
7  B12R1.107  c1ccc(cc1)C(CC(=O)O)N HAA2740 [1,0,0,0,1,0|1,0,1]=4
8  B12R1.107  c1ccc(cc1)C(CC(=O)O)N HAA2745 [1,0,0,0,1,0|1,0,1]=4
9  B12R1.107  c1ccc(cc1)[C@@H](CC(=O)O)N HAA8710 [1,0,0,0,1,0|1,0,1]=4
10  B12R1.107  c1ccc(cc1)[C@H](CC(=O)O)N HAA8740 [1,0,0,0,1,0|1,0,1]=4