0 B11R1.509 O=S(=O)(O)NC1CCCCC1 T0941 [0,1,0,0,0,0|2,0,0]=3 1 B9R0.2 CC(=O)NCCCCCN T5222 [0,0,1,0,0,0|3,0,0]=4 2 B9R0.2 CCCCCCCC(=O)O T3946 [0,0,1,0,0,0|0,0,0]=1 3 B9R0.2 CCCCC\C=C\C(=O)O T5261 [0,0,1,0,0,0|0,0,2]=3 4 B9R1.6 O=C(O)C1=CCCNC1 T7557 [0,0,0,0,1,0|1,0,2]=4 5 B9R1.6 O=C(O)C1=CCCNC1 TN1717 [0,0,0,0,1,0|1,0,2]=4 6 B9R1.6 O=C(O)C1=CCNCC1 T11684 [0,0,0,0,1,0|1,0,2]=4 7 B9R1.6 O=C(O)C1CCCCC1 T5563 [0,0,0,0,1,0|0,0,0]=1 8 B9R1.6 O=C(O)C1CCCCN1 T4819 [0,0,0,0,1,0|1,0,0]=2 9 B9R1.6 O=C(O)C1CCNCC1 T22348 [0,0,0,0,1,0|1,0,0]=2 10 B9R1.6 O=C(O)[C@@H]1CCCCN1 T4762 [0,0,0,0,1,0|1,0,0]=2 11 B9R1.6 O=C(O)[C@@H]1CCCNC1 T22482 [0,0,0,0,1,0|1,0,0]=2 12 B9R1.6 O=C(O)[C@H]1CCCCN1 T13634 [0,0,0,0,1,0|1,0,0]=2 13 B8R0.4 CCCCCCCCO T10024 [1,0,1,0,0,0|0,0,1]=3 14 B8R0.7 NCCCCCC(=O)O T0881 [1,0,1,0,0,0|1,0,0]=3 15 B10R0.4 CCCCCCCCC(=O)O T3947 [0,1,1,0,0,0|0,0,0]=2 16 B10R0.4 NCCCCCCCC(=O)O T8102 [0,1,1,0,0,0|0,0,0]=2 17 B10R0.75 CCCCCCC(O)C(=O)O T7481 [0,1,1,0,0,0|0,0,0]=2 18 B10R0.75 N[C@@H](CSCCCO)C(=O)O T1481 [0,1,1,0,0,0|2,0,0]=4 19 B10R0.97 O=C(O)CCCCCC(=O)O T4795 [0,1,1,0,0,0|1,0,1]=4 20 B10R0.96 CC(CCC(=O)O)CC(=O)O T5253 [0,1,1,0,0,0|1,0,1]=4 21 B10R0.79 O=C(O)CN(CCO)CCO T22274 [0,1,1,0,0,0|2,0,0]=4 22 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CC1 T8091 [0,1,0,0,1,0|0,0,0]=2 23 B10R1.61 O=C(O)C1CCCCN1O T19458 [0,1,0,0,1,0|1,0,0]=3 24 B12R1.349 O=C(O)C[C@]1(O)CC[C@@H](O)CC1 TN2395 [0,2,0,0,0,0|0,0,0]=2 25 B12R1.3862 NCC1(CC(=O)O)CCCCC1 T0702 [0,2,0,0,0,0|0,0,0]=2 26 B12R1.3862 NCC1(CC(=O)O)CCCCC1 T6507 [0,2,0,0,0,0|0,0,0]=2 27 B10R2.71 O=C1CC2CCC(C1)N2 T1702 [0,0,0,1,1,0|2,0,0]=4 28 B8R0.8 CCCCC(O)C(=O)O T5224 [0,0,1,0,1,0|1,0,0]=3 29 B8R0.8 CCCC[C@H](N)C(=O)O T4765 [0,0,1,0,1,0|1,0,0]=3 30 B8R0.8 CSCCC(N)C(=O)O TJO2742 [0,0,1,0,1,0|2,0,0]=4 31 B8R0.8 CSCC[C@H](N)C(=O)O T4844 [0,0,1,0,1,0|2,0,0]=4 32 B8R0.8 C[Se]CCC(N)C(=O)O T1658 [0,0,1,0,1,0|2,0,0]=4 33 B8R0.8 C[Se]CC[C@H](N)C(=O)O T5372 [0,0,1,0,1,0|2,0,0]=4 34 B8R0.8 NCCC[C@@H](N)C(=O)O T0551 [0,0,1,0,1,0|2,0,0]=4 35 B8R0.8 NCCC[C@H](N)C(=O)O T0737 [0,0,1,0,1,0|2,0,0]=4 36 B8R0.8 NCCC[C@H](N)C(=O)O T2O2701 [0,0,1,0,1,0|2,0,0]=4 37 B8R1.7 O=C(O)C1CSCN1 T0221 [0,0,0,0,2,0|2,0,0]=4 38 B8R1.7 O=C(O)C1CSSC1 T10388 [0,0,0,0,2,0|2,0,0]=4 39 B8R1.7 O=C(O)[C@@H]1CCCN1 T2O2683 [0,0,0,0,2,0|1,0,0]=3 40 B8R1.7 O=C(O)[C@@H]1CCCN1 TN1593 [0,0,0,0,2,0|1,0,0]=3 41 B8R1.7 O=C(O)[C@@H]1CSCN1 T4292 [0,0,0,0,2,0|2,0,0]=4 42 B8R1.7 O=C(O)[C@H]1CCCN1 T5302 [0,0,0,0,2,0|1,0,0]=3