0 B13R0.2 C(=CCCC(=O)OCC)CCCCC MCULE-7720982156 [0,0,0,0,0,0|0,0,2]=2 1 B13R0.2 C=CCCCCCCCC(=O)OCC MCULE-7330309912 [0,0,0,0,0,0|0,0,2]=2 2 B13R0.2 C=COC(=O)CCCCCCCCC MCULE-6857715884 [0,0,0,0,0,0|0,0,2]=2 3 B13R0.2 CCCCC/C=C/CCC(=O)OCC MCULE-2528964118 [0,0,0,0,0,0|0,0,2]=2 4 B13R0.2 CCCCC/C=C\C=C\C(=O)OCC MCULE-3578089676 [0,0,0,0,0,0|0,0,4]=4 5 B13R0.2 CCCCCC=CC=CC(=O)OCC MCULE-6246344331 [0,0,0,0,0,0|0,0,4]=4 6 B13R0.2 CCCCCCC/C=C/C(=O)OCC MCULE-9821388261 [0,0,0,0,0,0|0,0,2]=2 7 B13R0.2 CCCCCCCC=CC(=O)OCC MCULE-8496462023 [0,0,0,0,0,0|0,0,2]=2 8 B13R0.2 CCCCCCCCC/C(=C/CBr)/C MCULE-3162465870 [0,0,0,0,0,0|3,0,0]=3 9 B13R0.2 CCCCCCCCCC(=O)CCC MCULE-7843912102 [0,0,0,0,0,0|1,0,0]=1 10 B13R0.2 CCCCCCCCCC(=O)OCC MCULE-9201389917 [0,0,0,0,0,0|0,0,0]=0 11 B13R0.2 CCCCCCCCCC(=O)OCCl MCULE-4204116817 [0,0,0,0,0,0|1,0,0]=1 12 B13R0.2 CCCCCCCCCC(=O)OCI MCULE-3516770567 [0,0,0,0,0,0|1,0,0]=1 13 B13R0.2 CCCCCCCCCC(C)CCBr MCULE-9823733593 [0,0,0,0,0,0|3,0,1]=4 14 B13R0.2 CCCCCCCCCC(O)CCO MCULE-6275560025 [0,0,0,0,0,0|2,0,2]=4 15 B13R0.2 CCCCCCCCNC(=O)CC#N MCULE-2816658013 [0,0,0,0,0,0|3,0,1]=4 16 B13R0.2 CCCCCCCCOC(=O)CC#N MCULE-4816511178 [0,0,0,0,0,0|3,0,1]=4 17 B13R0.2 CCCCCCCCOC(=O)CCC MCULE-8890710257 [0,0,0,0,0,0|2,0,0]=2 18 B13R0.2 CCCCCCNCCC(=O)OCC MCULE-8059203538 [0,0,0,0,0,0|1,0,0]=1 19 B13R0.2 CCOC(=O)CCCCCCCCBr MCULE-7199679649 [0,0,0,0,0,0|1,0,0]=1 20 B13R0.2 CCOC(=O)CCCCCCN=N#N MCULE-8321573793 [0,0,0,0,0,0|3,0,0]=3 21 B13R0.2 CCOC(=O)CCOCCOCCO MCULE-8136577453 [0,0,0,0,0,0|3,0,0]=3 22 B13R0.2 CCOCCCNCCC(=O)OCC MCULE-5907720522 [0,0,0,0,0,0|2,0,0]=2 23 B12R0.1 C=CCCCCCCC(=O)OCC MCULE-2529046007 [1,0,0,0,0,0|0,0,2]=3 24 B12R0.1 CCCCCC=CCC(=O)OCC MCULE-2452505052 [1,0,0,0,0,0|0,0,2]=3 25 B12R0.1 CCCCCCC#CC(=O)OCC MCULE-9938881189 [1,0,0,0,0,0|0,0,2]=3 26 B12R0.1 CCCCCCC=CC(=O)OCC MCULE-4260025223 [1,0,0,0,0,0|0,0,2]=3 27 B12R0.1 CCCCCCCCC(=O)NCO MCULE-9330858839 [1,0,0,0,0,0|2,0,0]=3 28 B12R0.1 CCCCCCCCC(=O)OCC MCULE-5309868306 [1,0,0,0,0,0|0,0,0]=1 29 B12R0.1 CCCCCCCCC(=O)OCCl MCULE-7482672748 [1,0,0,0,0,0|1,0,0]=2 30 B12R0.1 CCCCCCCCC(C)CCC MCULE-8337776414 [1,0,0,0,0,0|2,0,1]=4 31 B12R0.1 CCCCCCCCC(O)CCC MCULE-4193341089 [1,0,0,0,0,0|1,0,2]=4 32 B12R0.1 CCCCCCCCS(=O)CCCl MCULE-5342861128 [1,0,0,0,0,0|3,0,0]=4 33 B12R0.1 CCCCCCCCS(=O)CCO MCULE-7963242650 [1,0,0,0,0,0|3,0,0]=4 34 B12R0.1 CCCCCCCOC(=O)CCC MCULE-5390225657 [1,0,0,0,0,0|2,0,0]=3 35 B12R0.1 CCCCCNCCC(=O)OCC MCULE-6006388312 [1,0,0,0,0,0|1,0,0]=2 36 B12R0.1 CCCCOCCOC(=O)CCC MCULE-5623408620 [1,0,0,0,0,0|3,0,0]=4 37 B12R0.1 CCNC(=O)CCNCCCOC MCULE-4505097554 [1,0,0,0,0,0|3,0,0]=4 38 B12R0.1 CCOC(=O)CCCCCCCBr MCULE-8678920768 [1,0,0,0,0,0|1,0,0]=2 39 B12R0.1 CCOC(=O)CCCCCCCCl MCULE-8377860069 [1,0,0,0,0,0|1,0,0]=2 40 B12R0.1 CCOC(=O)CCCCCCCI MCULE-5677306490 [1,0,0,0,0,0|1,0,0]=2 41 B12R0.1 CCOC(=O)CCCCCCCN MCULE-2162819446 [1,0,0,0,0,0|1,0,0]=2 42 B12R0.1 CCOC(=O)CCCCCCCN MCULE-4046698936 [1,0,0,0,0,0|1,0,0]=2 43 B12R0.1 CCOC(=O)CCCCCCCO MCULE-3311157136 [1,0,0,0,0,0|1,0,0]=2 44 B12R0.1 CCOC(=O)CCCCCN=C=O MCULE-6504190833 [1,0,0,0,0,0|2,0,1]=4 45 B12R0.1 CCOC(=O)CCCCCN=N#N MCULE-6831574976 [1,0,0,0,0,0|3,0,0]=4 46 B12R0.1 CCOC(=O)CCNCCCOC MCULE-1490737085 [1,0,0,0,0,0|2,0,0]=3 47 B12R0.1 CCOCCNCCC(=O)OCC MCULE-8716932397 [1,0,0,0,0,0|2,0,0]=3 48 B12R0.5 C=COCCCCCCCCCC MCULE-9853638067 [1,0,0,0,0,0|0,0,3]=4 49 B12R0.5 CC/C=C\CCCCCCCCO MCULE-3025560116 [1,0,0,0,0,0|2,0,0]=3 50 B12R0.5 CCC#CCCCCCCCCO MCULE-9432389600 [1,0,0,0,0,0|2,0,1]=4 51 B12R0.5 CCC/C=C\CCCCCCCO MCULE-1596799446 [1,0,0,0,0,0|2,0,1]=4 52 B12R0.5 CCC=CCCCCCCCCO MCULE-1639369196 [1,0,0,0,0,0|2,0,0]=3 53 B12R0.5 CCCC=CCCCCCCCO MCULE-6437929263 [1,0,0,0,0,0|2,0,1]=4 54 B12R0.5 CCCCCCCCC/C=C/C=O MCULE-3924650225 [1,0,0,0,0,0|2,0,1]=4 55 B12R0.5 CCCCCCCCC/C=C/CO MCULE-8437286382 [1,0,0,0,0,0|2,0,0]=3 56 B12R0.5 CCCCCCCCC=CCCO MCULE-1965044026 [1,0,0,0,0,0|2,0,1]=4 57 B12R0.5 CCCCCCCCCC#CCO MCULE-3667812839 [1,0,0,0,0,0|2,0,1]=4 58 B12R0.5 CCCCCCCCCC=CC=O MCULE-6984246846 [1,0,0,0,0,0|2,0,1]=4 59 B12R0.5 CCCCCCCCCC=CCO MCULE-9263380318 [1,0,0,0,0,0|2,0,0]=3 60 B12R0.5 CCCCCCCCCCCCBr MCULE-2442495006 [1,0,0,0,0,0|2,0,1]=4 61 B12R0.5 CCCCCCCCCCCCC MCULE-7749861366 [1,0,0,0,0,0|1,0,1]=3 62 B12R0.5 CCCCCCCCCCCCCl MCULE-6025385532 [1,0,0,0,0,0|2,0,1]=4 63 B12R0.5 CCCCCCCCCCCCF MCULE-3563531940 [1,0,0,0,0,0|2,0,1]=4 64 B12R0.5 CCCCCCCCCCCCI MCULE-6449418786 [1,0,0,0,0,0|2,0,1]=4 65 B12R0.5 CCCCCCCCCCCCN MCULE-1282419209 [1,0,0,0,0,0|2,0,1]=4 66 B12R0.5 CCCCCCCCCCCCN MCULE-1312431857 [1,0,0,0,0,0|2,0,1]=4 67 B12R0.5 CCCCCCCCCCCCN MCULE-3936839656 [1,0,0,0,0,0|2,0,1]=4 68 B12R0.5 CCCCCCCCCCCCN MCULE-8497998841 [1,0,0,0,0,0|2,0,1]=4 69 B12R0.5 CCCCCCCCCCCCN MCULE-9101484482 [1,0,0,0,0,0|2,0,1]=4 70 B12R0.5 CCCCCCCCCCCCO MCULE-3423087499 [1,0,0,0,0,0|2,0,1]=4 71 B12R0.5 CCCCCCCCCCCCO MCULE-9381688904 [1,0,0,0,0,0|2,0,1]=4 72 B12R0.5 CCCCCCCCCCCCS MCULE-8388213802 [1,0,0,0,0,0|2,0,1]=4 73 B12R0.5 CCCCCCCCCCCNC MCULE-4232799137 [1,0,0,0,0,0|2,0,1]=4 74 B12R0.5 CCCCCCCCCCCNC MCULE-9324463288 [1,0,0,0,0,0|2,0,1]=4 75 B12R0.5 CCCCCCCCCCSCC MCULE-4046728399 [1,0,0,0,0,0|0,1,1]=3 76 B12R0.5 CCCCCCCCCSCCO MCULE-1890346670 [1,0,0,0,0,0|3,0,0]=4 77 B12R0.5 CCCCCCCCNCCCC MCULE-6370859761 [1,0,0,0,0,0|2,0,1]=4 78 B12R0.5 CCCCCCNCCCCCC MCULE-3670409724 [1,0,0,0,0,0|2,0,1]=4 79 B12R0.5 CCCCCCNCCCCCC MCULE-4867029659 [1,0,0,0,0,0|2,0,1]=4 80 B12R0.5 CCCCCCNCCCCCC MCULE-9932038203 [1,0,0,0,0,0|2,0,1]=4 81 B12R0.5 CCCCCCOCCCCCC MCULE-3976538682 [1,0,0,0,0,0|2,0,1]=4 82 B12R0.5 CCCCCCSCCCCCC MCULE-2928486782 [1,0,0,0,0,0|2,0,1]=4 83 B12R0.5 CCCCNCCOCCOCC MCULE-4895739563 [1,0,0,0,0,0|2,0,1]=4 84 B12R0.5 CCCCOCCOCCOCC MCULE-6182503793 [1,0,0,0,0,0|2,0,1]=4 85 B12R0.5 CCCOCCCCCCCCO MCULE-6159515912 [1,0,0,0,0,0|3,0,0]=4 86 B12R0.5 CCOCCCCCCCCCBr MCULE-4453801533 [1,0,0,0,0,0|1,0,1]=3 87 B12R0.5 CCOCCCCCCCCCO MCULE-6343777651 [1,0,0,0,0,0|1,0,1]=3 88 B12R0.5 [NH2+](CCCC)CCCCCCCC MCULE-9696707679 [1,0,0,0,0,0|2,0,1]=4 89 B12R0.248 C=CC(=O)NCCCCCCCC MCULE-9686941876 [1,0,0,0,0,0|1,0,2]=4 90 B12R0.248 C=CC(=O)OCCCCCCCC MCULE-8708207271 [1,0,0,0,0,0|1,0,2]=4 91 B12R0.248 C=CCCCCCCCC(=O)OC MCULE-1843303649 [1,0,0,0,0,0|0,0,2]=3 92 B12R0.248 CCCCCCCCC/C(=N\O)/N MCULE-5582103663 [1,0,0,0,0,0|3,0,0]=4 93 B12R0.248 CCCCCCCCCC(=O)CC MCULE-8070056231 [1,0,0,0,0,0|0,0,0]=1 94 B12R0.248 CCCCCCCCCC(=O)NC MCULE-5903490737 [1,0,0,0,0,0|1,0,0]=2 95 B12R0.248 CCCCCCCCCC(=O)NN MCULE-5225093755 [1,0,0,0,0,0|2,0,0]=3 96 B12R0.248 CCCCCCCCCC(=O)NO MCULE-3922115888 [1,0,0,0,0,0|2,0,0]=3 97 B12R0.248 CCCCCCCCCC(=O)OC MCULE-3080392178 [1,0,0,0,0,0|0,0,0]=1 98 B12R0.248 CCCCCCCCCC(O)CC MCULE-8088841540 [1,0,0,0,0,0|0,0,2]=3 99 B12R0.248 CCCCCCCCCC(O)CO MCULE-3958170897 [1,0,0,0,0,0|1,0,2]=4 100 B12R0.248 CCCCCCCCCC([NH3+])CO MCULE-4329139225 [1,0,0,0,0,0|2,0,1]=4 101 B12R0.248 CCCCCCCCCC([NH3+])CO MCULE-6424120612 [1,0,0,0,0,0|2,0,1]=4 102 B12R0.248 CCCCCCCCNC(=O)CCl MCULE-4427362960 [1,0,0,0,0,0|2,0,0]=3 103 B12R0.248 CCCCCCCCOC(=O)CBr MCULE-6221987137 [1,0,0,0,0,0|2,0,0]=3 104 B12R0.248 CCCCCCCCOC(=O)CC MCULE-3871560069 [1,0,0,0,0,0|1,0,0]=2 105 B12R0.248 CCCCCCCCOC(=O)CCl MCULE-4822709810 [1,0,0,0,0,0|2,0,0]=3 106 B12R0.248 CCCCCCCCOC(=O)CN MCULE-1232197423 [1,0,0,0,0,0|2,0,0]=3 107 B12R0.248 CCCCCCCCOC(=O)CN MCULE-3856902884 [1,0,0,0,0,0|2,0,0]=3 108 B12R0.248 CCCCCCCCOC(=O)CS MCULE-8976044992 [1,0,0,0,0,0|2,0,0]=3 109 B12R0.248 CCCCCCCSCC(=O)OC MCULE-8419218207 [1,0,0,0,0,0|1,0,0]=2 110 B12R0.248 CNCCCCCCCC(=O)OC MCULE-2073535841 [1,0,0,0,0,0|1,0,0]=2 111 B12R0.248 COC(=O)CCCCCCCC=O MCULE-8962678443 [1,0,0,0,0,0|1,0,1]=3 112 B12R0.248 COC(=O)CCCCCCCCBr MCULE-8360143365 [1,0,0,0,0,0|1,0,0]=2 113 B12R0.248 COC(=O)CCCCCCCCO MCULE-5867988584 [1,0,0,0,0,0|1,0,0]=2 114 B12R0.248 COC(=O)CCCCCCN=N#N MCULE-3237572469 [1,0,0,0,0,0|3,0,0]=4 115 B12R0.248 COC(=O)CCOCCOCCO MCULE-8679120721 [1,0,0,0,0,0|3,0,0]=4 116 B14R0.1 CCCC(=O)CCCCCC(=O)OCC MCULE-1852332395 [0,1,0,0,0,0|0,0,1]=2 117 B14R0.1 CCOC(=O)CCCCCC(=O)OCC MCULE-3418863099 [0,1,0,0,0,0|1,0,1]=3 118 B14R0.1 CCOC(=O)CCCSCC(=O)OCC MCULE-8019807116 [0,1,0,0,0,0|2,0,1]=4 119 B14R0.1 CCOC(=O)CCNCCC(=O)OCC MCULE-5996883020 [0,1,0,0,0,0|2,0,1]=4 120 B14R0.1 CCOC(=O)CCSCCC(=O)OCC MCULE-1688160765 [0,1,0,0,0,0|2,0,1]=4 121 B14R0.32 CCOC(=O)CCCCCCC(=O)CC MCULE-6411623459 [0,1,0,0,0,0|0,0,1]=2 122 B14R0.73 CCCCCCCC(=O)CC(=O)OCC MCULE-4555181327 [0,1,0,0,0,0|0,0,1]=2 123 B14R0.73 CCCCCCCC(O)CC(=O)OCC MCULE-1244067150 [0,1,0,0,0,0|0,0,0]=1 124 B14R0.73 CCOCCOCC(=O)CC(=O)OCC MCULE-4863569955 [0,1,0,0,0,0|2,0,1]=4 125 B14R0.83 CCCCCCCCC(Br)C(=O)OCC MCULE-1967939137 [0,1,0,0,0,0|0,0,0]=1 126 B14R0.83 CCCCCCCCC(C)C(=O)OCC MCULE-3079375751 [0,1,0,0,0,0|0,0,0]=1 127 B14R0.83 CCOC(=O)C(=O)CCCCCCC#N MCULE-6558982302 [0,1,0,0,0,0|1,0,2]=4 128 B14R0.83 CCOC(=O)C(C)CCCCCCCN MCULE-3981835582 [0,1,0,0,0,0|1,0,0]=2 129 B14R0.163 CCCCC(=O)CCCCC(=O)OCC MCULE-2371747046 [0,1,0,0,0,0|0,0,1]=2 130 B14R0.181 CCCCCCCCCC(=O)C(N)CO MCULE-1931483192 [0,1,0,0,0,0|2,0,0]=3 131 B14R0.181 CCCCCCCCCC(=O)C(N)CO MCULE-6322014235 [0,1,0,0,0,0|2,0,0]=3 132 B14R0.181 CCCCCCCCCC(=O)C(O)CC MCULE-1818366635 [0,1,0,0,0,0|1,0,0]=2 133 B14R0.181 CCCCCCCCCC(=O)N(C)N=O MCULE-5339672002 [0,1,0,0,0,0|3,0,0]=4 134 B14R0.199 CCCCCCC(=O)CCC(=O)OCC MCULE-8046058651 [0,1,0,0,0,0|0,0,1]=2 135 B14R0.199 CCOC(=O)CCC(=O)OCCCCO MCULE-4228679604 [0,1,0,0,0,0|2,0,1]=4 136 B14R0.391 CCCCCCCCCC(=O)OC(C)C MCULE-7099041092 [0,1,0,0,0,0|0,0,0]=1 137 B14R0.391 CCCCCCCCOC(=O)CC(=O)C MCULE-8441732366 [0,1,0,0,0,0|2,0,1]=4 138 B14R0.393 C=CCCCCCCCCC(=O)OC=C MCULE-6691284845 [0,1,0,0,0,0|0,0,3]=4 139 B14R0.393 C=CCCCCCCCCC(=O)OCC MCULE-8561484163 [0,1,0,0,0,0|0,0,1]=2 140 B14R0.393 CCCCCCCCC#CC(=O)OCC MCULE-1422889109 [0,1,0,0,0,0|0,0,1]=2 141 B14R0.393 CCCCCCCCCCC(=O)OCC MCULE-7345568612 [0,1,0,0,0,0|0,0,0]=1 142 B14R0.393 CCCCCCCCCCS(=O)CCCl MCULE-1369991528 [0,1,0,0,0,0|3,0,0]=4 143 B14R0.393 CCCCCCCCCCS(=O)CCO MCULE-6360797475 [0,1,0,0,0,0|3,0,0]=4 144 B14R0.393 CCCCCCCCCNC(=O)CC#N MCULE-4595673603 [0,1,0,0,0,0|2,0,1]=4 145 B14R0.393 CCCCCCCCCNC(=O)CCS MCULE-5450463677 [0,1,0,0,0,0|2,0,0]=3 146 B14R0.393 CCCCCCCNCCC(=O)NCC MCULE-8513247916 [0,1,0,0,0,0|1,0,0]=2 147 B14R0.393 CCCCCCCNCCC(=O)OCC MCULE-6058376626 [0,1,0,0,0,0|0,0,0]=1 148 B14R0.393 CCOC(=O)CCCCCCCCC=O MCULE-1701011376 [0,1,0,0,0,0|0,0,1]=2 149 B14R0.393 CCOC(=O)CCCCCCCCCBr MCULE-9108239972 [0,1,0,0,0,0|0,0,0]=1 150 B14R0.393 CCOC(=O)CCCCCCCCCO MCULE-7625421399 [0,1,0,0,0,0|0,0,0]=1 151 B14R0.393 CCOCCCCCCCC(=O)OCC MCULE-2934612920 [0,1,0,0,0,0|0,0,0]=1 152 B14R0.432 CCOC(=O)CCCCCCCC(=O)C MCULE-8382585898 [0,1,0,0,0,0|0,0,1]=2 153 B14R0.432 CCOC(=O)CCCCCCCC(C)F MCULE-7195707616 [0,1,0,0,0,0|0,0,0]=1 154 B14R0.432 CCOC(=O)CCCCCCCN(=O)=O MCULE-5806854069 [0,1,0,0,0,0|2,0,0]=3 155 B14R0.432 CCOC(=O)CCCCCNCC(C)C MCULE-5406882176 [0,1,0,0,0,0|1,0,0]=2 156 B14R0.432 CCOC(=O)CCNCCCOC(C)C MCULE-9586474784 [0,1,0,0,0,0|2,0,0]=3 157 B14R0.493 CCCCCCCCCC(=O)OCCC MCULE-2561376129 [0,1,0,0,0,0|0,0,0]=1 158 B14R0.493 CCCCCCCCCC(=O)OCCCl MCULE-3404862373 [0,1,0,0,0,0|0,0,0]=1 159 B14R0.493 CCCCCCCCCC(=O)OCCS MCULE-2142812663 [0,1,0,0,0,0|0,0,0]=1 160 B14R0.493 CCCCCCCCNC(=O)CCCC MCULE-8729299663 [0,1,0,0,0,0|2,0,0]=3 161 B14R0.2432 CCCCCC(=O)CCCC(=O)OCC MCULE-5103251138 [0,1,0,0,0,0|0,0,1]=2 162 B14R0.2432 CCCCCC(O)CCCC(=O)OCC MCULE-5137362015 [0,1,0,0,0,0|0,0,0]=1 163 B14R1.26 CCCCCCCC1CCCC(=O)O1 MCULE-4837230476 [0,0,0,1,0,0|2,0,0]=3 164 B14R1.26 N#CCCCCCC1CCCC(=O)C1 MCULE-8205747806 [0,0,0,1,0,0|2,0,1]=4 165 B14R1.40 CCCCCCCCCC1OCCO1 MCULE-6985905845 [0,0,0,1,0,0|0,0,2]=3 166 B14R1.216 CCCCCCC#CN1CCOC1=O MCULE-4601649579 [0,0,0,1,0,0|1,0,2]=4 167 B14R1.216 CCCCCCCCC1CCCC1=O MCULE-7970611652 [0,0,0,1,0,0|1,0,0]=2 168 B14R1.216 CCCCCCCCC1CCCC1N MCULE-3296053087 [0,0,0,1,0,0|2,0,1]=4 169 B14R1.216 CCCCCCCCC1CCCC1N MCULE-4887341639 [0,0,0,1,0,0|2,0,1]=4 170 B14R1.216 CCCCCCCCC1CCNC1=O MCULE-8169921256 [0,0,0,1,0,0|1,0,0]=2 171 B14R1.216 CCCCCCCCN1CCCC1=O MCULE-8809059739 [0,0,0,1,0,0|2,0,0]=3 172 B14R1.216 CCCCCCCCN1CCOC1=O MCULE-6991317211 [0,0,0,1,0,0|1,0,0]=2 173 B14R1.263 CCNC(=O)N1CCCCC1CCO MCULE-9340150854 [0,0,0,1,0,0|3,0,0]=4 174 B14R1.263 CCOC(=O)C1CCCCC1N=C=S MCULE-4309569653 [0,0,0,1,0,0|2,0,1]=4 175 B14R1.263 CCOC(=O)C1CCCN=C1OCC MCULE-1008800776 [0,0,0,1,0,0|2,0,1]=4 176 B14R1.263 CCOC(=O)N1CCCCC1CCCl MCULE-3289205484 [0,0,0,1,0,0|2,0,0]=3 177 B14R1.520 CCNC(=O)CCCC1CCNCC1 MCULE-6728545251 [0,0,0,1,0,0|2,0,0]=3 178 B14R1.520 CCNC(=O)CCNC1CCCCC1 MCULE-5362666766 [0,0,0,1,0,0|2,0,0]=3 179 B14R1.520 CCOC(=O)CCCC1CCNCC1 MCULE-1132703610 [0,0,0,1,0,0|1,0,0]=2 180 B14R1.520 CCOC(=O)CCCC1CCNCC1 MCULE-9259992147 [0,0,0,1,0,0|1,0,0]=2 181 B14R1.520 CCOC(=O)CCCN1CCCCC1 MCULE-3807468838 [0,0,0,1,0,0|1,0,0]=2 182 B14R1.520 CCOC(=O)CCNC1CCCCC1 MCULE-7082412575 [0,0,0,1,0,0|1,0,0]=2 183 B14R1.520 CCOC(=O)CNCC1CCCCC1 MCULE-5013187624 [0,0,0,1,0,0|1,0,0]=2 184 B14R1.520 CCOC(=O)CNCC1CCOCC1 MCULE-6943244858 [0,0,0,1,0,0|2,0,0]=3 185 B14R1.597 CCOC(=O)CC1CCCCNC1=O MCULE-1147529223 [0,0,0,1,0,0|2,0,1]=4 186 B14R1.597 CCOC(=O)CN1CCCCCC1=O MCULE-6225496676 [0,0,0,1,0,0|2,0,1]=4 187 B14R1.598 CCOC(=O)CCC1CCCCC1=O MCULE-9517495940 [0,0,0,1,0,0|1,0,1]=3 188 B14R1.598 CCOC(=O)CCC1CNCCC1=O MCULE-2670008355 [0,0,0,1,0,0|2,0,1]=4 189 B14R1.598 CCOC(=O)CCN1CCCCC1C MCULE-7383999367 [0,0,0,1,0,0|1,0,0]=2 190 B14R1.609 CCNC(=O)CCNCC1CCCO1 MCULE-4767261178 [0,0,0,1,0,0|3,0,0]=4 191 B14R1.609 CCOC(=O)CCCCC1CCCN1 MCULE-7032343383 [0,0,0,1,0,0|1,0,0]=2 192 B14R1.609 CCOC(=O)CCCCC1CCCN1 MCULE-8038136081 [0,0,0,1,0,0|1,0,0]=2 193 B14R1.609 CCOC(=O)CCNCC1CCCO1 MCULE-2046787801 [0,0,0,1,0,0|2,0,0]=3 194 B14R1.622 CCOC(=O)C1CCCCCCC1=O MCULE-8587458168 [0,0,0,1,0,0|1,0,1]=3 195 B14R1.955 CCOC(=O)CCCCCCC1CO1 MCULE-4458416037 [0,0,0,1,0,0|1,0,0]=2 196 B14R1.965 CCOC(=O)CN1CCCCC1CC MCULE-9994211600 [0,0,0,1,0,0|1,0,0]=2 197 B14R1.4211 O=C1CCNCCCC(CCN1)CO MCULE-5361678997 [0,0,0,1,0,0|3,0,0]=4 198 B14R1.4211 O=C1CCNCCCC(CCN1)CO MCULE-7859777882 [0,0,0,1,0,0|3,0,0]=4 199 B14R1.4408 O=C1CCCCCCCCCCCN1 MCULE-1851658645 [0,0,0,1,0,0|1,0,0]=2 200 B14R1.4408 O=C1CCCCCCCCCCCO1 MCULE-9380541113 [0,0,0,1,0,0|0,0,0]=1 201 B14R1.6816 CCCCCCCCNC(=O)C1CC1 MCULE-6361868608 [0,0,0,1,0,0|2,0,0]=3 202 B14R1.7146 CCOC(=O)CCC1CCCCCC1 MCULE-3044268476 [0,0,0,1,0,0|0,0,0]=1 203 B14R1.7146 CCOC(=O)CCN1CCCCCC1 MCULE-1408957526 [0,0,0,1,0,0|1,0,0]=2 204 B14R1.7146 CCOC(=O)CNC1=NCCCCC1 MCULE-3761827895 [0,0,0,1,0,0|2,0,1]=4 205 B14R1.7146 CCOC(=O)CNC1=NCCCCC1 MCULE-6165062274 [0,0,0,1,0,0|2,0,1]=4 206 B14R1.7343 CCNC(=S)NC1CCCCCCC1 MCULE-4808288040 [0,0,0,1,0,0|2,1,0]=4 207 B14R1.7343 CCOC(=O)CN1CCCCCCC1 MCULE-2586261034 [0,0,0,1,0,0|1,0,0]=2 208 B14R1.7343 COCC(=O)NC1CCCCCCC1 MCULE-2086189771 [0,0,0,1,0,0|3,0,0]=4 209 B14R1.7343 O=C(CCCl)NC1CCCCCCC1 MCULE-7827437589 [0,0,0,1,0,0|3,0,0]=4 210 B11R0.3 CCCCCCCCC=CCO MCULE-3768375215 [2,0,0,0,0,0|1,0,1]=4 211 B11R0.3 CCCCCCCCCCCBr MCULE-1007413186 [2,0,0,0,0,0|1,0,1]=4 212 B11R0.3 CCCCCCCCCCCC MCULE-3947157412 [2,0,0,0,0,0|0,0,1]=3 213 B11R0.3 CCCCCCCCCCCCl MCULE-9378407763 [2,0,0,0,0,0|1,0,1]=4 214 B11R0.3 CCCCCCCCCCCI MCULE-2947342202 [2,0,0,0,0,0|1,0,1]=4 215 B11R0.3 CCCCCCCCCCCN MCULE-7249870518 [2,0,0,0,0,0|1,0,1]=4 216 B11R0.3 CCCCCCCCCCCO MCULE-9897986150 [2,0,0,0,0,0|1,0,1]=4 217 B11R0.3 CCCCCCCCCCCS MCULE-6868324316 [2,0,0,0,0,0|1,0,1]=4 218 B11R0.3 CCCCCCCCCCNC MCULE-1416369118 [2,0,0,0,0,0|1,0,1]=4 219 B11R0.3 CCCCCCCCCCNC MCULE-6168905746 [2,0,0,0,0,0|1,0,1]=4 220 B11R0.3 CCCCCCCCCCOC MCULE-1264379510 [2,0,0,0,0,0|0,0,1]=3 221 B11R0.3 CCCCCCCCCCON MCULE-2069797576 [2,0,0,0,0,0|1,0,1]=4 222 B11R0.3 CCCCCCCCCCON MCULE-7830749583 [2,0,0,0,0,0|1,0,1]=4 223 B11R0.3 CCCCCCCCCCSC MCULE-7334657081 [2,0,0,0,0,0|0,1,1]=4 224 B11R0.3 CCCCCCCCCNCC MCULE-2932168769 [2,0,0,0,0,0|1,0,0]=3 225 B11R0.3 CCCCCCCCCOC=O MCULE-1616501735 [2,0,0,0,0,0|1,0,1]=4 226 B11R0.3 CCCCCCCCCSCC MCULE-6635551100 [2,0,0,0,0,0|0,1,0]=3 227 B11R0.3 CCCCCCCCNCCC MCULE-8531662839 [2,0,0,0,0,0|1,0,1]=4 228 B11R0.3 CCCCCCCCNOCC MCULE-3650695826 [2,0,0,0,0,0|1,0,0]=3 229 B11R0.3 CCCCCCCCNOCC MCULE-5548504565 [2,0,0,0,0,0|1,0,0]=3 230 B11R0.3 CCCCCCCNCCCC MCULE-4951242533 [2,0,0,0,0,0|1,0,1]=4 231 B11R0.3 CCCCCCNCCCOC MCULE-6742672078 [2,0,0,0,0,0|1,0,1]=4 232 B11R0.3 CCNCCCCCCNCC MCULE-1626825133 [2,0,0,0,0,0|2,0,0]=4 233 B11R0.3 CCOCCCCCCCCO MCULE-8839640265 [2,0,0,0,0,0|1,0,0]=3 234 B11R0.3 CCSCCCCCCSCC MCULE-1161288056 [2,0,0,0,0,0|1,1,0]=4 235 B11R0.3 COCCCCCCCCCBr MCULE-8740247574 [2,0,0,0,0,0|1,0,1]=4 236 B11R0.3 COCCCCCCCCCN MCULE-5428647902 [2,0,0,0,0,0|1,0,1]=4 237 B11R0.3 COCCCCCCCCCO MCULE-5483027656 [2,0,0,0,0,0|1,0,1]=4 238 B11R0.3 COCCCCCCCCOC MCULE-6292448161 [2,0,0,0,0,0|1,0,1]=4 239 B11R0.3 [NH2+](CCCC)CCCCCCC MCULE-5696674484 [2,0,0,0,0,0|1,0,1]=4 240 B11R0.4 C(=CC(=O)OCC)CCCCC MCULE-4171275205 [2,0,0,0,0,0|0,0,2]=4 241 B11R0.4 C=CCCCCCC(=O)OCC MCULE-7006723315 [2,0,0,0,0,0|0,0,2]=4 242 B11R0.4 C=COC(=O)CCCCCCC MCULE-8119830012 [2,0,0,0,0,0|0,0,2]=4 243 B11R0.4 CCCC=CCCC(=O)OCC MCULE-9126448594 [2,0,0,0,0,0|0,0,2]=4 244 B11R0.4 CCCCC/C=C/C(=O)OCC MCULE-5442918020 [2,0,0,0,0,0|0,0,2]=4 245 B11R0.4 CCCCCC#CC(=O)OCC MCULE-5790220243 [2,0,0,0,0,0|0,0,2]=4 246 B11R0.4 CCCCCCCC(=O)CCC MCULE-1180729281 [2,0,0,0,0,0|1,0,0]=3 247 B11R0.4 CCCCCCCC(=O)OCC MCULE-2970505348 [2,0,0,0,0,0|0,0,0]=2 248 B11R0.4 CCCCCCCC(=O)OCCl MCULE-2638292153 [2,0,0,0,0,0|1,0,0]=3 249 B11R0.4 CCCCCCNC(=O)CCC MCULE-8057065415 [2,0,0,0,0,0|2,0,0]=4 250 B11R0.4 CCCCCCOC(=O)CCC MCULE-8350935490 [2,0,0,0,0,0|2,0,0]=4 251 B11R0.4 CCCCCCOC(=O)OCCl MCULE-3018615324 [2,0,0,0,0,0|2,0,0]=4 252 B11R0.4 CCCCNCCC(=O)OCC MCULE-5853777478 [2,0,0,0,0,0|1,0,0]=3 253 B11R0.4 CCCCSCCC(=O)OCC MCULE-6074500572 [2,0,0,0,0,0|1,0,0]=3 254 B11R0.4 CCOC(=O)CCCCCC=O MCULE-8029913259 [2,0,0,0,0,0|1,0,1]=4 255 B11R0.4 CCOC(=O)CCCCCCBr MCULE-6438098940 [2,0,0,0,0,0|1,0,0]=3 256 B11R0.4 CCOC(=O)CCCCCCCl MCULE-2985397172 [2,0,0,0,0,0|1,0,0]=3 257 B11R0.4 CCOC(=O)CCCCCCI MCULE-6134074150 [2,0,0,0,0,0|1,0,0]=3 258 B11R0.4 CCOC(=O)CCCCCCN MCULE-5019264359 [2,0,0,0,0,0|1,0,0]=3 259 B11R0.4 CCOC(=O)CCCCCCN MCULE-8921407508 [2,0,0,0,0,0|1,0,0]=3 260 B11R0.4 CCOC(=O)CCCCCNC MCULE-3880282111 [2,0,0,0,0,0|1,0,0]=3 261 B11R0.4 CCOC(=O)CCCCCNC MCULE-5211183009 [2,0,0,0,0,0|1,0,0]=3 262 B11R0.4 CCOC(=O)CCNCCCO MCULE-6911342581 [2,0,0,0,0,0|2,0,0]=4 263 B11R0.4 CCOC(=O)CCNCCOC MCULE-2066847830 [2,0,0,0,0,0|2,0,0]=4 264 B11R0.4 CCOC(=O)NCCCCCO MCULE-3754810142 [2,0,0,0,0,0|2,0,0]=4 265 B11R0.40 CCCCC/C=C/CC(=O)OC MCULE-2579151246 [2,0,0,0,0,0|0,0,2]=4 266 B11R0.40 CCCCCCC#CC(=O)OC MCULE-7877194626 [2,0,0,0,0,0|0,0,2]=4 267 B11R0.40 CCCCCCC=CC(=O)OC MCULE-3102057992 [2,0,0,0,0,0|0,0,2]=4 268 B11R0.40 CCCCCCCCC(=O)C=O MCULE-2896760493 [2,0,0,0,0,0|1,0,1]=4 269 B11R0.40 CCCCCCCCC(=O)CC MCULE-9958837588 [2,0,0,0,0,0|0,0,0]=2 270 B11R0.40 CCCCCCCCC(=O)NN MCULE-6560373796 [2,0,0,0,0,0|2,0,0]=4 271 B11R0.40 CCCCCCCCC(=O)NO MCULE-7098688577 [2,0,0,0,0,0|2,0,0]=4 272 B11R0.40 CCCCCCCCC(=O)OC MCULE-4760106079 [2,0,0,0,0,0|0,0,0]=2 273 B11R0.40 CCCCCCCCC(O)CC MCULE-7447063642 [2,0,0,0,0,0|0,0,2]=4 274 B11R0.40 CCCCCCCNC(=O)CBr MCULE-3010395952 [2,0,0,0,0,0|2,0,0]=4 275 B11R0.40 CCCCCCCOC(=O)CC MCULE-6239287032 [2,0,0,0,0,0|1,0,0]=3 276 B11R0.40 CCCCCCCOC(=O)CCl MCULE-6089837080 [2,0,0,0,0,0|2,0,0]=4 277 B11R0.40 CCCCCCCOC(=O)CS MCULE-3304894936 [2,0,0,0,0,0|2,0,0]=4 278 B11R0.40 COC(=O)CCCCCCC#N MCULE-5476473532 [2,0,0,0,0,0|1,0,1]=4 279 B11R0.40 COC(=O)CCCCCCC=O MCULE-8693929860 [2,0,0,0,0,0|1,0,1]=4 280 B11R0.40 COC(=O)CCCCCCCBr MCULE-5537473467 [2,0,0,0,0,0|1,0,0]=3 281 B11R0.40 COC(=O)CCCCCCCCl MCULE-1981178961 [2,0,0,0,0,0|1,0,0]=3 282 B11R0.40 COC(=O)CCCCCCCN MCULE-3361449332 [2,0,0,0,0,0|1,0,0]=3 283 B11R0.40 COC(=O)CCCCCCCN MCULE-5266446188 [2,0,0,0,0,0|1,0,0]=3 284 B11R0.40 COC(=O)CCCCCCCO MCULE-4577508073 [2,0,0,0,0,0|1,0,0]=3 285 B11R0.40 COCCCNCCC(=O)OC MCULE-4020268298 [2,0,0,0,0,0|2,0,0]=4 286 B11R0.148 C#CCCCCCCCC(=O)O MCULE-1292545040 [2,0,0,0,0,0|0,0,2]=4 287 B11R0.148 C=C(Br)CCCCCCCCC MCULE-3332268450 [2,0,0,0,0,0|1,0,1]=4 288 B11R0.148 C=C(C)CCCCCCCCC MCULE-1709497926 [2,0,0,0,0,0|1,0,0]=3 289 B11R0.148 C=C(Cl)CCCCCCCCC MCULE-9304719526 [2,0,0,0,0,0|1,0,1]=4 290 B11R0.148 C=CCCCCCCCC(=O)O MCULE-3892173219 [2,0,0,0,0,0|0,0,2]=4 291 B11R0.148 CC(=O)CCCCCCCCBr MCULE-8502798206 [2,0,0,0,0,0|1,0,0]=3 292 B11R0.148 CCCCC/C=C/CCC(=O)O MCULE-1356880290 [2,0,0,0,0,0|0,0,2]=4 293 B11R0.148 CCCCCC/C=C/CC(=O)O MCULE-1834860815 [2,0,0,0,0,0|0,0,2]=4 294 B11R0.148 CCCCCC=CCCC(=O)O MCULE-1637451620 [2,0,0,0,0,0|0,0,2]=4 295 B11R0.148 CCCCCCC/C=C/C(=O)O MCULE-3189731619 [2,0,0,0,0,0|0,0,2]=4 296 B11R0.148 CCCCCCC/C=C\C(=O)O MCULE-5508964733 [2,0,0,0,0,0|0,0,2]=4 297 B11R0.148 CCCCCCC=CCC(=O)O MCULE-5816262119 [2,0,0,0,0,0|0,0,2]=4 298 B11R0.148 CCCCCCCC=CC(=O)O MCULE-9648702049 [2,0,0,0,0,0|0,0,2]=4 299 B11R0.148 CCCCCCCCCC(=N)N MCULE-6113298447 [2,0,0,0,0,0|2,0,0]=4 300 B11R0.148 CCCCCCCCCC(=N)N MCULE-7599360964 [2,0,0,0,0,0|2,0,0]=4 301 B11R0.148 CCCCCCCCCC(=O)C MCULE-6858373499 [2,0,0,0,0,0|0,0,0]=2 302 B11R0.148 CCCCCCCCCC(=O)Cl MCULE-4226412977 [2,0,0,0,0,0|1,0,0]=3 303 B11R0.148 CCCCCCCCCC(=O)F MCULE-1839398331 [2,0,0,0,0,0|1,0,0]=3 304 B11R0.148 CCCCCCCCCC(=O)N MCULE-1159230758 [2,0,0,0,0,0|1,0,0]=3 305 B11R0.148 CCCCCCCCCC(=O)O MCULE-3914949169 [2,0,0,0,0,0|0,0,0]=2 306 B11R0.148 CCCCCCCCCC(=O)O MCULE-7204730113 [2,0,0,0,0,0|0,0,0]=2 307 B11R0.148 CCCCCCCCCC(=O)[O-] MCULE-2720595773 [2,0,0,0,0,0|0,0,1]=3 308 B11R0.148 CCCCCCCCCC(=O)[O-] MCULE-7398604282 [2,0,0,0,0,0|0,0,1]=3 309 B11R0.148 CCCCCCCCCC(C)C MCULE-1079534714 [2,0,0,0,0,0|1,0,1]=4 310 B11R0.148 CCCCCCCCCC(C)N MCULE-8277808063 [2,0,0,0,0,0|1,0,1]=4 311 B11R0.148 CCCCCCCCCC(C)O MCULE-8628471202 [2,0,0,0,0,0|0,0,2]=4 312 B11R0.148 CCCCCCCCCN(=O)=O MCULE-5909474153 [2,0,0,0,0,0|1,0,1]=4 313 B11R0.148 CCCCCCCCNC(=O)N MCULE-1005292011 [2,0,0,0,0,0|2,0,0]=4 314 B11R0.148 CCCCCCCCOC(=O)C MCULE-8590238161 [2,0,0,0,0,0|1,0,0]=3 315 B11R0.148 CCCCCCCCOC(=O)Cl MCULE-2623966790 [2,0,0,0,0,0|2,0,0]=4 316 B11R0.148 CCCCCCCNCC(=O)O MCULE-2155508761 [2,0,0,0,0,0|1,0,0]=3 317 B11R0.148 CCCCCCCNCC(=O)O MCULE-8805007132 [2,0,0,0,0,0|1,0,0]=3 318 B11R0.148 CCCCCCCSCC(=O)O MCULE-7218313490 [2,0,0,0,0,0|1,0,0]=3 319 B11R0.148 CCCCOCCOCC(=O)O MCULE-3118678736 [2,0,0,0,0,0|2,0,0]=4 320 B11R0.148 CCCCSCCCCC(=O)O MCULE-1665011362 [2,0,0,0,0,0|1,0,0]=3 321 B11R0.148 CCOCCOCCCC(=O)O MCULE-5210306588 [2,0,0,0,0,0|2,0,0]=4 322 B11R0.148 NC(=O)CCCCCCCCCl MCULE-4533445908 [2,0,0,0,0,0|2,0,0]=4 323 B11R0.148 NCCCCCCCCC(=O)O MCULE-9064856591 [2,0,0,0,0,0|1,0,0]=3 324 B11R0.148 O=C(O)CCCCCCCCBr MCULE-2459167157 [2,0,0,0,0,0|1,0,0]=3 325 B11R0.148 O=C(O)CCCCCCCCCl MCULE-9010808862 [2,0,0,0,0,0|1,0,0]=3 326 B11R0.148 O=C(O)CCCCCCCCO MCULE-6121514710 [2,0,0,0,0,0|1,0,0]=3 327 B11R0.148 O=CCCCCCCCC(=O)O MCULE-8345312745 [2,0,0,0,0,0|1,0,1]=4 328 B13R0.66 C=CCOC(=O)CCCCCCCC MCULE-4814095857 [1,1,0,0,0,0|0,0,1]=3 329 B13R0.66 CCCCCCCCC(=O)CCCC MCULE-3156876863 [1,1,0,0,0,0|1,0,0]=3 330 B13R0.66 CCCCCCCCS(=O)CCCO MCULE-2280372695 [1,1,0,0,0,0|2,0,0]=4 331 B13R0.87 CCOC(=O)CCCCCC(=O)CC MCULE-9296151326 [1,1,0,0,0,0|0,0,1]=3 332 B13R0.88 C=C(Br)CCCCCCC(=O)OCC MCULE-4287197501 [1,1,0,0,0,0|0,0,2]=4 333 B13R0.88 C=C(C)CCCCCCC(=O)OCC MCULE-4909005807 [1,1,0,0,0,0|0,0,1]=3 334 B13R0.88 C=C(Cl)CCCCCCC(=O)OCC MCULE-7000981381 [1,1,0,0,0,0|0,0,2]=4 335 B13R0.88 CCOC(=O)CCCCCCC(=O)O MCULE-5379886661 [1,1,0,0,0,0|1,0,1]=4 336 B13R0.88 CCOC(=O)CCCCCCN(=O)=O MCULE-3042680473 [1,1,0,0,0,0|2,0,0]=4 337 B13R0.88 CCOC(=O)CCCCCOC(=O)C MCULE-7762272982 [1,1,0,0,0,0|1,0,1]=4 338 B13R0.88 CCOC(=O)CCNCCCN(C)C MCULE-1215691233 [1,1,0,0,0,0|2,0,0]=4 339 B13R0.175 CCCCC(=O)CCCC(=O)OCC MCULE-9779499391 [1,1,0,0,0,0|0,0,1]=3 340 B13R0.193 CCCCCC(=O)CCC(=O)OCC MCULE-4346357886 [1,1,0,0,0,0|0,0,1]=3 341 B13R0.193 CCCCCC(O)C=CC(=O)OCC MCULE-6682483213 [1,1,0,0,0,0|0,0,2]=4 342 B13R0.275 CCCCCCCC(C)C(=O)OCC MCULE-3939081286 [1,1,0,0,0,0|0,0,0]=2 343 B13R0.275 CCOC(=O)C(=O)CCCCCCCl MCULE-6238076438 [1,1,0,0,0,0|1,0,1]=4 344 B13R0.330 CCCCCCC(=O)CC(=O)OCC MCULE-7009669263 [1,1,0,0,0,0|0,0,1]=3 345 B13R0.330 CCCCCCC(O)CC(=O)OCC MCULE-1322338775 [1,1,0,0,0,0|0,0,0]=2 346 B13R0.335 CCCCCCCCC(=O)NC(C)C MCULE-2834737168 [1,1,0,0,0,0|1,0,0]=3 347 B13R0.335 CCCCCCCCC(=O)OC(C)C MCULE-6579125494 [1,1,0,0,0,0|0,0,0]=2 348 B13R0.367 CCCC(=O)CCCCC(=O)OCC MCULE-3320708203 [1,1,0,0,0,0|0,0,1]=3 349 B13R0.367 CCOC(=O)CCCCC(=O)CCCl MCULE-6538968674 [1,1,0,0,0,0|1,0,1]=4 350 B13R0.367 CCOC(=O)CCCCC(=O)OCC MCULE-2781050180 [1,1,0,0,0,0|1,0,1]=4 351 B13R0.367 CCOC(=O)CCCCC(Cl)CCCl MCULE-9571782817 [1,1,0,0,0,0|1,0,0]=3 352 B13R0.367 CCOC(=O)CCCCC(O)CCCl MCULE-5110914158 [1,1,0,0,0,0|1,0,0]=3 353 B13R0.54 CCCCCCCCCCCC(C)N MCULE-3980418920 [1,1,0,0,0,0|1,0,1]=4 354 B13R0.54 CCCCCCCCCCCC(C)O MCULE-3181779723 [1,1,0,0,0,0|1,0,1]=4 355 B13R0.54 CCCCCCCCCCOC(=O)C MCULE-7452399897 [1,1,0,0,0,0|0,0,2]=4 356 B13R0.165 CCCCCCC(C)CCCCCC MCULE-2236189519 [1,1,0,0,0,0|1,0,1]=4 357 B13R0.165 CCCCCCC(N)CCCCCC MCULE-2802579601 [1,1,0,0,0,0|1,0,1]=4 358 B13R0.165 CCCCCCC(O)CCCCCC MCULE-2797114957 [1,1,0,0,0,0|1,0,1]=4 359 B13R0.336 CCCCCCCCCCC=CCO MCULE-7248316175 [1,1,0,0,0,0|2,0,0]=4 360 B13R0.336 CCCCCCCCCCCCCBr MCULE-4920949706 [1,1,0,0,0,0|1,0,1]=4 361 B13R0.336 CCCCCCCCCCCCCC MCULE-7442374993 [1,1,0,0,0,0|1,0,1]=4 362 B13R0.336 CCCCCCCCCCCCCCl MCULE-5597677663 [1,1,0,0,0,0|1,0,1]=4 363 B13R0.336 CCCCCCCCCCCCCI MCULE-8848884635 [1,1,0,0,0,0|1,0,1]=4 364 B13R0.336 CCCCCCCCCCCCCN MCULE-1771591728 [1,1,0,0,0,0|1,0,1]=4 365 B13R0.336 CCCCCCCCCCCCCO MCULE-4385103550 [1,1,0,0,0,0|1,0,1]=4 366 B13R0.336 CCCCCCCCCCCCNC MCULE-6157278006 [1,1,0,0,0,0|1,0,1]=4 367 B13R0.336 CCCCCCCCCCCCSC MCULE-8837710331 [1,1,0,0,0,0|1,0,1]=4 368 B13R0.336 CCCCCCCCCCCSCC MCULE-7247079771 [1,1,0,0,0,0|0,1,1]=4 369 B13R0.336 CCCCCCCCCCNCCC MCULE-5779059384 [1,1,0,0,0,0|1,0,1]=4 370 B13R0.336 CCCCCCCCCCNCCO MCULE-6579629969 [1,1,0,0,0,0|1,0,1]=4 371 B13R0.336 CCCCCCCCCCOCCCl MCULE-1526089088 [1,1,0,0,0,0|0,0,1]=3 372 B13R0.336 CCCCCCCCCCOCCO MCULE-4975665756 [1,1,0,0,0,0|0,0,1]=3 373 B13R0.336 CCCCCCCCCCSCCO MCULE-4627647142 [1,1,0,0,0,0|0,1,1]=4 374 B13R0.336 CCCCCCCCCC[NH2+]CCCl MCULE-2529658193 [1,1,0,0,0,0|1,0,1]=4 375 B13R0.336 CCCCCCCCCC[NH2+]CCCl MCULE-5824513113 [1,1,0,0,0,0|1,0,1]=4 376 B13R0.336 CCCCCCCCC[NH2+]CCCC MCULE-3004462204 [1,1,0,0,0,0|1,0,1]=4 377 B13R0.336 CCCCCCCCC[NH2+]CCCC MCULE-3338948197 [1,1,0,0,0,0|1,0,1]=4 378 B13R0.336 CCCCCCCCNCCOCC MCULE-6476025295 [1,1,0,0,0,0|0,0,1]=3 379 B13R0.336 CCCCCCCC[NH2+]CCOCC MCULE-4163142812 [1,1,0,0,0,0|0,0,1]=3 380 B13R0.336 CCCCCCCNCCCNCC MCULE-4051699159 [1,1,0,0,0,0|1,0,1]=4 381 B13R0.336 CCCCCCCOCCOCCCl MCULE-7165053997 [1,1,0,0,0,0|1,0,1]=4 382 B13R0.336 CCCCCCCSCCOCCO MCULE-9037054254 [1,1,0,0,0,0|1,0,1]=4 383 B13R0.336 CCCNCCCCCCNCCC MCULE-3165058793 [1,1,0,0,0,0|2,0,0]=4 384 B13R0.150 C=C(C)C(=O)OCCCCCCCC MCULE-8155490272 [1,1,0,0,0,0|1,0,1]=4 385 B13R0.150 CCCCCCCCCC(=O)N(C)C MCULE-9601486105 [1,1,0,0,0,0|1,0,0]=3 386 B13R0.150 CCCCCCCCOC(=O)C(C)C MCULE-6611613310 [1,1,0,0,0,0|1,0,0]=3 387 B13R0.150 CN(C)C(=O)CCCCCCCCN MCULE-8937163414 [1,1,0,0,0,0|2,0,0]=4 388 B13R0.150 CN(C)C(=O)CCCCCCCCN MCULE-9086226591 [1,1,0,0,0,0|2,0,0]=4 389 B13R0.201 CCC(C)CCCCCCC(=O)OC MCULE-5985049144 [1,1,0,0,0,0|0,0,0]=2 390 B13R0.201 COC(=O)CCCCCCC(=O)OC MCULE-3000822003 [1,1,0,0,0,0|1,0,1]=4 391 B13R0.202 COC(=O)CCCCCCCC(=O)O MCULE-2825137842 [1,1,0,0,0,0|1,0,1]=4 392 B13R0.202 COC(=O)CCCCCCCC(C)C MCULE-3325371997 [1,1,0,0,0,0|0,0,0]=2 393 B13R0.274 CCCCCCCC(O)CC(=O)OC MCULE-2537921032 [1,1,0,0,0,0|0,0,0]=2 394 B13R0.274 CCCCCCC[C@@H](O)CC(=O)OC MCULE-4586199421 [1,1,0,0,0,0|0,0,0]=2 395 B13R0.274 CCCCCCC[C@@H](O)CC(=O)OC MCULE-7045432024 [1,1,0,0,0,0|0,0,0]=2 396 B13R0.274 CCCCCCNC(C)CC(=O)OC MCULE-2373355014 [1,1,0,0,0,0|1,0,0]=3 397 B13R0.274 CCOCCCNC(C)CC(=O)OC MCULE-4407072193 [1,1,0,0,0,0|2,0,0]=4 398 B13R0.412 CCCCCCCCCC(C=O)CC MCULE-6879865212 [1,1,0,0,0,0|0,0,1]=3 399 B13R0.412 CCCCCCCCCC(CC)CO MCULE-4844751733 [1,1,0,0,0,0|0,0,2]=4 400 B13R0.412 CCCCCCCCCC(OC)OC MCULE-5319229815 [1,1,0,0,0,0|0,0,2]=4 401 B13R0.1170 CCCCCCC(O)CCC(=O)OC MCULE-3812992050 [1,1,0,0,0,0|0,0,0]=2 402 B13R0.1215 CCS(=O)(=O)CCCCCCCCO MCULE-3495101460 [1,1,0,0,0,0|2,0,0]=4 403 B15R0.1 CCCCC(=O)CCCCCC(=O)OCC MCULE-7418543364 [0,2,0,0,0,0|0,0,0]=2 404 B15R0.2187 CCOC(=O)CCC(F)CCC(=O)OCC MCULE-4962064110 [0,2,0,0,0,0|1,0,1]=4 405 B15R0.2187 CCOC(=O)CCC(N)CCC(=O)OCC MCULE-6399541149 [0,2,0,0,0,0|1,0,1]=4 406 B15R0.386 CCOC(=O)CCCCCCC(=O)C(C)C MCULE-5599768644 [0,2,0,0,0,0|0,0,1]=3 407 B15R0.408 CCCC(=O)CCCCCCC(=O)OCC MCULE-3529131104 [0,2,0,0,0,0|0,0,0]=2 408 B15R0.408 CCOC(=O)CCCCCCC(=O)OCC MCULE-4051190597 [0,2,0,0,0,0|0,0,1]=3 409 B15R0.2847 CCOC(=O)CCNCCCN(CC)CC MCULE-1916027691 [0,2,0,0,0,0|2,0,0]=4 410 B15R0.370 CCCCCCCCC(=O)CC(=O)OCC MCULE-9806856728 [0,2,0,0,0,0|0,0,0]=2 411 B15R0.370 CCCCCCCCC(O)CC(=O)OCC MCULE-1501317277 [0,2,0,0,0,0|0,0,0]=2 412 B15R0.3222 CCCCCCCCCC(=O)N(C)CCO MCULE-5364766444 [0,2,0,0,0,0|1,0,0]=3 413 B15R0.3222 CCCCOCCCNC(=O)C(=O)OCC MCULE-5496170229 [0,2,0,0,0,0|1,0,1]=4 414 B15R0.4413 CCOC(=O)C(C)(C)CCCCCCCBr MCULE-6878386906 [0,2,0,0,0,0|1,0,0]=3 415 B15R0.2001 CCCCCCCCCC(OCC)OCC MCULE-8105674016 [0,2,0,0,0,0|0,0,2]=4 416 B15R0.244 CCCCCC(=O)CCCCC(=O)OCC MCULE-9062171487 [0,2,0,0,0,0|0,0,0]=2 417 B15R0.4259 CCCOC(=O)CCCCC(=O)OCCC MCULE-9657963459 [0,2,0,0,0,0|1,0,1]=4 418 B15R0.3224 CCCCCCCCCC(=O)N(CC)CC MCULE-3489363648 [0,2,0,0,0,0|1,0,0]=3 419 B15R0.69 CCCCCCCCCOC(=O)CC(=O)C MCULE-7144219586 [0,2,0,0,0,0|1,0,1]=4 420 B15R0.3221 CCCCCCCCCC(=O)CC(=O)OC MCULE-9878066874 [0,2,0,0,0,0|1,0,1]=4 421 B15R0.3232 CC(C)(C)OC(=O)CCCCCCCCBr MCULE-2120270777 [0,2,0,0,0,0|1,0,0]=3 422 B15R0.3232 CC(C)(C)OC(=O)CCCCCCCCN MCULE-7711327017 [0,2,0,0,0,0|1,0,0]=3 423 B15R0.3232 CC(C)(C)OC(=O)CCOCCCCCBr MCULE-7634217706 [0,2,0,0,0,0|2,0,0]=4 424 B15R0.3232 CC(C)(C)OC(=O)COCCCCCCN MCULE-5298356669 [0,2,0,0,0,0|2,0,0]=4 425 B15R0.3232 CC(C)(C)OC(=O)COCCCCCCO MCULE-2382543789 [0,2,0,0,0,0|2,0,0]=4 426 B15R0.3232 CC(C)(C)OC(=O)NCCCCCCCBr MCULE-4646381127 [0,2,0,0,0,0|2,0,0]=4 427 B15R0.3232 CC(C)(C)OC(=O)NCCCCCCCN MCULE-6256602045 [0,2,0,0,0,0|2,0,0]=4 428 B15R0.3232 CC(C)(C)OC(=O)NCCCCCCCO MCULE-6284502555 [0,2,0,0,0,0|2,0,0]=4 429 B15R0.3232 CCCCCCNCCC(=O)OC(C)(C)C MCULE-6762473463 [0,2,0,0,0,0|1,0,0]=3 430 B15R0.3232 CCNCCCCCNC(=O)OC(C)(C)C MCULE-8252963513 [0,2,0,0,0,0|2,0,0]=4 431 B15R0.3232 CCOCCCNCCC(=O)OC(C)(C)C MCULE-4394552991 [0,2,0,0,0,0|2,0,0]=4 432 B15R0.3232 CNCCCCCCNC(=O)OC(C)(C)C MCULE-6865014123 [0,2,0,0,0,0|2,0,0]=4 433 B15R0.111 CCOC(=O)CCCCCCCCC(=O)C MCULE-9098653924 [0,2,0,0,0,0|0,0,0]=2 434 B15R0.111 CCOC(=O)CCCCCCCCC(=O)O MCULE-2428773430 [0,2,0,0,0,0|0,0,1]=3 435 B15R0.366 C=CCCCCCCCCCC(=O)OCC MCULE-7999165590 [0,2,0,0,0,0|0,0,0]=2 436 B15R0.366 C=COC(=O)CCCCCCCCCCC MCULE-4112696875 [0,2,0,0,0,0|0,0,2]=4 437 B15R0.366 CCCCCCCCC/C=C/C(=O)OCC MCULE-9164260564 [0,2,0,0,0,0|0,0,0]=2 438 B15R0.366 CCCCCCCCC=NNC(=O)OCC MCULE-3507647310 [0,2,0,0,0,0|0,0,1]=3 439 B15R0.366 CCCCCCCCCC=CC(=O)OCC MCULE-3827280556 [0,2,0,0,0,0|0,0,0]=2 440 B15R0.366 CCCCCCCCCCCC(=O)NCC MCULE-4785540132 [0,2,0,0,0,0|1,0,0]=3 441 B15R0.366 CCCCCCCCCCCC(=O)OCC MCULE-6150658986 [0,2,0,0,0,0|0,0,0]=2 442 B15R0.366 CCCCCCCCCCCC(=O)OCCl MCULE-7622384571 [0,2,0,0,0,0|1,0,0]=3 443 B15R0.366 CCCCCCCCNCCC(=O)OCC MCULE-7089762363 [0,2,0,0,0,0|0,0,0]=2 444 B15R0.366 CCCCCCCCSCCC(=O)OCC MCULE-2446708021 [0,2,0,0,0,0|0,0,0]=2 445 B15R0.366 CCNC(=O)CCCCCCCCC#CBr MCULE-4045494167 [0,2,0,0,0,0|1,0,1]=4 446 B15R0.366 CCOC(=O)CCCCCCCCCCBr MCULE-2219675372 [0,2,0,0,0,0|0,0,0]=2 447 B15R0.2002 C=CCCCCCCCCC(=O)NCCO MCULE-5146179123 [0,2,0,0,0,0|1,0,1]=4 448 B15R0.2002 CCCCCCCCCNC(=O)CCCCl MCULE-6850862251 [0,2,0,0,0,0|1,0,0]=3 449 B15R0.88 CCCCCCCCCC(=O)CC[NH+](C)C MCULE-6909829289 [0,2,0,0,0,0|1,0,0]=3 450 B15R0.88 CCCCCCCCCC(=O)CC[NH+](C)C MCULE-7035298255 [0,2,0,0,0,0|1,0,0]=3 451 B15R0.88 CCCCCCCCCC(=O)NCC(=O)O MCULE-9009743421 [0,2,0,0,0,0|1,0,1]=4 452 B15R0.88 CCCCCCCCCC(=O)NCC(C)C MCULE-6458606340 [0,2,0,0,0,0|1,0,0]=3 453 B15R0.88 CCCCCCCCCC(=O)NN=C(C)C MCULE-2692558195 [0,2,0,0,0,0|1,0,1]=4 454 B15R0.88 CCCCCCCCCC(=O)OCC(C)C MCULE-2896735365 [0,2,0,0,0,0|0,0,0]=2 455 B15R0.322 CCCCCCCCCC(=O)OCCCC MCULE-6539746773 [0,2,0,0,0,0|0,0,0]=2 456 B13R1.6 CCCCCCC1CCCC(=O)O1 MCULE-7844383556 [1,0,0,1,0,0|2,0,0]=4 457 B13R1.42 CCNC(=O)CCN1CCCCC1 MCULE-3745615462 [1,0,0,1,0,0|2,0,0]=4 458 B13R1.42 CCNC(=O)CCN1CCCCC1 MCULE-8319367404 [1,0,0,1,0,0|2,0,0]=4 459 B13R1.42 CCNC(=O)NCC1CCCCC1 MCULE-5330677370 [1,0,0,1,0,0|2,0,0]=4 460 B13R1.42 CCOC(=O)/C=C/C1CCCCC1 MCULE-1457900968 [1,0,0,1,0,0|0,0,2]=4 461 B13R1.42 CCOC(=O)C=CC1CCCCC1 MCULE-5687333040 [1,0,0,1,0,0|0,0,2]=4 462 B13R1.42 CCOC(=O)CCC1CCCCC1 MCULE-3795646947 [1,0,0,1,0,0|0,0,0]=2 463 B13R1.42 CCOC(=O)CCC1CCCCN1 MCULE-8312422994 [1,0,0,1,0,0|1,0,0]=3 464 B13R1.42 CCOC(=O)CCC1CCCCN1 MCULE-9450759265 [1,0,0,1,0,0|1,0,0]=3 465 B13R1.42 CCOC(=O)CCC1CCCNC1 MCULE-1637411753 [1,0,0,1,0,0|1,0,0]=3 466 B13R1.42 CCOC(=O)CCC1CCCNC1 MCULE-8761619525 [1,0,0,1,0,0|1,0,0]=3 467 B13R1.42 CCOC(=O)CCC1CCNCC1 MCULE-6427583290 [1,0,0,1,0,0|1,0,0]=3 468 B13R1.42 CCOC(=O)CCC1CCNCC1 MCULE-9125092654 [1,0,0,1,0,0|1,0,0]=3 469 B13R1.42 CCOC(=O)CCC1CCOCC1 MCULE-5773636038 [1,0,0,1,0,0|1,0,0]=3 470 B13R1.42 CCOC(=O)CCC1COCCN1 MCULE-4697835214 [1,0,0,1,0,0|2,0,0]=4 471 B13R1.42 CCOC(=O)CCC1OCCCO1 MCULE-8117295121 [1,0,0,1,0,0|2,0,0]=4 472 B13R1.42 CCOC(=O)CCN1CCCCC1 MCULE-1605821182 [1,0,0,1,0,0|1,0,0]=3 473 B13R1.42 CCOC(=O)CCN1CCNCC1 MCULE-8095645723 [1,0,0,1,0,0|2,0,0]=4 474 B13R1.42 CCOC(=O)CCN1CCNCC1 MCULE-9650581085 [1,0,0,1,0,0|2,0,0]=4 475 B13R1.42 CCOC(=O)CCN1CCOCC1 MCULE-1947254518 [1,0,0,1,0,0|2,0,0]=4 476 B13R1.42 CCOC(=O)CNC1CCCCC1 MCULE-1722006916 [1,0,0,1,0,0|1,0,0]=3 477 B13R1.42 CCOC(=O)CNC1CCCCC1 MCULE-4764520099 [1,0,0,1,0,0|1,0,0]=3 478 B13R1.42 CCOC(=O)COC1CCCCO1 MCULE-4958737382 [1,0,0,1,0,0|2,0,0]=4 479 B13R1.42 CCOC(=O)COC1CCNCC1 MCULE-2621367837 [1,0,0,1,0,0|2,0,0]=4 480 B13R1.42 CCOC(=O)COC1CCNCC1 MCULE-6082423574 [1,0,0,1,0,0|2,0,0]=4 481 B13R1.190 CCCCCCC1OC(=O)CC1C MCULE-7996140068 [1,0,0,1,0,0|2,0,0]=4 482 B13R1.279 C=C1CCCCCCCCCCC1 MCULE-1393925319 [1,0,0,1,0,0|2,0,0]=4 483 B13R1.279 O=C1CCCCCCCCCCC1 MCULE-8431279332 [1,0,0,1,0,0|1,0,0]=3 484 B13R1.279 O=C1CCCCCCCCCCN1 MCULE-7739147292 [1,0,0,1,0,0|1,0,0]=3 485 B13R1.279 O=C1CCCCCCCCCCO1 MCULE-5646678690 [1,0,0,1,0,0|0,0,0]=2 486 B13R1.404 CCOC(=O)CCNC1CCCC1 MCULE-1525288622 [1,0,0,1,0,0|1,0,0]=3 487 B13R1.404 CCOC(=O)CCNC1CCCC1 MCULE-8488402424 [1,0,0,1,0,0|1,0,0]=3 488 B13R1.404 CCOC(=O)CNCC1CCCO1 MCULE-5596592609 [1,0,0,1,0,0|2,0,0]=4 489 B13R1.404 CCOC(=O)COCC1CCCO1 MCULE-2076514702 [1,0,0,1,0,0|2,0,0]=4 490 B13R1.448 CCOC(=O)CCCNC1CCC1 MCULE-1013663406 [1,0,0,1,0,0|1,0,0]=3 491 B13R1.463 CCOC(=O)C1CCCCCC1=O MCULE-8781094992 [1,0,0,1,0,0|1,0,1]=4 492 B13R1.464 CCNC(=O)N1CCCCC1CC MCULE-7723904653 [1,0,0,1,0,0|2,0,0]=4 493 B13R1.464 CCOC(=O)N1CCCCC1CO MCULE-3880015020 [1,0,0,1,0,0|2,0,0]=4 494 B13R1.470 CCOC(=O)CC1CCCCC1=O MCULE-9467254413 [1,0,0,1,0,0|1,0,1]=4 495 B13R1.470 CCOC(=O)CC1CCCCC1C MCULE-2556210216 [1,0,0,1,0,0|0,0,0]=2 496 B13R1.470 CCOC(=O)CC1CCNCC1C MCULE-6866763376 [1,0,0,1,0,0|1,0,0]=3 497 B13R1.470 CCOC(=O)CC1CCNCC1C MCULE-8458420799 [1,0,0,1,0,0|1,0,0]=3 498 B13R1.470 CCOC(=O)CC1CCOCC1F MCULE-4987265269 [1,0,0,1,0,0|2,0,0]=4 499 B13R1.470 CCOC(=O)CN1CCCCC1C MCULE-7049686856 [1,0,0,1,0,0|1,0,0]=3 500 B13R1.654 CCCCCCCC1CCCC1=O MCULE-6699941490 [1,0,0,1,0,0|1,0,0]=3 501 B13R1.1464 CCOC(=O)C1CCCCCCC1 MCULE-7547074128 [1,0,0,1,0,0|0,0,0]=2 502 B13R1.1575 CCNC(=O)OC1CCCCCC1 MCULE-9362178954 [1,0,0,1,0,0|2,0,0]=4 503 B13R1.1575 CCOC(=O)C=C1CCCCCC1 MCULE-9731133687 [1,0,0,1,0,0|0,0,2]=4 504 B13R1.1575 CCOC(=O)CC1CCCCCC1 MCULE-3082077758 [1,0,0,1,0,0|0,0,0]=2 505 B13R1.1575 CCOC(=O)CN1CCCCCC1 MCULE-5110746682 [1,0,0,1,0,0|1,0,0]=3 506 B13R1.1575 CCOC(=O)CN1CCCNCC1 MCULE-2285037240 [1,0,0,1,0,0|2,0,0]=4 507 B13R1.1575 CCOC(=O)CN1CCCNCC1 MCULE-4526170590 [1,0,0,1,0,0|2,0,0]=4 508 B13R1.1575 CCOC(=O)NC1CCCCCC1 MCULE-5320832869 [1,0,0,1,0,0|1,0,0]=3 509 B13R1.2851 CCCCOC1CC1C(=O)OCC MCULE-7375295486 [1,0,0,1,0,0|1,0,0]=3 510 B13R1.28 CCCCCCCC1CCCCC1 MCULE-5431487347 [1,0,0,1,0,0|1,0,1]=4 511 B13R1.28 CCCCCNCC1CCOCC1 MCULE-6543779177 [1,0,0,1,0,0|1,0,1]=4 512 B13R1.207 CCOC1CCCCCCC1NC MCULE-2927737246 [1,0,0,1,0,0|1,0,1]=4 513 B13R1.225 CCNC1CCCCCC1OCC MCULE-2650007549 [1,0,0,1,0,0|1,0,1]=4 514 B13R1.2883 C1CCCCCCNCCCCC1 MCULE-9792674396 [1,0,0,1,0,0|1,0,1]=4 515 B13R1.9 CCCCCCC1CCC(=O)CC1 MCULE-8215721805 [1,0,0,1,0,0|0,0,0]=2 516 B13R1.9 CCCCCCN1CCC(=O)CC1 MCULE-9197520812 [1,0,0,1,0,0|1,0,0]=3 517 B13R1.27 CCCCCCCC1CCC(=O)O1 MCULE-9018416843 [1,0,0,1,0,0|1,0,0]=3 518 B13R1.27 CCCCCCC[C@H]1CCC(=O)O1 MCULE-5815442718 [1,0,0,1,0,0|1,0,0]=3 519 B13R1.527 COC(=O)CC1CCCCCC1=O MCULE-7980040182 [1,0,0,1,0,0|1,0,1]=4 520 B13R1.528 COC(=O)CCC1CCCCC1=O MCULE-6511835645 [1,0,0,1,0,0|1,0,1]=4 521 B13R1.528 COC(=O)CCN1CCCCC1C MCULE-8929818560 [1,0,0,1,0,0|1,0,0]=3 522 B13R1.536 COC(=O)CCNCC1CCCC1 MCULE-8692054082 [1,0,0,1,0,0|1,0,0]=3 523 B13R1.536 COC(=O)CCNCC1CCCO1 MCULE-2760624578 [1,0,0,1,0,0|2,0,0]=4 524 B13R1.536 COC(=O)CCOCC1CCNC1 MCULE-3506589342 [1,0,0,1,0,0|2,0,0]=4 525 B13R1.536 COC(=O)CCOCC1CCNC1 MCULE-9390752221 [1,0,0,1,0,0|2,0,0]=4 526 B13R1.546 COC(=O)C1CCCCCCC1=O MCULE-2058547373 [1,0,0,1,0,0|1,0,1]=4 527 B13R1.613 COC(=O)CCN1CCC[C@H]1CO MCULE-8738435926 [1,0,0,1,0,0|2,0,0]=4 528 B13R1.718 CCC(=O)NCCN1CCCCC1 MCULE-8643520756 [1,0,0,1,0,0|2,0,0]=4 529 B13R1.718 CCC(=O)OCCC1CCCCN1 MCULE-6945783306 [1,0,0,1,0,0|2,0,0]=4 530 B13R1.718 CCC(=O)OCCC1CCCCN1 MCULE-7199789721 [1,0,0,1,0,0|2,0,0]=4 531 B13R1.718 CCC(=O)OCCC1CCCNC1 MCULE-3396732389 [1,0,0,1,0,0|2,0,0]=4 532 B13R1.718 CCC(=O)OCCC1CCCNC1 MCULE-6398484140 [1,0,0,1,0,0|2,0,0]=4 533 B13R1.718 CCC(=O)OCCC1CCNCC1 MCULE-3568490915 [1,0,0,1,0,0|2,0,0]=4 534 B13R1.718 CCC(=O)OCCC1CCNCC1 MCULE-6258622429 [1,0,0,1,0,0|2,0,0]=4 535 B13R1.718 CNC(=O)CCCC1CCNCC1 MCULE-9692635349 [1,0,0,1,0,0|2,0,0]=4 536 B13R1.718 CNC(=O)CCNC1CCCCC1 MCULE-9756341626 [1,0,0,1,0,0|2,0,0]=4 537 B13R1.718 COC(=O)CCCC1CCNCC1 MCULE-7580366096 [1,0,0,1,0,0|1,0,0]=3 538 B13R1.718 COC(=O)CCCC1CCNCC1 MCULE-9217647970 [1,0,0,1,0,0|1,0,0]=3 539 B13R1.718 COC(=O)CCCN1CCCCC1 MCULE-6840007912 [1,0,0,1,0,0|1,0,0]=3 540 B13R1.718 COC(=O)CCCN1CCCCC1 MCULE-9231421014 [1,0,0,1,0,0|1,0,0]=3 541 B13R1.718 COC(=O)CCCN1CCNCC1 MCULE-6927160903 [1,0,0,1,0,0|2,0,0]=4 542 B13R1.718 COC(=O)CCCN1CCOCC1 MCULE-1569044371 [1,0,0,1,0,0|2,0,0]=4 543 B13R1.718 COC(=O)CCCN1CCSCC1 MCULE-8202738986 [1,0,0,1,0,0|2,0,0]=4 544 B13R1.718 COC(=O)CCNC1CCCCC1 MCULE-2199390487 [1,0,0,1,0,0|1,0,0]=3 545 B13R1.718 COC(=O)CCNC1CCOCC1 MCULE-4160290559 [1,0,0,1,0,0|2,0,0]=4 546 B13R1.718 COC(=O)CCOC1CCCCO1 MCULE-9346048746 [1,0,0,1,0,0|2,0,0]=4 547 B13R1.718 COC(=O)CCOC1CCCNC1 MCULE-2837273563 [1,0,0,1,0,0|2,0,0]=4 548 B13R1.718 COC(=O)CCOC1CCCNC1 MCULE-8847881863 [1,0,0,1,0,0|2,0,0]=4 549 B13R1.718 COC(=O)CCOC1CCNCC1 MCULE-5235263362 [1,0,0,1,0,0|2,0,0]=4 550 B13R1.718 COC(=O)CCOC1CCNCC1 MCULE-7461665740 [1,0,0,1,0,0|2,0,0]=4 551 B13R1.718 COC(=O)NCCC1CCCCN1 MCULE-8941703851 [1,0,0,1,0,0|2,0,0]=4 552 B13R1.718 O=C(CCl)NCCC1CCCCC1 MCULE-5494147009 [1,0,0,1,0,0|2,0,0]=4 553 B13R1.1711 COC(=O)CCN1CCCCCC1 MCULE-1344291062 [1,0,0,1,0,0|1,0,0]=3 554 B13R1.1711 COC(=O)CCN1CCCCCC1 MCULE-4180090952 [1,0,0,1,0,0|1,0,0]=3 555 B13R1.1870 CCC(=O)NC1CCCCCCC1 MCULE-9142981832 [1,0,0,1,0,0|1,0,0]=3 556 B13R1.1870 O=C(CCl)NC1CCCCCCC1 MCULE-3469077952 [1,0,0,1,0,0|2,0,0]=4 557 B15R1.795 CCOC(=O)CCNCCN1CCCC1 MCULE-1054491994 [0,1,0,1,0,0|1,0,0]=3 558 B15R1.3857 CCOC(=O)CCCCC1CCCC1=O MCULE-4127064634 [0,1,0,1,0,0|0,0,1]=3 559 B15R1.10572 CCOC(=O)CCCCCC(=O)C1CC1 MCULE-2142098161 [0,1,0,1,0,0|0,0,1]=3 560 B15R1.11 CCOC(=O)CCCN1CCN(CC1)C MCULE-1233333121 [0,1,0,1,0,0|2,0,0]=4 561 B15R1.11 CCOC(=O)CCC[NH+]1CC[NH+](CC1)C MCULE-9873207479 [0,1,0,1,0,0|2,0,0]=4 562 B15R1.809 CCOC(=O)CC(=O)CC1CCCCC1 MCULE-5002210125 [0,1,0,1,0,0|0,0,1]=3 563 B15R1.809 CCOC(=O)CC(=O)CC1CCOCC1 MCULE-3490377623 [0,1,0,1,0,0|1,0,1]=4 564 B15R1.1284 CCOC(=O)CC(=O)CCC1CCCC1 MCULE-1857634087 [0,1,0,1,0,0|0,0,1]=3 565 B15R1.2593 CCOC(=O)CC1(CCCCCCC1)O MCULE-6917014202 [0,1,0,1,0,0|0,0,0]=2 566 B15R1.16078 CCOC(=O)CC(N)C1CCCCCC1 MCULE-2467005006 [0,1,0,1,0,0|0,0,0]=2 567 B15R1.826 CCOC(=O)C(=O)NCC1CCCCC1 MCULE-6534300537 [0,1,0,1,0,0|1,0,1]=4 568 B15R1.826 CCOC(=O)C(N)CCC1CCCCC1 MCULE-5059068636 [0,1,0,1,0,0|0,0,0]=2 569 B15R1.826 CCOC(=O)C(N)CSC1CCCCO1 MCULE-3188640710 [0,1,0,1,0,0|2,0,0]=4 570 B15R1.826 CCOC(=O)[C@@H](N)CCC1CCCCC1 MCULE-4661368114 [0,1,0,1,0,0|0,0,0]=2 571 B15R1.826 CCOC(=O)[C@@H](N)CCC1CCCCC1 MCULE-9312849678 [0,1,0,1,0,0|0,0,0]=2 572 B15R1.826 CCOC(=O)[C@H](O)CCC1CCCCC1 MCULE-3656974410 [0,1,0,1,0,0|0,0,0]=2 573 B15R1.1039 CCOC(=O)C1CCCN(C1)CCCN MCULE-5258567386 [0,1,0,1,0,0|2,0,0]=4 574 B15R1.3954 CCOC(=O)C(=O)N1CCCCC1CC MCULE-5497023955 [0,1,0,1,0,0|1,0,1]=4 575 B15R1.5365 CCCCCCCCC1CC(=O)OC1=O MCULE-6008951424 [0,1,0,1,0,0|0,0,1]=3 576 B15R1.16791 CCOC(=O)C(=O)N1CCCCCCC1 MCULE-3044083070 [0,1,0,1,0,0|1,0,1]=4 577 B15R1.16898 CCOC(=O)C(=O)NC1CCCCCC1 MCULE-2149994390 [0,1,0,1,0,0|1,0,1]=4 578 B15R1.34 CCCCCCCCCC1OCC(O1)C MCULE-8755635049 [0,1,0,1,0,0|0,0,2]=4 579 B15R1.35 CCCCCCCCCC1=NCCCC1 MCULE-1430435229 [0,1,0,1,0,0|2,0,0]=4 580 B15R1.778 CCOC(=O)CCCOC1CCCCO1 MCULE-1899444465 [0,1,0,1,0,0|1,0,0]=3 581 B15R1.778 CCOC(=O)CSCCN1CCCCC1 MCULE-7888527931 [0,1,0,1,0,0|1,0,0]=3 582 B15R1.778 CCOC(=O)CSCCN1CCCCC1 MCULE-9845660217 [0,1,0,1,0,0|1,0,0]=3 583 B15R1.832 CCCCC1CC1CCCC(=O)OCC MCULE-3691869431 [0,1,0,1,0,0|0,0,0]=2 584 B15R1.1252 CCOC(=O)CCNC1CCCCC1C MCULE-1242997753 [0,1,0,1,0,0|0,0,0]=2 585 B15R1.6476 O=C1CCCCCCCC(=O)OCCO1 MCULE-6659312326 [0,1,0,1,0,0|1,0,1]=4 586 B15R1.10422 CCOC(=O)CCCCC(=O)C1CCC1 MCULE-1000483956 [0,1,0,1,0,0|0,0,1]=3 587 B15R1.89 CCOC(=O)CCC(=O)C1CCCCC1 MCULE-4123937782 [0,1,0,1,0,0|0,0,1]=3 588 B15R1.89 CCOC(=O)CNC(=O)C1CCCCC1 MCULE-6298689897 [0,1,0,1,0,0|1,0,1]=4 589 B15R1.3974 CCCCCCC(=O)NC1CCOC1=O MCULE-8966539462 [0,1,0,1,0,0|1,0,1]=4 590 B15R1.3974 CCCCCCC(=O)N[C@H]1CCOC1=O MCULE-6581627132 [0,1,0,1,0,0|1,0,1]=4 591 B15R1.9084 CC(C)NC(=O)CCCC1CCNCC1 MCULE-7540904607 [0,1,0,1,0,0|2,0,0]=4 592 B15R1.22532 CC(C)NC(=O)CNC1CCCCCC1 MCULE-1286618793 [0,1,0,1,0,0|2,0,0]=4 593 B15R1.22585 CC(C)CC(=O)NC1CCCCCCC1 MCULE-6915196116 [0,1,0,1,0,0|2,0,0]=4 594 B15R1.106 CCCCCCCCC1CCCC(=O)O1 MCULE-2792905042 [0,1,0,1,0,0|1,0,0]=3 595 B15R1.106 N#CCCCCCCC1CCCC(=O)C1 MCULE-7064486276 [0,1,0,1,0,0|1,0,1]=4 596 B15R1.528 BrCCCCCCCCCC1OCCO1 MCULE-3778400260 [0,1,0,1,0,0|0,0,2]=4 597 B15R1.768 CCOC(=O)CCN1CCCCC1CC MCULE-5791107135 [0,1,0,1,0,0|0,0,0]=2 598 B15R1.1251 CCOC(=O)CCN1CCCCCC1=O MCULE-9705005762 [0,1,0,1,0,0|1,0,1]=4 599 B15R1.2461 CCOC(=O)CCNC1CCCCCC1 MCULE-2052294345 [0,1,0,1,0,0|0,0,0]=2 600 B15R1.6595 O=C1CCCCCCCCCCCCO1 MCULE-3692667490 [0,1,0,1,0,0|0,0,0]=2 601 B15R1.10442 CCOC(=O)CCCCCNCC1CC1 MCULE-9147181340 [0,1,0,1,0,0|0,0,0]=2 602 B15R1.2430 CCCNC(=O)NC1CCCCCCC1 MCULE-4412492525 [0,1,0,1,0,0|2,0,0]=4 603 B15R1.2430 CCOCC(=O)NC1CCCCCCC1 MCULE-1097589361 [0,1,0,1,0,0|1,0,0]=3 604 B15R1.794 CCOC(=O)CCCC(=O)C1CCCC1 MCULE-4260015819 [0,1,0,1,0,0|0,0,1]=3 605 B15R1.36731 CCOC(=O)CCN1C(CCCC1C)C MCULE-3842193287 [0,1,0,1,0,0|1,0,0]=3 606 B15R2.8841 O=C1NCCCCCNC2C1CCC2 MCULE-2689026675 [0,0,0,2,0,0|2,0,0]=4 607 B15R2.8841 O=C1NCCCCCN[C@@H]2[C@H]1CCC2 MCULE-9245521627 [0,0,0,2,0,0|2,0,0]=4 608 B15R2.359 O=C1OCCC1CC2CCCCC2O MCULE-3682020697 [0,0,0,2,0,0|1,0,0]=3 609 B15R2.17170 CCOC(=O)N1CC2CCC1CC2O MCULE-7501263088 [0,0,0,2,0,0|2,0,0]=4 610 B15R2.74328 CCOC(=O)[C@]12CNC[C@H]1CCOC2 MCULE-3591448241 [0,0,0,2,0,0|2,0,0]=4 611 B15R2.74328 CCOC(=O)[C@]12CNC[C@H]1CCOC2 MCULE-5401375071 [0,0,0,2,0,0|2,0,0]=4 612 B15R2.17397 CCOC(=O)C1C(OC2C1CCO2)C MCULE-8316735249 [0,0,0,2,0,0|2,0,0]=4 613 B15R2.75882 CCOC(=O)CC12CCCN1CCC2 MCULE-7158820058 [0,0,0,2,0,0|1,0,0]=3 614 B15R2.13582 C12CCCC(=O)NC1(CCCCN2)C MCULE-4788450967 [0,0,0,2,0,0|2,0,0]=4 615 B15R2.1342 CCOC(=O)C1CC1C2CCOCC2 MCULE-7863449975 [0,0,0,2,0,0|1,0,0]=3 616 B15R2.1356 [C@@H]12CCCC[C@@H]1N[C@@H](C2)C(=O)OCC MCULE-2002367724 [0,0,0,2,0,0|1,0,0]=3 617 B15R2.1356 [C@@H]12CCCC[C@@H]1N[C@@H](C2)C(=O)OCC MCULE-2901981492 [0,0,0,2,0,0|1,0,0]=3 618 B15R2.1356 [C@@H]12CCCC[C@@H]1N[C@@H](C2)C(=O)OCC MCULE-8104497403 [0,0,0,2,0,0|1,0,0]=3 619 B15R2.17289 CCNC(=O)NCC1CC2CCC1C2 MCULE-2267702959 [0,0,0,2,0,0|2,0,0]=4 620 B15R2.17289 CCOC(=O)CCC1CC2CCC1C2 MCULE-1541771980 [0,0,0,2,0,0|0,0,0]=2 621 B15R2.76 CCOC(=O)C1CCCC12OCCO2 MCULE-3119996999 [0,0,0,2,0,0|2,0,0]=4 622 B15R2.74812 CCOC(=O)C1C2C1CCC=CCC2 MCULE-2045441503 [0,0,0,2,0,0|0,0,2]=4 623 B15R2.74812 CCOC(=O)C1[C@@H]2[C@@H]1CCC=CCC2 MCULE-2040865857 [0,0,0,2,0,0|0,0,2]=4 624 B15R2.74812 [C@@H]12CCC=CCC[C@@H]1[C@@H]2C(=O)OCC MCULE-1925809679 [0,0,0,2,0,0|0,0,2]=4 625 B15R2.74812 [C@@H]12CCC=CCC[C@@H]1[C@H]2C(=O)OCC MCULE-4425579394 [0,0,0,2,0,0|0,0,2]=4 626 B15R2.69936 O=C(NC1CCCCCCC1)C2CC2 MCULE-7857555666 [0,0,0,2,0,0|2,0,0]=4