0 B12R1.1618 CCOC(=O)CC1(OCCO1)C TS45754 [0,0,0,0,0,0|0,0,0]=0 1 B11R1.30 CCOC(=O)C=C1CCCO1 TS10672 [1,0,0,0,0,0|1,0,2]=4 2 B11R1.30 CCOC(=O)CC1CCCO1 TS10985 [1,0,0,0,0,0|1,0,0]=2 3 B11R1.30 CCOC(=O)CC1CCNC1 TS85941 [1,0,0,0,0,0|3,0,0]=4 4 B11R1.30 CCOC(=O)CN1CCCC1 TS10877 [1,0,0,0,0,0|3,0,0]=4 5 B13R1.2583 CCOC(=O)CC1(OCC(O1)C)C TS50725 [0,1,0,0,0,0|0,0,0]=1 6 B11R0.354 CCOC(=O)CP(=O)(OC)OC TS53604 [0,0,1,0,0,0|2,0,0]=3 7 B13R2.3433 CC1(OCCO1)C2CCOC2=O TS45431 [0,0,0,1,0,0|0,0,0]=1 8 B11R1.819 CCOC(=O)C1(CCCC1)O TS10981 [0,0,0,0,1,0|3,0,0]=4 9 B11R1.840 CCOC(=O)CC1(COC1)N TS92183 [0,0,0,0,1,0|3,0,0]=4 10 B13R1.2570 CCOC(=O)CC1(CCCCC1)O TS16815 [0,0,0,0,0,1|3,0,0]=4 11 B10R0.1 CCCCCCC(=O)OCC TS11034 [1,0,1,0,0,0|2,0,0]=4 12 B10R0.1 CCOC(=O)CCCCCBr TS50270 [1,0,1,0,0,0|2,0,0]=4 13 B10R0.1 CCOC(=O)CCCCCN TS53584 [1,0,1,0,0,0|2,0,0]=4 14 B10R0.1 CCOC(=O)CCCCCO TS11263 [1,0,1,0,0,0|1,0,0]=3 15 B10R0.1 CCOC(=O)CCCCC[Zn+] TS57978 [1,0,1,0,0,0|2,0,0]=4 16 B10R0.2 CCCC(CC(=O)OCC)O TS11265 [1,0,1,0,0,0|1,0,0]=3 17 B10R0.2 CCOC(=CC(=O)OCC)C TS41894 [1,0,1,0,0,0|0,0,2]=4 18 B10R0.2 CCOC(=CC(=O)OCC)C TS41908 [1,0,1,0,0,0|0,0,2]=4 19 B10R0.2 CCOC(=N)CC(=O)OCC TS64888 [1,0,1,0,0,0|1,0,1]=4 20 B10R0.2 CCOC(=O)CC(=O)OCC TS42278 [1,0,1,0,0,0|0,0,2]=4 21 B10R0.2 CCOC(=O)CC(=O)OCC TS74525 [1,0,1,0,0,0|0,0,2]=4 22 B10R0.134 COC(=O)CP(=O)(OC)OC TS48187 [1,0,1,0,0,0|2,0,0]=4 23 B10R1.216 CC1(OCCO1)CCCCl TS11954 [2,0,0,0,0,0|1,0,1]=4 24 B12R1.318 CCOC(=O)CC1CCCC1=O TS64887 [1,1,0,0,0,0|2,0,0]=4 25 B12R1.3395 CCOC(=O)C1(CCCC1)CN TS45336 [0,1,0,0,1,0|2,0,0]=4 26 B12R1.32 CCOC(=O)CC1CCCCC1 TS94714 [0,0,1,1,0,0|2,0,0]=4 27 B12R1.32 CCOC(=O)CC1CCCNC1 TS00524 [0,0,1,1,0,0|2,0,0]=4 28 B12R1.32 CCOC(=O)CC1CCCNC1 TS43373 [0,0,1,1,0,0|2,0,0]=4 29 B12R1.32 CCOC(=O)CC1CNCCO1 TS13343 [0,0,1,1,0,0|1,0,0]=3 30 B12R1.32 CCOC(=O)CC1COCCN1 TS13334 [0,0,1,1,0,0|1,0,0]=3 31 B14R2.836 CCOC(=O)C1CC12CCOCC2 TS92659 [0,0,0,1,0,1|2,0,0]=4 32 B10R0.129 CCCC(C)(C(=O)OCC)N TS11171 [0,0,1,0,1,0|2,0,0]=4 33 B10R1.11 CCOC(=O)C1CCCO1 TS64896 [1,0,0,0,1,0|1,0,0]=3 34 B10R1.11 CCOC(=O)C1SCCS1 TS47610 [1,0,0,0,1,0|0,2,0]=4 35 B10R1.11 CCOC(=O)[C@H]1CCCN1 TS14482 [1,0,0,0,1,0|2,0,0]=4 36 B10R1.411 CC1(CCCO1)C(=O)OC TS90567 [1,0,0,0,1,0|1,0,0]=3 37 B10R1.411 C[C@@]1(CCCN1)C(=O)OC TS92809 [1,0,0,0,1,0|2,0,0]=4 38 B10R1.411 C[C@]1(CCCN1)C(=O)OC TS92126 [1,0,0,0,1,0|2,0,0]=4 39 B10R1.401 CCOC(=O)C1(CCC1)N TS06862 [0,0,0,0,2,0|2,0,0]=4 40 B10R1.401 CCOC(=O)C1(CCC1)N TS47801 [0,0,0,0,2,0|2,0,0]=4 41 B12R0.101 CCCCC(C)CCC(=O)OCC TS48956 [0,0,1,0,0,1|2,0,0]=4 42 B12R1.51 CCCC(=O)OCC1CCCO1 TS13186 [1,0,0,0,0,1|2,0,0]=4 43 B12R1.1595 CCOC(=O)C1(CCCNC1)C TS55925 [0,0,0,0,1,1|2,0,0]=4 44 B12R1.1595 CCOC(=O)C1(CCNCC1)C TS55943 [0,0,0,0,1,1|2,0,0]=4