0 B8R0.4 CCCCCCCSC CSC000033844 [0,0,0,0,0,0|3,0,0]=3 1 B8R0.4 CCCCCCSCC CSC000073868 [0,0,0,0,0,0|1,1,1]=3 2 B8R0.4 CCCCCSCCO CSC011215970 [0,0,0,0,0,0|2,0,2]=4 3 B8R0.4 CCCCSCCCC CSC000025195 [0,0,0,0,0,0|3,0,1]=4 4 B8R0.4 CSCCCCCCO CSC012179070 [0,0,0,0,0,0|2,0,2]=4 5 B8R0.4 CSCCCCCSC CSC009866234 [0,0,0,0,0,0|4,0,0]=4 6 B9R0.2 CCC=CCCOC(=O)C CSC015190845 [0,1,0,0,0,0|0,0,2]=3 7 B9R0.2 CCCCCCCC(=O)N CSC011216093 [0,1,0,0,0,0|1,0,0]=2 8 B9R0.2 CCCCCCOC(=O)C CSC000032130 [0,1,0,0,0,0|0,0,0]=1 9 B9R0.2 CCOCCCNC(=O)C CSC000161218 [0,1,0,0,0,0|2,0,0]=3 10 B9R0.5 CCCCCC(=O)OCC CSC000170156 [0,1,0,0,0,0|1,0,2]=4 11 B9R0.45 CCCCCCSCCO CSC011304839 [0,1,0,0,0,0|0,1,2]=4 12 B9R0.45 CCCCSCCOCC CSC000053094 [0,1,0,0,0,0|1,0,1]=3 13 B9R0.45 CCSCCCCSCC CSC000116838 [0,1,0,0,0,0|1,1,1]=4 14 B9R0.45 CSCCCCCCSC CSC000036278 [0,1,0,0,0,0|3,0,0]=4 15 B9R0.46 CCCCCCC(=O)NN CSC011221127 [0,1,0,0,0,0|3,0,0]=4 16 B9R0.46 CCCCCCC(=O)OC CSC011215249 [0,1,0,0,0,0|3,0,0]=4 17 B8R0.7 CCCCSCC(=C)C CSC000026947 [1,1,0,0,0,0|2,0,0]=4 18 B10R0.4 CC(=O)OCCCCCC=C CSC000037147 [0,2,0,0,0,0|0,0,1]=3 19 B10R0.4 CCCCCCCNC(=O)C CSC009862821 [0,2,0,0,0,0|1,0,0]=3 20 B10R0.4 CCCCCCCNC(=O)N CSC009878357 [0,2,0,0,0,0|1,0,0]=3 21 B10R0.4 CCCCCCCOC(=O)C CSC000036323 [0,2,0,0,0,0|0,0,0]=2 22 B10R0.4 CCCCOCCOC(=O)C CSC000032999 [0,2,0,0,0,0|0,0,0]=2 23 B10R0.4 COCCOCCOC(=O)C CSC000062832 [0,2,0,0,0,0|1,0,0]=3 24 B10R0.22 CCCCCCNS(=O)(=O)C CSC000171105 [0,2,0,0,0,0|2,0,0]=4 25 B10R0.74 CCC=CCCOC(=O)CC CSC020656764 [0,2,0,0,0,0|0,0,2]=4 26 B10R0.74 CCCCCCCC(=O)NN CSC000181853 [0,2,0,0,0,0|1,0,0]=3 27 B10R0.74 CCCCCCCC(=O)OC CSC011217195 [0,2,0,0,0,0|1,0,0]=3 28 B10R0.74 CCCCCCNC(=O)NC CSC000235370 [0,2,0,0,0,0|1,0,0]=3 29 B10R0.74 CCOCCCNC(=O)CC CSC000161224 [0,2,0,0,0,0|2,0,0]=4 30 B10R0.75 CCCCCNC(=O)C(=O)N CSC048324000 [0,2,0,0,0,0|2,0,0]=4 31 B10R0.97 CC(=O)OCCCOC(=O)C CSC000018353 [0,2,0,0,0,0|1,0,1]=4 32 B10R0.97 CC(C)OCCCNC(=O)C CSC000161839 [0,2,0,0,0,0|2,0,0]=4 33 B10R0.1 CCCCCCC(=O)OCC CSC011219609 [0,2,0,0,0,0|1,0,1]=4 34 B10R0.91 CCCCCC(=O)OCC=C CSC000006420 [0,2,0,0,0,0|1,0,1]=4 35 B10R0.71 CCCCSCCOCCO CSC011409991 [0,2,0,0,0,0|0,0,2]=4 36 B10R1.18 CC(=O)CN1CCCCC1 CSC000180294 [0,1,0,1,0,0|2,0,0]=4 37 B10R1.18 CC(=O)NC1CCCCC1 CSC000158227 [0,1,0,1,0,0|1,0,0]=3 38 B10R1.18 CC(=O)NC1CCCOC1 CSC011884898 [0,1,0,1,0,0|2,0,0]=4 39 B10R1.18 CC(=O)NC1CCSCC1 CSC011670947 [0,1,0,1,0,0|2,0,0]=4 40 B10R1.18 CC(=O)OC1CCCCC1 CSC000026541 [0,1,0,1,0,0|0,0,0]=2 41 B10R1.18 NC(=O)CC1CCCCO1 CSC000725203 [0,1,0,1,0,0|2,0,0]=4 42 B10R1.18 NC(=O)OC1CCCCC1 CSC000123476 [0,1,0,1,0,0|0,0,0]=2 43 B10R1.39 CC(=O)N1CCCC1CN CSC000706156 [0,1,0,1,0,0|2,0,0]=4 44 B10R1.39 CC(=O)N1CCCC1CO CSC011474066 [0,1,0,1,0,0|2,0,0]=4 45 B10R1.39 CC(=O)N1CCC[C@H]1CO CSC012003343 [0,1,0,1,0,0|2,0,0]=4 46 B10R1.39 CCC1CCCN1C(=O)N CSC011386413 [0,1,0,1,0,0|1,0,0]=3 47 B10R1.39 CCC1NCCC1C(=O)N CSC015706231 [0,1,0,1,0,0|2,0,0]=4 48 B10R1.39 CCN1CCC[C@H]1C(=O)N CSC015708101 [0,1,0,1,0,0|2,0,0]=4 49 B10R1.61 CC1CCCCN1C(=O)N CSC000238911 [0,1,0,1,0,0|1,0,0]=3 50 B10R1.61 CC1CNCCN1C(=O)C CSC011725993 [0,1,0,1,0,0|2,0,0]=4 51 B10R1.61 CC1CSCCN1C(=O)N CSC011976846 [0,1,0,1,0,0|2,0,0]=4 52 B10R1.61 CC1NCCCC1C(=O)N CSC012079615 [0,1,0,1,0,0|2,0,0]=4 53 B10R1.61 CC1OCCCC1C(=O)N CSC016159393 [0,1,0,1,0,0|2,0,0]=4 54 B10R1.61 C[C@@H]1CNCCN1C(=O)C CSC012025876 [0,1,0,1,0,0|2,0,0]=4 55 B10R1.61 C[C@@H]1COCCN1C(=O)C CSC014106315 [0,1,0,1,0,0|2,0,0]=4 56 B10R1.61 C[C@H]1CNCCN1C(=O)C CSC012025909 [0,1,0,1,0,0|2,0,0]=4 57 B10R1.64 CC1OCCC1NC(=O)C CSC013100664 [0,1,0,1,0,0|2,0,0]=4 58 B10R1.66 CC(=O)NCC1CCCN1 CSC011696608 [0,1,0,1,0,0|2,0,0]=4 59 B10R1.66 CC(=O)NCC1CCCO1 CSC000158280 [0,1,0,1,0,0|2,0,0]=4 60 B10R1.66 CC(=O)NCC1CCSC1 CSC014215000 [0,1,0,1,0,0|2,0,0]=4 61 B10R1.66 CC(=O)OCC1CCCO1 CSC000006207 [0,1,0,1,0,0|1,0,0]=3 62 B10R1.66 NC(=O)CCC1CCCC1 CSC000162258 [0,1,0,1,0,0|1,0,0]=3 63 B10R1.66 NC(=O)COC1CCCC1 CSC011347441 [0,1,0,1,0,0|2,0,0]=4 64 B10R1.348 CC(=O)N1CCCCCC1 CSC000157747 [0,1,0,1,0,0|1,0,0]=3 65 B10R1.348 NC(=O)C1CCCCCC1 CSC011707493 [0,1,0,1,0,0|1,0,0]=3 66 B10R1.29 CCCSC1CCOC1C CSC015237125 [0,1,0,1,0,0|1,0,1]=4 67 B10R1.17 CCCCN1CCOCC1 CSC000224583 [0,1,0,1,0,0|1,0,1]=4 68 B10R1.17 CCCNC1CCOCC1 CSC000714517 [0,1,0,1,0,0|1,0,1]=4 69 B10R1.149 CCN(C)C1CCNC1=O CSC047215055 [0,1,0,1,0,0|2,0,0]=4