0 B8R0.6 C#CC(O)CCCCC MCULE-3860216745 [0,0,0,0,0,0|0,0,2]=2 1 B8R0.6 C#CC(O)CCCCC MCULE-6741270715 [0,0,0,0,0,0|0,0,2]=2 2 B8R0.6 C#C[C@@H](O)CCCCC MCULE-2098834943 [0,0,0,0,0,0|0,0,2]=2 3 B8R0.6 C#C[C@@H](O)CCCCC MCULE-4627033805 [0,0,0,0,0,0|0,0,2]=2 4 B8R0.6 C#C[C@H](O)CCCCC MCULE-6006340759 [0,0,0,0,0,0|0,0,2]=2 5 B8R0.6 C#C[C@H](O)CCCCC MCULE-8399407443 [0,0,0,0,0,0|0,0,2]=2 6 B8R0.6 C=CC(=O)CCCCC MCULE-9094274880 [0,0,0,0,0,0|0,0,2]=2 7 B8R0.6 C=CC(=O)NCCCC MCULE-9365109925 [0,0,0,0,0,0|1,0,2]=3 8 B8R0.6 C=CC(=O)NCCOC MCULE-1939884493 [0,0,0,0,0,0|2,0,2]=4 9 B8R0.6 C=CC(=O)OCCCC MCULE-6944090543 [0,0,0,0,0,0|1,0,2]=3 10 B8R0.6 C=CC(=O)OCCCO MCULE-7957370216 [0,0,0,0,0,0|2,0,2]=4 11 B8R0.6 C=CC(=O)OCCOC MCULE-6865078247 [0,0,0,0,0,0|2,0,2]=4 12 B8R0.6 C=CC(O)CCCCC MCULE-3974016765 [0,0,0,0,0,0|0,0,0]=0 13 B8R0.6 CCC#CCC(O)CC MCULE-9738694630 [0,0,0,0,0,0|0,0,4]=4 14 B8R0.6 CCC(C)CCCCO MCULE-9107164434 [0,0,0,0,0,0|2,0,2]=4 15 B8R0.6 CCCCCC(=N)NO MCULE-4721600537 [0,0,0,0,0,0|3,0,1]=4 16 B8R0.6 CCCCCC(=O)CBr MCULE-6642335283 [0,0,0,0,0,0|1,0,3]=4 17 B8R0.6 CCCCCC(=O)CC MCULE-2012071553 [0,0,0,0,0,0|0,0,4]=4 18 B8R0.6 CCCCCC(=O)NN MCULE-3138841743 [0,0,0,0,0,0|2,0,2]=4 19 B8R0.6 CCCCCC(=O)NO MCULE-8432990947 [0,0,0,0,0,0|2,0,2]=4 20 B8R0.6 CCCCCC(=O)OC MCULE-2317616388 [0,0,0,0,0,0|1,0,3]=4 21 B8R0.6 CCCCCC(Br)CBr MCULE-6200544642 [0,0,0,0,0,0|2,0,1]=3 22 B8R0.6 CCCCCC(C)CC MCULE-8343490845 [0,0,0,0,0,0|1,0,2]=3 23 B8R0.6 CCCCCC(C)CO MCULE-4884757032 [0,0,0,0,0,0|2,0,1]=3 24 B8R0.6 CCCCCC(O)CC MCULE-6682377557 [0,0,0,0,0,0|0,0,2]=2 25 B8R0.6 CCCCCC(O)CCl MCULE-5610334497 [0,0,0,0,0,0|1,0,1]=2 26 B8R0.6 CCCCCC(O)CN MCULE-6091710122 [0,0,0,0,0,0|1,0,1]=2 27 B8R0.6 CCCCCC(O)CO MCULE-4124719814 [0,0,0,0,0,0|1,0,1]=2 28 B8R0.6 CCCCCN(C)N=O MCULE-6706578173 [0,0,0,0,0,0|4,0,0]=4 29 B8R0.6 CCCCNC(C)CC MCULE-9849866712 [0,0,0,0,0,0|2,0,2]=4 30 B8R0.6 CCCCOC(=O)C=O MCULE-1707513945 [0,0,0,0,0,0|2,0,2]=4 31 B8R0.6 CCCNCC(O)CO MCULE-1611893086 [0,0,0,0,0,0|2,0,1]=3 32 B8R0.6 CCCOCC(C)CO MCULE-8326797774 [0,0,0,0,0,0|3,0,1]=4 33 B8R0.6 CCCOCC(O)CO MCULE-8815613620 [0,0,0,0,0,0|2,0,1]=3 34 B8R0.6 CCCOC[C@H](O)CO MCULE-7750792134 [0,0,0,0,0,0|2,0,1]=3 35 B8R0.6 CCSCCC(C)NC MCULE-8576737073 [0,0,0,0,0,0|3,0,1]=4 36 B8R0.6 CC[C@H](C)CCCCO MCULE-2674922341 [0,0,0,0,0,0|2,0,2]=4 37 B8R0.6 CC[C@H](C)CCCCO MCULE-7482991055 [0,0,0,0,0,0|2,0,2]=4 38 B8R0.6 N#CC(O)CCCCO MCULE-3554580179 [0,0,0,0,0,0|2,0,1]=3 39 B8R0.6 NCCCCC(N)CO MCULE-5938273372 [0,0,0,0,0,0|3,0,1]=4 40 B8R0.6 NCCCCC(N)CO MCULE-9464237285 [0,0,0,0,0,0|3,0,1]=4 41 B8R0.6 NCCCCC(N)CS MCULE-1078097453 [0,0,0,0,0,0|3,0,1]=4 42 B8R0.6 NCCCC[C@H](N)CO MCULE-4735749396 [0,0,0,0,0,0|3,0,1]=4 43 B8R0.6 NCCCC[C@H](N)CO MCULE-6997150748 [0,0,0,0,0,0|3,0,1]=4 44 B8R0.6 NCCCC[C@H](N)CO MCULE-7936699760 [0,0,0,0,0,0|3,0,1]=4 45 B8R0.6 NCCCC[C@H](N)CO MCULE-9135547877 [0,0,0,0,0,0|3,0,1]=4 46 B8R0.6 NCCNCC(O)CO MCULE-4818647623 [0,0,0,0,0,0|3,0,1]=4 47 B8R0.6 OC(CCl)COCCCl MCULE-4547951832 [0,0,0,0,0,0|3,0,1]=4 48 B8R0.6 OCCCCC(O)CO MCULE-5891501842 [0,0,0,0,0,0|2,0,1]=3 49 B8R0.6 OCCNCC(O)CO MCULE-1632492020 [0,0,0,0,0,0|3,0,1]=4 50 B8R0.6 OCCOCC(O)CCl MCULE-1530998868 [0,0,0,0,0,0|3,0,1]=4 51 B8R0.6 OCCOCC(O)CO MCULE-4768071463 [0,0,0,0,0,0|3,0,1]=4 52 B8R0.6 [C@H](O)(CC)CCCCC MCULE-7121730436 [0,0,0,0,0,0|0,0,2]=2 53 B8R0.6 [NH3+]CCCCC([NH3+])CBr MCULE-2049014685 [0,0,0,0,0,0|3,0,1]=4 54 B8R0.6 [NH3+]CCCCC([NH3+])CBr MCULE-6467063594 [0,0,0,0,0,0|3,0,1]=4 55 B7R0.1 BrCCCCCCBr MCULE-5187406804 [1,0,0,0,0,0|2,0,1]=4 56 B7R0.1 C#CCCCCC=O MCULE-2019630243 [1,0,0,0,0,0|1,0,2]=4 57 B7R0.1 C#CCCCCCBr MCULE-1618292603 [1,0,0,0,0,0|1,0,2]=4 58 B7R0.1 C#CCCCCCC MCULE-4406928583 [1,0,0,0,0,0|0,0,2]=3 59 B7R0.1 C#CCCCCCCl MCULE-2788042800 [1,0,0,0,0,0|1,0,2]=4 60 B7R0.1 C#CCCCCCN MCULE-3067915237 [1,0,0,0,0,0|1,0,2]=4 61 B7R0.1 C#CCCCCCO MCULE-2909503471 [1,0,0,0,0,0|1,0,2]=4 62 B7R0.1 C#CCNCCCC MCULE-4241072719 [1,0,0,0,0,0|1,0,2]=4 63 B7R0.1 C/C=C/CCCCC MCULE-6911363331 [1,0,0,0,0,0|0,0,2]=3 64 B7R0.1 C/C=C\CCCCC MCULE-9470036254 [1,0,0,0,0,0|0,0,2]=3 65 B7R0.1 C=CCC#CCCO MCULE-2960075392 [1,0,0,0,0,0|1,0,2]=4 66 B7R0.1 C=CCC=CCCC MCULE-5753699682 [1,0,0,0,0,0|0,0,2]=3 67 B7R0.1 C=CCCCCC#N MCULE-5195400885 [1,0,0,0,0,0|1,0,1]=3 68 B7R0.1 C=CCCCCC=C MCULE-9285021489 [1,0,0,0,0,0|0,0,2]=3 69 B7R0.1 C=CCCCCC=O MCULE-6786275827 [1,0,0,0,0,0|1,0,1]=3 70 B7R0.1 C=CCCCCCBr MCULE-7782876660 [1,0,0,0,0,0|1,0,0]=2 71 B7R0.1 C=CCCCCCC MCULE-6867393536 [1,0,0,0,0,0|0,0,0]=1 72 B7R0.1 C=CCCCCCCl MCULE-2205880878 [1,0,0,0,0,0|1,0,0]=2 73 B7R0.1 C=CCCCCCI MCULE-1823596954 [1,0,0,0,0,0|1,0,0]=2 74 B7R0.1 C=CCCCCCN MCULE-2913783474 [1,0,0,0,0,0|1,0,0]=2 75 B7R0.1 C=CCCCCCN MCULE-9545708862 [1,0,0,0,0,0|1,0,0]=2 76 B7R0.1 C=CCCCCCO MCULE-1200112990 [1,0,0,0,0,0|1,0,0]=2 77 B7R0.1 C=CCCCCNC MCULE-3676018759 [1,0,0,0,0,0|1,0,0]=2 78 B7R0.1 C=CCCCCNC MCULE-9443600983 [1,0,0,0,0,0|1,0,0]=2 79 B7R0.1 C=CCCCCON MCULE-1155744928 [1,0,0,0,0,0|2,0,0]=3 80 B7R0.1 C=CCCCCON MCULE-1741904620 [1,0,0,0,0,0|2,0,0]=3 81 B7R0.1 C=CCCCN=C=S MCULE-8494947981 [1,0,0,0,0,0|2,0,1]=4 82 B7R0.1 C=CCCCNCC MCULE-2141378110 [1,0,0,0,0,0|1,0,0]=2 83 B7R0.1 C=CCCCNCC MCULE-4269657694 [1,0,0,0,0,0|1,0,0]=2 84 B7R0.1 C=CCCCOCCl MCULE-1172012073 [1,0,0,0,0,0|2,0,0]=3 85 B7R0.1 C=CCCNCC=C MCULE-3056921517 [1,0,0,0,0,0|1,0,2]=4 86 B7R0.1 C=CCCNCCO MCULE-8357008337 [1,0,0,0,0,0|2,0,0]=3 87 B7R0.1 C=CCCOCCN MCULE-5958891740 [1,0,0,0,0,0|2,0,0]=3 88 B7R0.1 C=CCCOCCO MCULE-5369849290 [1,0,0,0,0,0|2,0,0]=3 89 B7R0.1 C=CCCSCCN MCULE-5541844264 [1,0,0,0,0,0|2,0,0]=3 90 B7R0.1 C=CCNCC#CC MCULE-4083257639 [1,0,0,0,0,0|1,0,2]=4 91 B7R0.1 C=CCNCC#CC MCULE-8111632143 [1,0,0,0,0,0|1,0,2]=4 92 B7R0.1 C=CCNCCC#N MCULE-5558306546 [1,0,0,0,0,0|2,0,1]=4 93 B7R0.1 C=CCNCCC#N MCULE-9740464837 [1,0,0,0,0,0|2,0,1]=4 94 B7R0.1 C=CCNCCOC MCULE-6576578655 [1,0,0,0,0,0|2,0,0]=3 95 B7R0.1 C=CCOCCC=O MCULE-3332311483 [1,0,0,0,0,0|2,0,1]=4 96 B7R0.1 C=CCOCCCBr MCULE-7892533278 [1,0,0,0,0,0|2,0,0]=3 97 B7R0.1 C=CCOCCCC MCULE-2214755289 [1,0,0,0,0,0|1,0,0]=2 98 B7R0.1 C=CCOCCCN MCULE-4862923195 [1,0,0,0,0,0|2,0,0]=3 99 B7R0.1 C=CCOCCOC MCULE-7363927527 [1,0,0,0,0,0|2,0,0]=3 100 B7R0.1 C=CCSCCCC MCULE-4868736488 [1,0,0,0,0,0|1,0,0]=2 101 B7R0.1 C=CCSSCCC MCULE-1309818617 [1,0,0,0,0,0|2,0,0]=3 102 B7R0.1 C=COCCCCC MCULE-4024159480 [1,0,0,0,0,0|1,0,0]=2 103 B7R0.1 C=COCCCCO MCULE-3537265926 [1,0,0,0,0,0|2,0,0]=3 104 B7R0.1 CC#CCCCC=O MCULE-9621727341 [1,0,0,0,0,0|1,0,2]=4 105 B7R0.1 CC#CCCCCC MCULE-3651650902 [1,0,0,0,0,0|0,0,3]=4 106 B7R0.1 CC/C=C\CCC=O MCULE-5862165111 [1,0,0,0,0,0|1,0,2]=4 107 B7R0.1 CC=CCCCCC MCULE-7111489659 [1,0,0,0,0,0|0,0,2]=3 108 B7R0.1 CC=CCCCCO MCULE-8707373340 [1,0,0,0,0,0|1,0,2]=4 109 B7R0.1 CCC=CCCC=O MCULE-1386777548 [1,0,0,0,0,0|1,0,2]=4 110 B7R0.1 CCCC/C=C/C=O MCULE-1260131686 [1,0,0,0,0,0|1,0,2]=4 111 B7R0.1 CCCCC#CC=O MCULE-6973833394 [1,0,0,0,0,0|1,0,2]=4 112 B7R0.1 CCCCC=CC=O MCULE-6776317009 [1,0,0,0,0,0|1,0,2]=4 113 B7R0.1 CCCCCC=CI MCULE-9964634818 [1,0,0,0,0,0|1,0,1]=3 114 B7R0.1 CCCCCCC#N MCULE-7652123212 [1,0,0,0,0,0|1,0,1]=3 115 B7R0.1 CCCCCCC=O MCULE-5251820425 [1,0,0,0,0,0|1,0,0]=2 116 B7R0.1 CCCCCCCBr MCULE-8042829299 [1,0,0,0,0,0|1,0,1]=3 117 B7R0.1 CCCCCCCC MCULE-3248084959 [1,0,0,0,0,0|0,0,2]=3 118 B7R0.1 CCCCCCCCl MCULE-6286146566 [1,0,0,0,0,0|1,0,1]=3 119 B7R0.1 CCCCCCCF MCULE-9794868174 [1,0,0,0,0,0|1,0,1]=3 120 B7R0.1 CCCCCCCI MCULE-2930393920 [1,0,0,0,0,0|1,0,1]=3 121 B7R0.1 CCCCCCCN MCULE-1126747714 [1,0,0,0,0,0|1,0,1]=3 122 B7R0.1 CCCCCCCO MCULE-5882959353 [1,0,0,0,0,0|1,0,1]=3 123 B7R0.1 CCCCCCCS MCULE-3901364910 [1,0,0,0,0,0|1,0,1]=3 124 B7R0.1 CCCCCCNC MCULE-1828296852 [1,0,0,0,0,0|1,0,1]=3 125 B7R0.1 CCCCCCNN MCULE-5116098983 [1,0,0,0,0,0|2,0,0]=3 126 B7R0.1 CCCCCCNO MCULE-4175875706 [1,0,0,0,0,0|2,0,0]=3 127 B7R0.1 CCCCCCNO MCULE-8719557426 [1,0,0,0,0,0|2,0,0]=3 128 B7R0.1 CCCCCCOC MCULE-7148964901 [1,0,0,0,0,0|1,0,1]=3 129 B7R0.1 CCCCCCON MCULE-1836746134 [1,0,0,0,0,0|2,0,0]=3 130 B7R0.1 CCCCCCON MCULE-9566158736 [1,0,0,0,0,0|2,0,0]=3 131 B7R0.1 CCCCCN=C=O MCULE-6020523044 [1,0,0,0,0,0|2,0,1]=4 132 B7R0.1 CCCCCN=C=S MCULE-3433224152 [1,0,0,0,0,0|2,0,1]=4 133 B7R0.1 CCCCCN=N#N MCULE-3738662950 [1,0,0,0,0,0|3,0,0]=4 134 B7R0.1 CCCCCOC=O MCULE-2718009140 [1,0,0,0,0,0|2,0,0]=3 135 B7R0.1 CCCCCOCC MCULE-6346670527 [1,0,0,0,0,0|1,0,2]=4 136 B7R0.1 CCCCCON=O MCULE-8065075083 [1,0,0,0,0,0|3,0,0]=4 137 B7R0.1 CCCCCSC#N MCULE-8334022047 [1,0,0,0,0,0|2,0,1]=4 138 B7R0.1 CCCCNCC#N MCULE-1687580908 [1,0,0,0,0,0|2,0,1]=4 139 B7R0.1 CCCCNCCC MCULE-6342731867 [1,0,0,0,0,0|1,0,2]=4 140 B7R0.1 CCCCNCCN MCULE-3865190511 [1,0,0,0,0,0|2,0,1]=4 141 B7R0.1 CCCCNCCO MCULE-3582031814 [1,0,0,0,0,0|2,0,1]=4 142 B7R0.1 CCCCNCCS MCULE-6926403617 [1,0,0,0,0,0|2,0,1]=4 143 B7R0.1 CCCCOCCBr MCULE-5314812532 [1,0,0,0,0,0|2,0,1]=4 144 B7R0.1 CCCCOCCCl MCULE-9147804479 [1,0,0,0,0,0|2,0,1]=4 145 B7R0.1 CCCCOCCI MCULE-3571589392 [1,0,0,0,0,0|2,0,1]=4 146 B7R0.1 CCCCOCCN MCULE-1817743996 [1,0,0,0,0,0|2,0,1]=4 147 B7R0.1 CCCCOCCN MCULE-3658840205 [1,0,0,0,0,0|2,0,1]=4 148 B7R0.1 CCCCOCCO MCULE-1727546427 [1,0,0,0,0,0|2,0,1]=4 149 B7R0.1 CCCCOCCO MCULE-4417721312 [1,0,0,0,0,0|2,0,1]=4 150 B7R0.1 CCCCOCCS MCULE-7419398753 [1,0,0,0,0,0|2,0,1]=4 151 B7R0.1 CCCCSCC#N MCULE-9529960668 [1,0,0,0,0,0|2,0,1]=4 152 B7R0.1 CCCCSCCC MCULE-3137952516 [1,0,0,0,0,0|1,0,2]=4 153 B7R0.1 CCCCSCCN MCULE-3521818954 [1,0,0,0,0,0|2,0,1]=4 154 B7R0.1 CCCCSCCN MCULE-5281011566 [1,0,0,0,0,0|2,0,1]=4 155 B7R0.1 CCCCSCCO MCULE-8791357083 [1,0,0,0,0,0|2,0,1]=4 156 B7R0.1 CCCCSCCS MCULE-4109311315 [1,0,0,0,0,0|2,0,1]=4 157 B7R0.1 CCCNCCC#N MCULE-4350757262 [1,0,0,0,0,0|2,0,1]=4 158 B7R0.1 CCCNCCCN MCULE-6668094176 [1,0,0,0,0,0|2,0,1]=4 159 B7R0.1 CCCNCCCO MCULE-4366982860 [1,0,0,0,0,0|2,0,1]=4 160 B7R0.1 CCCNCCNC MCULE-3857593384 [1,0,0,0,0,0|2,0,1]=4 161 B7R0.1 CCCNCCOC MCULE-4425567647 [1,0,0,0,0,0|2,0,1]=4 162 B7R0.1 CCCOCCCN MCULE-5875738973 [1,0,0,0,0,0|2,0,1]=4 163 B7R0.1 CCCSCCCN MCULE-2911445961 [1,0,0,0,0,0|2,0,1]=4 164 B7R0.1 CCNCCCCO MCULE-4851249509 [1,0,0,0,0,0|2,0,1]=4 165 B7R0.1 CCOCCCC#N MCULE-6256619755 [1,0,0,0,0,0|2,0,1]=4 166 B7R0.1 CCOCCCCN MCULE-6583734908 [1,0,0,0,0,0|2,0,1]=4 167 B7R0.1 CCOCCCCO MCULE-9986213119 [1,0,0,0,0,0|2,0,1]=4 168 B7R0.1 CCSCCCC#N MCULE-4186353737 [1,0,0,0,0,0|2,0,1]=4 169 B7R0.1 CCSCCCCN MCULE-7961306984 [1,0,0,0,0,0|2,0,1]=4 170 B7R0.1 CCSCCCCO MCULE-1712194349 [1,0,0,0,0,0|2,0,1]=4 171 B7R0.1 CNCCCCCN MCULE-8023367999 [1,0,0,0,0,0|2,0,1]=4 172 B7R0.1 CNCCCCCO MCULE-2988249730 [1,0,0,0,0,0|2,0,1]=4 173 B7R0.1 CNCCCCCO MCULE-8033733525 [1,0,0,0,0,0|2,0,1]=4 174 B7R0.1 CNCCCCNC MCULE-4466243376 [1,0,0,0,0,0|2,0,1]=4 175 B7R0.1 CNCCCCOC MCULE-3203262011 [1,0,0,0,0,0|2,0,1]=4 176 B7R0.1 COCCCCC#N MCULE-5969342869 [1,0,0,0,0,0|2,0,1]=4 177 B7R0.1 COCCCCCBr MCULE-9843465236 [1,0,0,0,0,0|2,0,1]=4 178 B7R0.1 COCCCCCCl MCULE-6956815361 [1,0,0,0,0,0|2,0,1]=4 179 B7R0.1 COCCCCCN MCULE-2109050097 [1,0,0,0,0,0|2,0,1]=4 180 B7R0.1 COCCCCCO MCULE-6003118644 [1,0,0,0,0,0|2,0,1]=4 181 B7R0.1 COCCCCOC MCULE-3614881304 [1,0,0,0,0,0|2,0,1]=4 182 B7R0.1 COCCOCC=O MCULE-2621317944 [1,0,0,0,0,0|3,0,0]=4 183 B7R0.1 COCOCCC=O MCULE-3632276453 [1,0,0,0,0,0|3,0,0]=4 184 B7R0.1 CSCCCCC#N MCULE-5901122432 [1,0,0,0,0,0|2,0,1]=4 185 B7R0.1 CSCCCCCN MCULE-8771942873 [1,0,0,0,0,0|2,0,1]=4 186 B7R0.1 CSCCCCCO MCULE-3422729293 [1,0,0,0,0,0|2,0,1]=4 187 B7R0.1 ClCCCCCCBr MCULE-7471712605 [1,0,0,0,0,0|2,0,1]=4 188 B7R0.1 ClCCCCCCCl MCULE-2423183693 [1,0,0,0,0,0|2,0,1]=4 189 B7R0.1 ClCCCCCCI MCULE-2662361744 [1,0,0,0,0,0|2,0,1]=4 190 B7R0.1 FCCCCCCBr MCULE-9238324978 [1,0,0,0,0,0|2,0,1]=4 191 B7R0.1 ICCCCCCI MCULE-1005202656 [1,0,0,0,0,0|2,0,1]=4 192 B7R0.1 N#CCCCCCBr MCULE-2014100603 [1,0,0,0,0,0|2,0,1]=4 193 B7R0.1 N#CCCCCCCl MCULE-1324928568 [1,0,0,0,0,0|2,0,1]=4 194 B7R0.1 N#CCCCCCN MCULE-4837507252 [1,0,0,0,0,0|2,0,1]=4 195 B7R0.1 NCCCCCCBr MCULE-4017495581 [1,0,0,0,0,0|2,0,1]=4 196 B7R0.1 NCCCCCCBr MCULE-4048883510 [1,0,0,0,0,0|2,0,1]=4 197 B7R0.1 NCCCCCCN MCULE-1038764376 [1,0,0,0,0,0|2,0,1]=4 198 B7R0.1 NCCCCCCN MCULE-3766020930 [1,0,0,0,0,0|2,0,1]=4 199 B7R0.1 NCCCCCCN MCULE-9535729200 [1,0,0,0,0,0|2,0,1]=4 200 B7R0.1 NCCCCCCO MCULE-2264326846 [1,0,0,0,0,0|2,0,1]=4 201 B7R0.1 NCCCCCCS MCULE-3764839885 [1,0,0,0,0,0|2,0,1]=4 202 B7R0.1 NCCCCCCS MCULE-5822376723 [1,0,0,0,0,0|2,0,1]=4 203 B7R0.1 O=CCCCCC=O MCULE-3751145550 [1,0,0,0,0,0|2,0,1]=4 204 B7R0.1 O=CCCCCCBr MCULE-7014516847 [1,0,0,0,0,0|2,0,0]=3 205 B7R0.1 O=CCCCCCCl MCULE-8269912560 [1,0,0,0,0,0|2,0,0]=3 206 B7R0.1 O=CCCCCCF MCULE-8174281286 [1,0,0,0,0,0|2,0,0]=3 207 B7R0.1 O=CCCCCCO MCULE-3978349845 [1,0,0,0,0,0|2,0,0]=3 208 B7R0.1 O=CCCCCCO MCULE-4997016680 [1,0,0,0,0,0|2,0,0]=3 209 B7R0.1 OCCCCCCBr MCULE-3500356936 [1,0,0,0,0,0|2,0,1]=4 210 B7R0.1 OCCCCCCCl MCULE-4507452440 [1,0,0,0,0,0|2,0,1]=4 211 B7R0.1 OCCCCCCF MCULE-7082491218 [1,0,0,0,0,0|2,0,1]=4 212 B7R0.1 OCCCCCCI MCULE-3710706648 [1,0,0,0,0,0|2,0,1]=4 213 B7R0.1 OCCCCCCO MCULE-8817570517 [1,0,0,0,0,0|2,0,1]=4 214 B7R0.1 OCCCCCCS MCULE-9135853131 [1,0,0,0,0,0|2,0,1]=4 215 B7R0.1 SCCCCCCS MCULE-2873828857 [1,0,0,0,0,0|2,0,1]=4 216 B7R0.1 [NH3+]CCCCCC[NH3+] MCULE-2211304471 [1,0,0,0,0,0|2,0,1]=4 217 B7R0.3 C#CC(O)CCCC MCULE-8547184224 [1,0,0,0,0,0|0,0,2]=3 218 B7R0.3 C=C(C=O)CCCC MCULE-4974026399 [1,0,0,0,0,0|2,0,1]=4 219 B7R0.3 C=CC(=C)CCCO MCULE-3558306961 [1,0,0,0,0,0|2,0,1]=4 220 B7R0.3 C=CC(=O)CCCCl MCULE-7188402172 [1,0,0,0,0,0|1,0,2]=4 221 B7R0.3 C=CC(=O)NCCC MCULE-5704500398 [1,0,0,0,0,0|1,0,2]=4 222 B7R0.3 C=CC(=O)OCCC MCULE-5292603407 [1,0,0,0,0,0|1,0,2]=4 223 B7R0.3 C=CC(O)CCCC MCULE-1674668011 [1,0,0,0,0,0|0,0,0]=1 224 B7R0.3 CCC(O)CCCN MCULE-1491163174 [1,0,0,0,0,0|1,0,2]=4 225 B7R0.3 CCC(O)CCCN MCULE-5150508895 [1,0,0,0,0,0|1,0,2]=4 226 B7R0.3 CCC(O)CCCO MCULE-1099760826 [1,0,0,0,0,0|1,0,2]=4 227 B7R0.3 CCC(O)CCOC MCULE-1245099360 [1,0,0,0,0,0|1,0,2]=4 228 B7R0.3 CCCCC(Br)CBr MCULE-9142273359 [1,0,0,0,0,0|2,0,1]=4 229 B7R0.3 CCCCC(Br)CC MCULE-3813549657 [1,0,0,0,0,0|1,0,2]=4 230 B7R0.3 CCCCC(C)CC MCULE-9471981954 [1,0,0,0,0,0|1,0,2]=4 231 B7R0.3 CCCCC(C)NC MCULE-7492621121 [1,0,0,0,0,0|2,0,1]=4 232 B7R0.3 CCCCC(Cl)C#N MCULE-3338809987 [1,0,0,0,0,0|2,0,1]=4 233 B7R0.3 CCCCC(Cl)C=O MCULE-7474969991 [1,0,0,0,0,0|2,0,0]=3 234 B7R0.3 CCCCC(Cl)CCl MCULE-6681580076 [1,0,0,0,0,0|2,0,1]=4 235 B7R0.3 CCCCC(N)CC MCULE-1353863738 [1,0,0,0,0,0|1,0,2]=4 236 B7R0.3 CCCCC(N)CC MCULE-9870475040 [1,0,0,0,0,0|1,0,2]=4 237 B7R0.3 CCCCC(N)CN MCULE-2038464943 [1,0,0,0,0,0|2,0,1]=4 238 B7R0.3 CCCCC(N)CO MCULE-1874423109 [1,0,0,0,0,0|2,0,1]=4 239 B7R0.3 CCCCC(N)CO MCULE-2041767659 [1,0,0,0,0,0|2,0,1]=4 240 B7R0.3 CCCCC(N)CO MCULE-4533575851 [1,0,0,0,0,0|2,0,1]=4 241 B7R0.3 CCCCC(N)CO MCULE-7141990411 [1,0,0,0,0,0|2,0,1]=4 242 B7R0.3 CCCCC(O)CBr MCULE-8416535559 [1,0,0,0,0,0|1,0,1]=3 243 B7R0.3 CCCCC(O)CC MCULE-3912386534 [1,0,0,0,0,0|0,0,2]=3 244 B7R0.3 CCCCC(O)CN MCULE-1383380728 [1,0,0,0,0,0|1,0,1]=3 245 B7R0.3 CCCCC(O)CO MCULE-6903923961 [1,0,0,0,0,0|1,0,1]=3 246 B7R0.3 CCCC[C@@H](N)CO MCULE-1379297850 [1,0,0,0,0,0|2,0,1]=4 247 B7R0.3 CCCC[C@@H](N)CO MCULE-5016786633 [1,0,0,0,0,0|2,0,1]=4 248 B7R0.3 CCCC[C@@H](N)CO MCULE-6669873658 [1,0,0,0,0,0|2,0,1]=4 249 B7R0.3 CCCC[C@@H](N)CO MCULE-6809294141 [1,0,0,0,0,0|2,0,1]=4 250 B7R0.3 CCCC[C@H](C)C=O MCULE-7821873587 [1,0,0,0,0,0|2,0,0]=3 251 B7R0.3 CCCC[C@H](N)CO MCULE-3277509271 [1,0,0,0,0,0|2,0,1]=4 252 B7R0.3 CCCC[C@H](N)CO MCULE-5867397890 [1,0,0,0,0,0|2,0,1]=4 253 B7R0.3 CCNCC(O)CC MCULE-9820144398 [1,0,0,0,0,0|1,0,2]=4 254 B7R0.3 CCOCC(O)CCl MCULE-5119359541 [1,0,0,0,0,0|2,0,1]=4 255 B7R0.3 CCOCC(O)CN MCULE-2355759727 [1,0,0,0,0,0|2,0,1]=4 256 B7R0.3 CCOCC(O)CO MCULE-2728952355 [1,0,0,0,0,0|2,0,1]=4 257 B7R0.3 CSCCC(O)C#N MCULE-3484786988 [1,0,0,0,0,0|2,0,1]=4 258 B7R0.3 CSCCC(O)CN MCULE-3835830442 [1,0,0,0,0,0|2,0,1]=4 259 B7R0.3 OCCCC(O)CO MCULE-3529953491 [1,0,0,0,0,0|2,0,1]=4 260 B7R0.4 C#CCCCC(C)O MCULE-7136902430 [1,0,0,0,0,0|0,0,3]=4 261 B7R0.4 C#CCCC[C@@H](C)O MCULE-3650631732 [1,0,0,0,0,0|0,0,3]=4 262 B7R0.4 C=C(Br)CCCCC MCULE-3049831354 [1,0,0,0,0,0|1,0,1]=3 263 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [1,0,0,0,0,0|1,0,1]=3 264 B7R0.4 C=C(Cl)CCCCC MCULE-5074452982 [1,0,0,0,0,0|1,0,1]=3 265 B7R0.4 C=CCCCC(C)O MCULE-6692920526 [1,0,0,0,0,0|0,0,3]=4 266 B7R0.4 CC(Br)CCCCO MCULE-2106751856 [1,0,0,0,0,0|2,0,1]=4 267 B7R0.4 CC(C)CCCCBr MCULE-9236389539 [1,0,0,0,0,0|2,0,1]=4 268 B7R0.4 CC(C)CCCCCl MCULE-5223516486 [1,0,0,0,0,0|2,0,1]=4 269 B7R0.4 CC(C)CCCCN MCULE-3591523204 [1,0,0,0,0,0|2,0,1]=4 270 B7R0.4 CC(C)CCCCO MCULE-9053698607 [1,0,0,0,0,0|2,0,1]=4 271 B7R0.4 CC(Cl)CCCCCl MCULE-4829013540 [1,0,0,0,0,0|2,0,1]=4 272 B7R0.4 CC(N)CCCCN MCULE-3497267062 [1,0,0,0,0,0|2,0,1]=4 273 B7R0.4 CC(N)CCCCN MCULE-9887360104 [1,0,0,0,0,0|2,0,1]=4 274 B7R0.4 CC(N)CCCCO MCULE-7039935081 [1,0,0,0,0,0|2,0,1]=4 275 B7R0.4 CC(N)CCCCO MCULE-8167834378 [1,0,0,0,0,0|2,0,1]=4 276 B7R0.4 CC(O)CCCCO MCULE-3790969400 [1,0,0,0,0,0|1,0,1]=3 277 B7R0.4 CC(O)CNCCN MCULE-3904214677 [1,0,0,0,0,0|2,0,1]=4 278 B7R0.4 CC(O)CNCCO MCULE-4873845500 [1,0,0,0,0,0|2,0,1]=4 279 B7R0.4 CC(O)CSCCO MCULE-8885458360 [1,0,0,0,0,0|2,0,1]=4 280 B7R0.4 CCC#CCC(C)O MCULE-4633396611 [1,0,0,0,0,0|0,0,3]=4 281 B7R0.4 CCCC#CC(C)O MCULE-4333844811 [1,0,0,0,0,0|0,0,3]=4 282 B7R0.4 CCCCCB(O)O MCULE-3441747739 [1,0,0,0,0,0|2,0,0]=3 283 B7R0.4 CCCCCC(=N)N MCULE-4874167268 [1,0,0,0,0,0|2,0,1]=4 284 B7R0.4 CCCCCC(=N)N MCULE-6942690708 [1,0,0,0,0,0|2,0,1]=4 285 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [1,0,0,0,0,0|0,0,3]=4 286 B7R0.4 CCCCCC(=O)Cl MCULE-5446850478 [1,0,0,0,0,0|1,0,2]=4 287 B7R0.4 CCCCCC(=O)N MCULE-3215992514 [1,0,0,0,0,0|1,0,2]=4 288 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [1,0,0,0,0,0|1,0,1]=3 289 B7R0.4 CCCCCC(=O)[O-] MCULE-5310584661 [1,0,0,0,0,0|1,0,2]=4 290 B7R0.4 CCCCCC(=O)[O-] MCULE-9495078126 [1,0,0,0,0,0|1,0,2]=4 291 B7R0.4 CCCCCC(=S)N MCULE-7633089850 [1,0,0,0,0,0|1,1,1]=4 292 B7R0.4 CCCCCC(C)Br MCULE-4688847972 [1,0,0,0,0,0|1,0,1]=3 293 B7R0.4 CCCCCC(C)C MCULE-9815158757 [1,0,0,0,0,0|1,0,1]=3 294 B7R0.4 CCCCCC(C)Cl MCULE-1461261404 [1,0,0,0,0,0|1,0,1]=3 295 B7R0.4 CCCCCC(C)N MCULE-1307982487 [1,0,0,0,0,0|1,0,1]=3 296 B7R0.4 CCCCCC(C)N MCULE-8625441795 [1,0,0,0,0,0|1,0,1]=3 297 B7R0.4 CCCCCC(C)N MCULE-9791654909 [1,0,0,0,0,0|1,0,1]=3 298 B7R0.4 CCCCCC(C)O MCULE-2463855771 [1,0,0,0,0,0|0,0,1]=2 299 B7R0.4 CCCCCC(C)S MCULE-3173115736 [1,0,0,0,0,0|0,1,1]=3 300 B7R0.4 CCCCCN(=O)=O MCULE-6853489453 [1,0,0,0,0,0|2,0,1]=4 301 B7R0.4 CCCCCP(Cl)Cl MCULE-9695212092 [1,0,0,0,0,0|3,0,0]=4 302 B7R0.4 CCCCC[C@@H](C)N MCULE-2460238945 [1,0,0,0,0,0|1,0,1]=3 303 B7R0.4 CCCCC[C@@H](C)N MCULE-6386771130 [1,0,0,0,0,0|1,0,1]=3 304 B7R0.4 CCCCC[C@@H](C)N MCULE-6470246577 [1,0,0,0,0,0|1,0,1]=3 305 B7R0.4 CCCCC[C@@H](C)O MCULE-1984852239 [1,0,0,0,0,0|0,0,1]=2 306 B7R0.4 CCCCC[C@@H](C)O MCULE-2769933740 [1,0,0,0,0,0|0,0,1]=2 307 B7R0.4 CCCCC[C@H](C)N MCULE-8119988811 [1,0,0,0,0,0|1,0,1]=3 308 B7R0.4 CCCCC[C@H](C)N MCULE-9987283826 [1,0,0,0,0,0|1,0,1]=3 309 B7R0.4 CCCCC[C@H](C)O MCULE-2305379902 [1,0,0,0,0,0|0,0,1]=2 310 B7R0.4 CCCCC[C@H](C)O MCULE-5898721044 [1,0,0,0,0,0|0,0,1]=2 311 B7R0.4 CCCCNC(C)C MCULE-2695970517 [1,0,0,0,0,0|2,0,1]=4 312 B7R0.4 CCCCNC(C)C MCULE-9973816117 [1,0,0,0,0,0|2,0,1]=4 313 B7R0.4 CCCCOC(C)C MCULE-1504269570 [1,0,0,0,0,0|2,0,1]=4 314 B7R0.4 CCCCOC(Cl)Cl MCULE-2958816896 [1,0,0,0,0,0|3,0,0]=4 315 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [1,0,0,0,0,0|2,0,1]=4 316 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [1,0,0,0,0,0|2,0,1]=4 317 B7R0.4 CCCNCC(C)C MCULE-2869656642 [1,0,0,0,0,0|2,0,1]=4 318 B7R0.4 CCCNCC(C)O MCULE-8110237473 [1,0,0,0,0,0|1,0,1]=3 319 B7R0.4 CCCNCC(F)F MCULE-5407680209 [1,0,0,0,0,0|3,0,0]=4 320 B7R0.4 CCCNCC(F)F MCULE-9676670786 [1,0,0,0,0,0|3,0,0]=4 321 B7R0.4 CCCOCC(=O)O MCULE-6841640058 [1,0,0,0,0,0|2,0,1]=4 322 B7R0.4 CCCOCC(C)O MCULE-9214840563 [1,0,0,0,0,0|1,0,1]=3 323 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [1,0,0,0,0,0|2,0,1]=4 324 B7R0.4 CCNCCC(=O)O MCULE-4226597657 [1,0,0,0,0,0|2,0,1]=4 325 B7R0.4 CCNCCC(=O)O MCULE-9183951914 [1,0,0,0,0,0|2,0,1]=4 326 B7R0.4 CCOCCC(=O)O MCULE-3962084059 [1,0,0,0,0,0|2,0,1]=4 327 B7R0.4 CCSCCC(=O)O MCULE-9385724904 [1,0,0,0,0,0|2,0,1]=4 328 B7R0.4 CCSCCC(C)N MCULE-6854502332 [1,0,0,0,0,0|2,0,1]=4 329 B7R0.4 CNCCCC(=O)O MCULE-7598762485 [1,0,0,0,0,0|2,0,1]=4 330 B7R0.4 CNCCCC(=O)O MCULE-7877286915 [1,0,0,0,0,0|2,0,1]=4 331 B7R0.4 CNCCCC(C)C MCULE-1784678333 [1,0,0,0,0,0|2,0,1]=4 332 B7R0.4 COCCCC(=O)O MCULE-3165881573 [1,0,0,0,0,0|2,0,1]=4 333 B7R0.4 COCCCC(C)N MCULE-4298611846 [1,0,0,0,0,0|2,0,1]=4 334 B7R0.4 COCCCC(C)N MCULE-8139434838 [1,0,0,0,0,0|2,0,1]=4 335 B7R0.4 COCCCC(C)O MCULE-4190294636 [1,0,0,0,0,0|1,0,1]=3 336 B7R0.4 CSCCCC(=O)O MCULE-2126637794 [1,0,0,0,0,0|2,0,1]=4 337 B7R0.4 NCCCCC(=O)O MCULE-1155829905 [1,0,0,0,0,0|2,0,1]=4 338 B7R0.4 NCCCCC(=O)O MCULE-3920398524 [1,0,0,0,0,0|2,0,1]=4 339 B7R0.4 NCCCCC(=O)O MCULE-4404796498 [1,0,0,0,0,0|2,0,1]=4 340 B7R0.4 NCCCCC(=O)O MCULE-4971679857 [1,0,0,0,0,0|2,0,1]=4 341 B7R0.4 O=C(O)CCCCBr MCULE-2655919094 [1,0,0,0,0,0|2,0,1]=4 342 B7R0.4 O=C(O)CCCCCl MCULE-4094641005 [1,0,0,0,0,0|2,0,1]=4 343 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [1,0,0,0,0,0|2,0,1]=4 344 B7R0.4 O=C(O)CCCCS MCULE-2427465795 [1,0,0,0,0,0|2,0,1]=4 345 B7R0.4 OB(O)CCCCBr MCULE-3231135677 [1,0,0,0,0,0|3,0,0]=4 346 B9R0.1 C=CC(=O)OCCC(C)C MCULE-5192931697 [0,1,0,0,0,0|1,0,2]=4 347 B9R0.1 CC(C)CCCC(C)CO MCULE-8737374566 [0,1,0,0,0,0|2,0,1]=4 348 B9R0.1 CC(C)COCC(O)CN MCULE-5255759665 [0,1,0,0,0,0|2,0,1]=4 349 B9R0.1 CC(C)COCC(O)CO MCULE-6665926443 [0,1,0,0,0,0|2,0,1]=4 350 B9R0.1 CCC(C)CCCC(C)C MCULE-1067814067 [0,1,0,0,0,0|1,0,2]=4 351 B9R0.1 C[C@@H](N)COC[C@H](O)CCl MCULE-1215329842 [0,1,0,0,0,0|2,0,1]=4 352 B9R0.1 C[C@@H](N)COC[C@H](O)CCl MCULE-1680848350 [0,1,0,0,0,0|2,0,1]=4 353 B9R0.5 C/C=C/C(=O)OCCCC MCULE-3981123215 [0,1,0,0,0,0|1,0,2]=4 354 B9R0.5 C=CCC(C)CCCCC MCULE-2730037142 [0,1,0,0,0,0|1,0,0]=2 355 B9R0.5 C=CCC(O)CCCCC MCULE-6811117459 [0,1,0,0,0,0|0,0,0]=1 356 B9R0.5 C=CCN(C)CCNCC MCULE-7073350830 [0,1,0,0,0,0|3,0,0]=4 357 B9R0.5 C=CCN(C)CCNCC MCULE-8308418109 [0,1,0,0,0,0|3,0,0]=4 358 B9R0.5 C=COC(=O)CCCCC MCULE-9610448604 [0,1,0,0,0,0|0,0,2]=3 359 B9R0.5 CC=CC(=O)OCCCC MCULE-5053011213 [0,1,0,0,0,0|1,0,2]=4 360 B9R0.5 CCCCCC(C)CC=O MCULE-4528527314 [0,1,0,0,0,0|1,0,1]=3 361 B9R0.5 CCCCCC(C)CCBr MCULE-7502279942 [0,1,0,0,0,0|1,0,2]=4 362 B9R0.5 CCCCCC(C)CCC MCULE-5749911992 [0,1,0,0,0,0|1,0,2]=4 363 B9R0.5 CCCCCC(C)CCO MCULE-6787638248 [0,1,0,0,0,0|1,0,2]=4 364 B9R0.5 CCCCCC(C)N=C=S MCULE-1027041999 [0,1,0,0,0,0|2,0,1]=4 365 B9R0.5 CCCCCC(O)CCC MCULE-8117002289 [0,1,0,0,0,0|0,0,2]=3 366 B9R0.5 CCCCCC(O)CCO MCULE-7307683143 [0,1,0,0,0,0|0,0,2]=3 367 B9R0.5 CCCCC[C@@H](C)N=C=S MCULE-3380937652 [0,1,0,0,0,0|2,0,1]=4 368 B9R0.5 CCCCC[C@@H](C)N=C=S MCULE-7325784502 [0,1,0,0,0,0|2,0,1]=4 369 B9R0.5 CCCCC[C@H](C)N=C=S MCULE-8259893543 [0,1,0,0,0,0|2,0,1]=4 370 B9R0.5 CCCCC[C@H](C)N=C=S MCULE-9555596106 [0,1,0,0,0,0|2,0,1]=4 371 B9R0.8 C=CC(O)C(=O)OCCC MCULE-8001887534 [0,1,0,0,0,0|1,0,1]=3 372 B9R0.8 CCCCC(C)C(C)CC MCULE-4441142939 [0,1,0,0,0,0|1,0,2]=4 373 B9R0.8 COCCC(O)C(O)CO MCULE-8755237951 [0,1,0,0,0,0|2,0,1]=4 374 B9R0.8 COCC[C@H](O)[C@H](O)CO MCULE-6552589711 [0,1,0,0,0,0|2,0,1]=4 375 B9R0.20 CCCCCC(C)(C)C=O MCULE-9322679488 [0,1,0,0,0,0|2,0,0]=3 376 B9R0.20 CCCCCC(C)(C)CC MCULE-1624392380 [0,1,0,0,0,0|1,0,2]=4 377 B9R0.20 CCCCCC(C)(C)CN MCULE-5282463066 [0,1,0,0,0,0|2,0,1]=4 378 B9R0.20 CCCCCC(C)(O)CC MCULE-1815029739 [0,1,0,0,0,0|0,0,2]=3 379 B9R0.20 CCOCCC(C)(C)C=O MCULE-2777298648 [0,1,0,0,0,0|3,0,0]=4 380 B9R0.24 CCC(C)CCC(C)CO MCULE-2874782306 [0,1,0,0,0,0|2,0,1]=4 381 B9R0.24 CCC(O)CCC(O)CC MCULE-1642680986 [0,1,0,0,0,0|0,0,2]=3 382 B9R0.24 CC[C@@H](O)CC[C@H](O)CC MCULE-1865073881 [0,1,0,0,0,0|0,0,2]=3 383 B9R0.24 CC[C@@H](O)CC[C@H](O)CC MCULE-3722023249 [0,1,0,0,0,0|0,0,2]=3 384 B9R0.24 CC[C@H](O)CC[C@@H](O)CC MCULE-2960364022 [0,1,0,0,0,0|0,0,2]=3 385 B9R0.24 CC[C@H](O)CC[C@@H](O)CC MCULE-6575186172 [0,1,0,0,0,0|0,0,2]=3 386 B9R0.34 C=CC(O)CC(=O)OCC MCULE-2209401732 [0,1,0,0,0,0|1,0,1]=3 387 B9R0.34 CCCC(C)CC(C)CC MCULE-6332739976 [0,1,0,0,0,0|1,0,2]=4 388 B9R0.46 C#CC(O)CCCCCBr MCULE-4507050415 [0,1,0,0,0,0|0,0,2]=3 389 B9R0.46 C#CC(O)CCCCCC MCULE-7473928469 [0,1,0,0,0,0|0,0,2]=3 390 B9R0.46 C=CC(=O)CCCCCC MCULE-4486396694 [0,1,0,0,0,0|0,0,2]=3 391 B9R0.46 C=CC(=O)NCCCCO MCULE-8904662179 [0,1,0,0,0,0|1,0,2]=4 392 B9R0.46 C=CC(=O)NCCCOC MCULE-8394671492 [0,1,0,0,0,0|1,0,2]=4 393 B9R0.46 C=CC(=O)OCCCCBr MCULE-9764748740 [0,1,0,0,0,0|1,0,2]=4 394 B9R0.46 C=CC(=O)OCCCCC MCULE-6727835934 [0,1,0,0,0,0|0,0,2]=3 395 B9R0.46 C=CC(=O)OCCCCCl MCULE-6562256525 [0,1,0,0,0,0|1,0,2]=4 396 B9R0.46 C=CC(=O)OCCCCO MCULE-5659811687 [0,1,0,0,0,0|1,0,2]=4 397 B9R0.46 C=CC(=O)OCCOCC MCULE-4004586372 [0,1,0,0,0,0|1,0,2]=4 398 B9R0.46 C=CC(O)CCCCCC MCULE-8553741195 [0,1,0,0,0,0|0,0,0]=1 399 B9R0.46 C=CCCCCC(O)CN MCULE-2170358695 [0,1,0,0,0,0|1,0,2]=4 400 B9R0.46 C=CCCCCC(O)CO MCULE-9731075660 [0,1,0,0,0,0|1,0,2]=4 401 B9R0.46 CCC(C)CCCCCO MCULE-2502680966 [0,1,0,0,0,0|1,0,2]=4 402 B9R0.46 CCCCCCC(Br)CBr MCULE-3379995276 [0,1,0,0,0,0|2,0,1]=4 403 B9R0.46 CCCCCCC(C)C#N MCULE-9341747817 [0,1,0,0,0,0|2,0,1]=4 404 B9R0.46 CCCCCCC(C)C=O MCULE-4073561137 [0,1,0,0,0,0|2,0,0]=3 405 B9R0.46 CCCCCCC(C)CBr MCULE-4123455914 [0,1,0,0,0,0|2,0,1]=4 406 B9R0.46 CCCCCCC(C)CC MCULE-3624776298 [0,1,0,0,0,0|1,0,2]=4 407 B9R0.46 CCCCCCC(C)CO MCULE-7202468291 [0,1,0,0,0,0|2,0,1]=4 408 B9R0.46 CCCCCCC(C)NN MCULE-7546667258 [0,1,0,0,0,0|3,0,0]=4 409 B9R0.46 CCCCCCC(C)NN MCULE-9220046974 [0,1,0,0,0,0|3,0,0]=4 410 B9R0.46 CCCCCCC(Cl)C=O MCULE-9755396866 [0,1,0,0,0,0|2,0,0]=3 411 B9R0.46 CCCCCCC(Cl)CCl MCULE-7909703582 [0,1,0,0,0,0|2,0,1]=4 412 B9R0.46 CCCCCCC(O)CBr MCULE-4248488641 [0,1,0,0,0,0|1,0,1]=3 413 B9R0.46 CCCCCCC(O)CC MCULE-7543978401 [0,1,0,0,0,0|0,0,2]=3 414 B9R0.46 CCCCCCC(O)CO MCULE-7396593748 [0,1,0,0,0,0|1,0,1]=3 415 B9R0.46 CCCCCC[C@@H](O)CO MCULE-9540453574 [0,1,0,0,0,0|1,0,1]=3 416 B9R0.46 CCCCCC[C@H](O)CO MCULE-8481484883 [0,1,0,0,0,0|1,0,1]=3 417 B9R0.46 CCCCOCC(O)CC MCULE-2411357752 [0,1,0,0,0,0|0,0,2]=3 418 B9R0.46 CCCCOCC(O)CCl MCULE-6855689044 [0,1,0,0,0,0|1,0,1]=3 419 B9R0.46 CCCCOCC(O)CN MCULE-1971283908 [0,1,0,0,0,0|1,0,1]=3 420 B9R0.46 CCCCOCC(O)CO MCULE-8662748140 [0,1,0,0,0,0|1,0,1]=3 421 B9R0.46 CCCCSCC(O)CO MCULE-8665487683 [0,1,0,0,0,0|1,0,1]=3 422 B9R0.46 CC[C@H](C)CCCCCO MCULE-2345749211 [0,1,0,0,0,0|1,0,2]=4 423 B9R0.46 CC[C@H](C)CCCCCO MCULE-9450083737 [0,1,0,0,0,0|1,0,2]=4 424 B9R0.46 COCCOCC(O)CCl MCULE-7963737892 [0,1,0,0,0,0|2,0,1]=4 425 B9R0.46 OCCCCCC(O)CO MCULE-1241763539 [0,1,0,0,0,0|1,0,1]=3 426 B9R0.47 C(N)(CCCCN)C(=O)O MCULE-7060791798 [0,1,0,0,0,0|3,0,0]=4 427 B9R0.47 C=C(C)C(=O)NCCCC MCULE-9430540018 [0,1,0,0,0,0|1,0,2]=4 428 B9R0.47 C=C(C)C(=O)OCCCC MCULE-4077978269 [0,1,0,0,0,0|1,0,2]=4 429 B9R0.47 C=C(F)C(=O)OCCCC MCULE-6284470197 [0,1,0,0,0,0|1,0,2]=4 430 B9R0.47 CCCC=CC(O)C(=O)O MCULE-9096490162 [0,1,0,0,0,0|1,0,2]=4 431 B9R0.47 CCCCCC(=O)C(=O)C MCULE-3171324169 [0,1,0,0,0,0|0,0,3]=4 432 B9R0.47 CCCCCC(=O)C(=O)O MCULE-2334480456 [0,1,0,0,0,0|1,0,2]=4 433 B9R0.47 CCCCCC(C)C(=O)C MCULE-8141962187 [0,1,0,0,0,0|1,0,1]=3 434 B9R0.47 CCCCCC(C)C(=O)O MCULE-3831811055 [0,1,0,0,0,0|2,0,0]=3 435 B9R0.47 CCCCCC(C)C(C)C MCULE-2636833283 [0,1,0,0,0,0|1,0,2]=4 436 B9R0.47 CCCCCC(Cl)C(C)Cl MCULE-3130271642 [0,1,0,0,0,0|1,0,2]=4 437 B9R0.47 CCCCCC(N)C(=O)O MCULE-5558679374 [0,1,0,0,0,0|2,0,0]=3 438 B9R0.47 CCCCCC(N)C(=O)O MCULE-8607576790 [0,1,0,0,0,0|2,0,0]=3 439 B9R0.47 CCCCCC(O)C(=O)O MCULE-4151749430 [0,1,0,0,0,0|1,0,0]=2 440 B9R0.47 CCCCCC(O)C(C)C MCULE-1365333754 [0,1,0,0,0,0|0,0,2]=3 441 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-3981603450 [0,1,0,0,0,0|2,0,0]=3 442 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-6090735433 [0,1,0,0,0,0|2,0,0]=3 443 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-8108024359 [0,1,0,0,0,0|2,0,0]=3 444 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-9961773652 [0,1,0,0,0,0|2,0,0]=3 445 B9R0.47 CCCCOC(C)C(=O)O MCULE-2711768240 [0,1,0,0,0,0|3,0,0]=4 446 B9R0.47 CCCCSC(C)C(=O)O MCULE-1538375330 [0,1,0,0,0,0|3,0,0]=4 447 B9R0.47 CCCSCC(N)C(=O)O MCULE-1465196294 [0,1,0,0,0,0|3,0,0]=4 448 B9R0.47 CCCSCC(N)C(=O)O MCULE-2196835186 [0,1,0,0,0,0|3,0,0]=4 449 B9R0.47 CCCSC[C@H](N)C(=O)O MCULE-2274873569 [0,1,0,0,0,0|3,0,0]=4 450 B9R0.47 CCNCCC(N)C(=O)O MCULE-8873123795 [0,1,0,0,0,0|3,0,0]=4 451 B9R0.47 CCSCCC(N)C(=O)O MCULE-8503033566 [0,1,0,0,0,0|3,0,0]=4 452 B9R0.47 CCSCCC(N)C(=O)O MCULE-9465623190 [0,1,0,0,0,0|3,0,0]=4 453 B9R0.47 CCSCC[C@@H](N)C(=O)O MCULE-2836325620 [0,1,0,0,0,0|3,0,0]=4 454 B9R0.47 CCSCC[C@H](N)C(=O)O MCULE-6614300528 [0,1,0,0,0,0|3,0,0]=4 455 B9R0.47 CC[Se]CCC(N)C(=O)O MCULE-7426703933 [0,1,0,0,0,0|3,0,0]=4 456 B9R0.47 COCCCC(C)C(=O)O MCULE-7159772792 [0,1,0,0,0,0|3,0,0]=4 457 B9R0.47 NC(CCCCO)C(=O)O MCULE-7372730935 [0,1,0,0,0,0|3,0,0]=4 458 B9R0.47 NCCCCC(N)C(=O)N MCULE-5695768231 [0,1,0,0,0,0|3,0,0]=4 459 B9R0.47 NCCCCC(N)C(=O)N MCULE-8502146041 [0,1,0,0,0,0|3,0,0]=4 460 B9R0.47 NCCCCC(N)C(=O)O MCULE-1411873021 [0,1,0,0,0,0|3,0,0]=4 461 B9R0.47 NCCCCC(N)C(=O)O MCULE-1436032977 [0,1,0,0,0,0|3,0,0]=4 462 B9R0.47 NCCCCC(N)C(=O)O MCULE-5737537430 [0,1,0,0,0,0|3,0,0]=4 463 B9R0.47 NCCCCC(N)C(=O)O MCULE-6537319758 [0,1,0,0,0,0|3,0,0]=4 464 B9R0.47 NCCCCC(N)C(=O)O MCULE-9665753367 [0,1,0,0,0,0|3,0,0]=4 465 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2051883110 [0,1,0,0,0,0|3,0,0]=4 466 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2174845427 [0,1,0,0,0,0|3,0,0]=4 467 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7229907816 [0,1,0,0,0,0|3,0,0]=4 468 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7646209988 [0,1,0,0,0,0|3,0,0]=4 469 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-2490465776 [0,1,0,0,0,0|3,0,0]=4 470 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-5523101334 [0,1,0,0,0,0|3,0,0]=4 471 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-7682920289 [0,1,0,0,0,0|3,0,0]=4 472 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-9381942600 [0,1,0,0,0,0|3,0,0]=4 473 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-1814780282 [0,1,0,0,0,0|3,0,0]=4 474 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2585671029 [0,1,0,0,0,0|3,0,0]=4 475 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2735109468 [0,1,0,0,0,0|3,0,0]=4 476 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-3226089160 [0,1,0,0,0,0|3,0,0]=4 477 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-4736099943 [0,1,0,0,0,0|3,0,0]=4 478 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5602916309 [0,1,0,0,0,0|3,0,0]=4 479 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5669080418 [0,1,0,0,0,0|3,0,0]=4 480 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5771120494 [0,1,0,0,0,0|3,0,0]=4 481 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-6467055628 [0,1,0,0,0,0|3,0,0]=4 482 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7268734331 [0,1,0,0,0,0|3,0,0]=4 483 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7702716758 [0,1,0,0,0,0|3,0,0]=4 484 B9R0.47 NCCCC[C@H]([NH3+])C(=O)O MCULE-1421201563 [0,1,0,0,0,0|3,0,0]=4 485 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-1855458643 [0,1,0,0,0,0|3,0,0]=4 486 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-3280637244 [0,1,0,0,0,0|3,0,0]=4 487 B9R0.47 O=C(O)C(Br)CCCCBr MCULE-9265332965 [0,1,0,0,0,0|3,0,0]=4 488 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-2676284364 [0,1,0,0,0,0|3,0,0]=4 489 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-3536027321 [0,1,0,0,0,0|3,0,0]=4 490 B9R0.47 [C@H](N)(CCNCC)C(=O)O MCULE-8327043663 [0,1,0,0,0,0|3,0,0]=4 491 B9R0.50 CCCCCC(C=O)CC MCULE-2036961521 [0,1,0,0,0,0|2,0,0]=3 492 B9R0.50 CCCCCC(CC)CC MCULE-6306174845 [0,1,0,0,0,0|1,0,2]=4 493 B9R0.50 CCCCCC(CO)CO MCULE-5254181477 [0,1,0,0,0,0|1,0,1]=3 494 B9R0.50 CCCCCC(OC)OC MCULE-8808414526 [0,1,0,0,0,0|1,0,1]=3 495 B9R0.50 COC(CCCCN)OC MCULE-2878649881 [0,1,0,0,0,0|2,0,1]=4 496 B9R0.50 NCCCCC(CO)CO MCULE-9856529758 [0,1,0,0,0,0|2,0,1]=4 497 B9R1.1 CCC1CCC(CC1)C MCULE-2653372010 [0,0,0,1,0,0|1,0,2]=4 498 B9R1.1 CCC1CCC(CC1)N MCULE-3699342075 [0,0,0,1,0,0|1,0,2]=4 499 B9R1.1 CCC1CCC(CC1)N MCULE-8941706723 [0,0,0,1,0,0|1,0,2]=4 500 B9R1.1 CCC1CCC(CC1)O MCULE-8097752772 [0,0,0,1,0,0|0,0,2]=3 501 B9R1.1 CCC1CCC(NC1)C MCULE-9037446160 [0,0,0,1,0,0|2,0,1]=4 502 B9R1.1 CCN1CCC(CC1)O MCULE-9813710535 [0,0,0,1,0,0|1,0,2]=4 503 B9R1.1 CC[C@H]1CC[C@@H](CC1)N MCULE-4018920391 [0,0,0,1,0,0|1,0,2]=4 504 B9R1.1 CC[C@H]1CC[C@@H](CC1)N MCULE-6650148008 [0,0,0,1,0,0|1,0,2]=4 505 B9R1.1 CC[C@H]1CC[C@@H](CC1)O MCULE-2707983247 [0,0,0,1,0,0|0,0,2]=3 506 B9R1.1 CC[C@H]1CC[C@H](CC1)N MCULE-9970355250 [0,0,0,1,0,0|1,0,2]=4 507 B9R1.1 CC[C@H]1CC[C@H](CC1)O MCULE-2491233696 [0,0,0,1,0,0|0,0,2]=3 508 B9R1.1 CNC1CCC(CC1)O MCULE-4830228871 [0,0,0,1,0,0|1,0,2]=4 509 B9R1.1 CNC1CCC(CC1)O MCULE-6477610530 [0,0,0,1,0,0|1,0,2]=4 510 B9R1.1 CN[C@H]1CC[C@@H](CC1)O MCULE-1022113223 [0,0,0,1,0,0|1,0,2]=4 511 B9R1.1 CN[C@H]1CC[C@@H](CC1)O MCULE-1356433778 [0,0,0,1,0,0|1,0,2]=4 512 B9R1.1 CN[C@H]1CC[C@H](CC1)O MCULE-1490699426 [0,0,0,1,0,0|1,0,2]=4 513 B9R1.1 CN[C@H]1CC[C@H](CC1)O MCULE-7508857663 [0,0,0,1,0,0|1,0,2]=4 514 B9R1.1 COC1=CCC(CC1)O MCULE-8647551052 [0,0,0,1,0,0|1,0,2]=4 515 B9R1.1 COC1CCC(CC1)O MCULE-7486081080 [0,0,0,1,0,0|1,0,2]=4 516 B9R1.1 CO[C@H]1CC[C@@H](CC1)O MCULE-6913861887 [0,0,0,1,0,0|1,0,2]=4 517 B9R1.1 NCC1CCC(CC1)O MCULE-1773102107 [0,0,0,1,0,0|1,0,2]=4 518 B9R1.1 NCC1CCC(CC1)O MCULE-3605496824 [0,0,0,1,0,0|1,0,2]=4 519 B9R1.1 NCC1CCC(CO1)O MCULE-3286854000 [0,0,0,1,0,0|2,0,1]=4 520 B9R1.1 NC[C@H]1CC[C@@H](CC1)O MCULE-3725371515 [0,0,0,1,0,0|1,0,2]=4 521 B9R1.1 NC[C@H]1CC[C@@H](CC1)O MCULE-3796180406 [0,0,0,1,0,0|1,0,2]=4 522 B9R1.1 NC[C@H]1CC[C@H](CC1)O MCULE-6015230551 [0,0,0,1,0,0|1,0,2]=4 523 B9R1.1 NC[C@H]1CC[C@H](CC1)O MCULE-9189660845 [0,0,0,1,0,0|1,0,2]=4 524 B9R1.1 OC1CCC(CC1)CCl MCULE-3310167491 [0,0,0,1,0,0|1,0,2]=4 525 B9R1.1 OCC1CCC(CC1)O MCULE-2821884453 [0,0,0,1,0,0|1,0,2]=4 526 B9R1.1 OCC1CCC(CO1)O MCULE-4333559257 [0,0,0,1,0,0|2,0,1]=4 527 B9R1.1 OC[C@H]1CC[C@@H](CC1)O MCULE-4903112146 [0,0,0,1,0,0|1,0,2]=4 528 B9R1.1 OC[C@H]1CC[C@H](CC1)O MCULE-5364161264 [0,0,0,1,0,0|1,0,2]=4 529 B9R1.2 C#CC1CCCC(C1)C MCULE-8256643054 [0,0,0,1,0,0|1,0,2]=4 530 B9R1.2 C=CC1CCCC(=O)C1 MCULE-4962666890 [0,0,0,1,0,0|2,0,1]=4 531 B9R1.2 C=CC1CCCN(C1)C MCULE-3504057822 [0,0,0,1,0,0|2,0,0]=3 532 B9R1.2 C=CC1CCCN(C1)C MCULE-6214803958 [0,0,0,1,0,0|2,0,0]=3 533 B9R1.2 CC1C=C(CCC1)C=O MCULE-8149754044 [0,0,0,1,0,0|2,0,1]=4 534 B9R1.2 CC1CC(CCO1)C=O MCULE-4627853236 [0,0,0,1,0,0|3,0,0]=4 535 B9R1.2 CC1CCCC(C1)C#N MCULE-1752931434 [0,0,0,1,0,0|2,0,1]=4 536 B9R1.2 CC1CCCC(C1)C=O MCULE-8003239715 [0,0,0,1,0,0|2,0,0]=3 537 B9R1.2 CC1CCCC(C1)CBr MCULE-4436738297 [0,0,0,1,0,0|2,0,1]=4 538 B9R1.2 CC1CCCC(C1)CN MCULE-5692325071 [0,0,0,1,0,0|2,0,1]=4 539 B9R1.2 CC1CCCC(C1)CO MCULE-5618525751 [0,0,0,1,0,0|2,0,1]=4 540 B9R1.2 CC1CCCC(C1)NN MCULE-8101664650 [0,0,0,1,0,0|3,0,0]=4 541 B9R1.2 CC1CCCC(C1)NN MCULE-8912578771 [0,0,0,1,0,0|3,0,0]=4 542 B9R1.2 CC1CCCC(C1)NN MCULE-8960586966 [0,0,0,1,0,0|3,0,0]=4 543 B9R1.2 CC1CCCC(N1)CO MCULE-1132392693 [0,0,0,1,0,0|2,0,1]=4 544 B9R1.2 CC1CCCC(O1)CN MCULE-9065375307 [0,0,0,1,0,0|1,0,1]=3 545 B9R1.2 CC1CNCC(O1)C#N MCULE-8375247309 [0,0,0,1,0,0|2,0,1]=4 546 B9R1.2 CC1CNCC(O1)CO MCULE-6915504187 [0,0,0,1,0,0|2,0,1]=4 547 B9R1.2 CCC1CCCC(C1)C MCULE-6755768980 [0,0,0,1,0,0|1,0,2]=4 548 B9R1.2 CCC1CNCC(O1)C MCULE-6402129304 [0,0,0,1,0,0|1,0,2]=4 549 B9R1.2 CC[C@@H]1CCC[C@@H](N1)C MCULE-4368459266 [0,0,0,1,0,0|1,0,2]=4 550 B9R1.2 CC[C@H]1CNC[C@H](O1)C MCULE-1726802726 [0,0,0,1,0,0|1,0,2]=4 551 B9R1.2 CN1CCCC(C1)C=O MCULE-8355946906 [0,0,0,1,0,0|3,0,0]=4 552 B9R1.2 CNC1CCCC(C1)C MCULE-5420065311 [0,0,0,1,0,0|2,0,1]=4 553 B9R1.2 CNC1CCCC(C1)C MCULE-9367652439 [0,0,0,1,0,0|2,0,1]=4 554 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-4030187082 [0,0,0,1,0,0|2,0,1]=4 555 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-8521542499 [0,0,0,1,0,0|2,0,1]=4 556 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6331587635 [0,0,0,1,0,0|2,0,1]=4 557 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6791243811 [0,0,0,1,0,0|2,0,1]=4 558 B9R1.2 [C@H]1(CNC[C@@H](O1)CO)C MCULE-4259776230 [0,0,0,1,0,0|2,0,1]=4 559 B9R1.3 C1(CCNC(C1C)C)O MCULE-7157710103 [0,0,0,1,0,0|1,0,2]=4 560 B9R1.3 C1(CCNC(C1C)C)O MCULE-8288554330 [0,0,0,1,0,0|1,0,2]=4 561 B9R1.3 CC1=C(C(CCC1)O)C MCULE-7202234917 [0,0,0,1,0,0|0,0,2]=3 562 B9R1.3 CC1CCCC(=O)C1=O MCULE-3677088238 [0,0,0,1,0,0|1,0,2]=4 563 B9R1.3 CC1CCCC(C1=O)C MCULE-4896844140 [0,0,0,1,0,0|2,0,0]=3 564 B9R1.3 CC1CCCC(C1C)C MCULE-9375072995 [0,0,0,1,0,0|1,0,2]=4 565 B9R1.3 CC1CCCC(C1C)N MCULE-7085283833 [0,0,0,1,0,0|1,0,2]=4 566 B9R1.3 CC1CCCC(C1C)O MCULE-1285216829 [0,0,0,1,0,0|0,0,2]=3 567 B9R1.3 CC1CCCC(C1N)C MCULE-4904455493 [0,0,0,1,0,0|2,0,1]=4 568 B9R1.3 CC1CCCC(C1N)C MCULE-9589109711 [0,0,0,1,0,0|2,0,1]=4 569 B9R1.3 CC1CCCC(C1O)C MCULE-8568932421 [0,0,0,1,0,0|2,0,1]=4 570 B9R1.3 CC1CCCC(N1N)C MCULE-5765452870 [0,0,0,1,0,0|3,0,0]=4 571 B9R1.3 CC1COCC(C1=O)C MCULE-6746359512 [0,0,0,1,0,0|3,0,0]=4 572 B9R1.3 CC1OCCC(C1O)O MCULE-6494583965 [0,0,0,1,0,0|2,0,1]=4 573 B9R1.3 CN1CCCC(C1=O)Br MCULE-1025570589 [0,0,0,1,0,0|3,0,0]=4 574 B9R1.3 CN1CCCC(C1=O)N MCULE-3986588144 [0,0,0,1,0,0|3,0,0]=4 575 B9R1.3 CN1CCCC(C1=O)N MCULE-7149075004 [0,0,0,1,0,0|3,0,0]=4 576 B9R1.3 CN1CCCC(C1=O)N MCULE-8825003509 [0,0,0,1,0,0|3,0,0]=4 577 B9R1.3 CN1CCCC(C1=O)N MCULE-8988509393 [0,0,0,1,0,0|3,0,0]=4 578 B9R1.3 CN1CCCC(C1=O)O MCULE-9396895370 [0,0,0,1,0,0|2,0,0]=3 579 B9R1.3 CN1CCC[C@@H](C1=O)N MCULE-1758642850 [0,0,0,1,0,0|3,0,0]=4 580 B9R1.3 CN1CCC[C@@H](C1=O)N MCULE-3159461429 [0,0,0,1,0,0|3,0,0]=4 581 B9R1.3 CN1CCC[C@@H](C1=O)N MCULE-7461179322 [0,0,0,1,0,0|3,0,0]=4 582 B9R1.3 CN1CCC[C@@H](C1=O)N MCULE-9831345261 [0,0,0,1,0,0|3,0,0]=4 583 B9R1.3 CN1CCC[C@H](C1=O)N MCULE-1637263724 [0,0,0,1,0,0|3,0,0]=4 584 B9R1.3 CN1CCC[C@H](C1=O)N MCULE-4764518735 [0,0,0,1,0,0|3,0,0]=4 585 B9R1.3 CN1CCC[C@H](C1=O)N MCULE-8517113396 [0,0,0,1,0,0|3,0,0]=4 586 B9R1.3 CN1CCC[C@H](C1=O)N MCULE-8710321967 [0,0,0,1,0,0|3,0,0]=4 587 B9R1.3 C[C@@H]1CNC[C@@H]([C@@H]1O)O MCULE-4065345114 [0,0,0,1,0,0|2,0,1]=4 588 B9R1.3 C[C@@H]1CNC[C@@H]([C@@H]1O)O MCULE-5732596905 [0,0,0,1,0,0|2,0,1]=4 589 B9R1.3 C[C@H]1CNC[C@@H]([C@@H]1O)O MCULE-3640440568 [0,0,0,1,0,0|2,0,1]=4 590 B9R1.3 C[C@H]1CNC[C@@H]([C@@H]1O)O MCULE-9501528896 [0,0,0,1,0,0|2,0,1]=4 591 B9R1.3 NC1C(CCCC1O)O MCULE-1978359416 [0,0,0,1,0,0|2,0,1]=4 592 B9R1.3 NC1CCCN(C1=O)O MCULE-1786572763 [0,0,0,1,0,0|3,0,0]=4 593 B9R1.3 N[C@@H]1CCC[C@H]([C@@H]1O)O MCULE-7294484287 [0,0,0,1,0,0|2,0,1]=4 594 B9R1.3 N[C@H]1CCC[C@@H]([C@@H]1O)O MCULE-4901407173 [0,0,0,1,0,0|2,0,1]=4 595 B9R1.3 N[C@H]1CCC[C@H]([C@@H]1O)O MCULE-2706489441 [0,0,0,1,0,0|2,0,1]=4 596 B9R1.3 OC1CCCC(C1O)O MCULE-2835511427 [0,0,0,1,0,0|2,0,1]=4 597 B9R1.3 [C@@H]1(CCC[C@H]([C@@H]1N)O)O MCULE-9327450801 [0,0,0,1,0,0|2,0,1]=4 598 B9R1.5 BrC1CCCCCC1Br MCULE-2183687656 [0,0,0,1,0,0|2,0,1]=4 599 B9R1.5 CC1CCCCCC1=O MCULE-3737709008 [0,0,0,1,0,0|2,0,0]=3 600 B9R1.5 CC1CCCCCC1N MCULE-5854491023 [0,0,0,1,0,0|1,0,2]=4 601 B9R1.5 CC1CCCCNC1=O MCULE-6519247850 [0,0,0,1,0,0|3,0,0]=4 602 B9R1.5 CC1CCNCCC1=O MCULE-4416410353 [0,0,0,1,0,0|3,0,0]=4 603 B9R1.5 CC1CCNCCC1=O MCULE-7780011332 [0,0,0,1,0,0|3,0,0]=4 604 B9R1.5 CC1CCNCCC1O MCULE-2014482309 [0,0,0,1,0,0|1,0,2]=4 605 B9R1.5 CC1CCNCCC1O MCULE-7020970444 [0,0,0,1,0,0|1,0,2]=4 606 B9R1.5 CC1CNCCCC1=O MCULE-2991075150 [0,0,0,1,0,0|3,0,0]=4 607 B9R1.5 CC1CNCCCC1=O MCULE-6909508049 [0,0,0,1,0,0|3,0,0]=4 608 B9R1.5 CC1CNCCCC1O MCULE-7042298511 [0,0,0,1,0,0|1,0,2]=4 609 B9R1.5 CC1CNCCCC1O MCULE-8658161534 [0,0,0,1,0,0|1,0,2]=4 610 B9R1.5 CN1CCCCCC1=O MCULE-7241062208 [0,0,0,1,0,0|3,0,0]=4 611 B9R1.5 NC1CCCCCC1=O MCULE-1905655125 [0,0,0,1,0,0|2,0,0]=3 612 B9R1.5 NC1CCCCCC1=O MCULE-7826089166 [0,0,0,1,0,0|2,0,0]=3 613 B9R1.5 NC1CCCCCC1O MCULE-8315023618 [0,0,0,1,0,0|1,0,1]=3 614 B9R1.5 NC1CCCCNC1=O MCULE-1440525393 [0,0,0,1,0,0|3,0,0]=4 615 B9R1.5 NC1CCCCNC1=O MCULE-9185446308 [0,0,0,1,0,0|3,0,0]=4 616 B9R1.5 NC1CCCCNC1=O MCULE-9575519565 [0,0,0,1,0,0|3,0,0]=4 617 B9R1.5 NC1CCCCNC1=O MCULE-9618135909 [0,0,0,1,0,0|3,0,0]=4 618 B9R1.5 N[C@@H]1CCCCC[C@@H]1O MCULE-2063759577 [0,0,0,1,0,0|1,0,1]=3 619 B9R1.5 N[C@@H]1CCCCC[C@@H]1O MCULE-8213087274 [0,0,0,1,0,0|1,0,1]=3 620 B9R1.5 N[C@@H]1CCCCC[C@H]1O MCULE-5613622981 [0,0,0,1,0,0|1,0,1]=3 621 B9R1.5 N[C@@H]1CCCCNC1=O MCULE-5153147263 [0,0,0,1,0,0|3,0,0]=4 622 B9R1.5 N[C@@H]1CCCCNC1=O MCULE-7391081425 [0,0,0,1,0,0|3,0,0]=4 623 B9R1.5 N[C@@H]1CCCCNC1=O MCULE-7745749225 [0,0,0,1,0,0|3,0,0]=4 624 B9R1.5 N[C@@H]1CCCCNC1=O MCULE-8592559653 [0,0,0,1,0,0|3,0,0]=4 625 B9R1.5 N[C@H]1CCCCC[C@@H]1O MCULE-6991711117 [0,0,0,1,0,0|1,0,1]=3 626 B9R1.5 N[C@H]1CCCCC[C@H]1N MCULE-4838437415 [0,0,0,1,0,0|2,0,1]=4 627 B9R1.5 N[C@H]1CCCCC[C@H]1N MCULE-9986210496 [0,0,0,1,0,0|2,0,1]=4 628 B9R1.5 N[C@H]1CCCCC[C@H]1O MCULE-2920839467 [0,0,0,1,0,0|1,0,1]=3 629 B9R1.5 N[C@H]1CCCCC[C@H]1O MCULE-2969566133 [0,0,0,1,0,0|1,0,1]=3 630 B9R1.5 N[C@H]1CCCCNC1=O MCULE-1339098987 [0,0,0,1,0,0|3,0,0]=4 631 B9R1.5 N[C@H]1CCCCNC1=O MCULE-1817473261 [0,0,0,1,0,0|3,0,0]=4 632 B9R1.5 N[C@H]1CCCCNC1=O MCULE-2707429520 [0,0,0,1,0,0|3,0,0]=4 633 B9R1.5 N[C@H]1CCCCNC1=O MCULE-9750792164 [0,0,0,1,0,0|3,0,0]=4 634 B9R1.5 O=C1CCCCCC1=O MCULE-5149160405 [0,0,0,1,0,0|1,0,2]=4 635 B9R1.5 O=C1CCCCCC1Br MCULE-8987490106 [0,0,0,1,0,0|2,0,0]=3 636 B9R1.5 O=C1CCCCCC1Cl MCULE-8475724231 [0,0,0,1,0,0|2,0,0]=3 637 B9R1.5 O=C1CCCCCC1F MCULE-9375666074 [0,0,0,1,0,0|2,0,0]=3 638 B9R1.5 O=C1CCCCCC1O MCULE-1763055677 [0,0,0,1,0,0|1,0,0]=2 639 B9R1.5 O=C1CCCCCN1Br MCULE-9229859393 [0,0,0,1,0,0|3,0,0]=4 640 B9R1.5 O=C1CCCNCC1F MCULE-2925975058 [0,0,0,1,0,0|3,0,0]=4 641 B9R1.5 O=C1CCCNCC1F MCULE-8103284018 [0,0,0,1,0,0|3,0,0]=4 642 B9R1.5 O=C1CCNCCC1Br MCULE-2617340721 [0,0,0,1,0,0|3,0,0]=4 643 B9R1.5 O=C1CCNCCC1Br MCULE-7631698969 [0,0,0,1,0,0|3,0,0]=4 644 B9R1.5 O=C1CCNCCC1F MCULE-5060609426 [0,0,0,1,0,0|3,0,0]=4 645 B9R1.5 O=C1CCNCCC1F MCULE-9571678689 [0,0,0,1,0,0|3,0,0]=4 646 B9R1.5 O=C1CNCCCC1F MCULE-6506742195 [0,0,0,1,0,0|3,0,0]=4 647 B9R1.5 O=C1CNCCCC1F MCULE-9667202528 [0,0,0,1,0,0|3,0,0]=4 648 B9R1.5 O=C1NCCCCC1Br MCULE-1879428965 [0,0,0,1,0,0|3,0,0]=4 649 B9R1.5 OC1CCCCCC1O MCULE-7682077273 [0,0,0,1,0,0|1,0,1]=3 650 B9R1.5 OC1CCNCCC1F MCULE-6523954631 [0,0,0,1,0,0|2,0,1]=4 651 B9R1.5 OC1CCNCCC1F MCULE-9888134998 [0,0,0,1,0,0|2,0,1]=4 652 B9R1.5 OC1CNCCCC1F MCULE-3253307740 [0,0,0,1,0,0|2,0,1]=4 653 B9R1.5 OC1CNCCCC1F MCULE-9432299615 [0,0,0,1,0,0|2,0,1]=4 654 B9R1.5 O[C@H]1CCCCC[C@@H]1O MCULE-9651607332 [0,0,0,1,0,0|1,0,1]=3 655 B9R1.7 CCCN1C=CC(=N1)O MCULE-3121256695 [0,0,0,1,0,0|2,0,1]=4 656 B9R1.7 CCCN1C=CN(C1)C MCULE-2357733510 [0,0,0,1,0,0|3,0,0]=4 657 B9R1.7 CCCN1C=CN(C1)C MCULE-2969368671 [0,0,0,1,0,0|3,0,0]=4 658 B9R1.7 CCCN1C=C[NH+](C1)C MCULE-3673894340 [0,0,0,1,0,0|3,0,0]=4 659 B9R1.7 COCC1CC(CN1)O MCULE-1719796553 [0,0,0,1,0,0|2,0,1]=4 660 B9R1.7 COCC1CC(CN1)O MCULE-2828004706 [0,0,0,1,0,0|2,0,1]=4 661 B9R1.7 COC[C@@H]1C[C@@H](CN1)O MCULE-4903855773 [0,0,0,1,0,0|2,0,1]=4 662 B9R1.7 COC[C@@H]1C[C@@H](CN1)O MCULE-5035930973 [0,0,0,1,0,0|2,0,1]=4 663 B9R1.7 COC[C@@H]1C[C@H](CN1)O MCULE-1656210028 [0,0,0,1,0,0|2,0,1]=4 664 B9R1.7 COC[C@@H]1C[C@H](CN1)O MCULE-8717772588 [0,0,0,1,0,0|2,0,1]=4 665 B9R1.7 COC[C@H]1C[C@H](CN1)O MCULE-7483280166 [0,0,0,1,0,0|2,0,1]=4 666 B9R1.7 COC[C@H]1C[C@H](CN1)O MCULE-7672691308 [0,0,0,1,0,0|2,0,1]=4 667 B9R1.7 NCCC1CC[C@H](C1)O MCULE-3758609813 [0,0,0,1,0,0|1,0,2]=4 668 B9R1.7 NCC[C@H]1CC[C@H](C1)O MCULE-7245034683 [0,0,0,1,0,0|1,0,2]=4 669 B9R1.7 [NH+]1(C=CN(C1)CCC)C MCULE-7179736072 [0,0,0,1,0,0|3,0,0]=4 670 B9R1.11 C#CC(O)C1CCCC1 MCULE-2991189926 [0,0,0,1,0,0|0,0,2]=3 671 B9R1.11 C=CC(=O)N1CCCC1 MCULE-9314569500 [0,0,0,1,0,0|1,0,2]=4 672 B9R1.11 C=CC(O)C1CCCC1 MCULE-8096299119 [0,0,0,1,0,0|0,0,0]=1 673 B9R1.11 CC(CBr)C1CCCC1 MCULE-7239123079 [0,0,0,1,0,0|2,0,1]=4 674 B9R1.11 CCC(N)C1CCCC1 MCULE-2018376160 [0,0,0,1,0,0|1,0,2]=4 675 B9R1.11 N#CC(Br)C1CCCC1 MCULE-6381713655 [0,0,0,1,0,0|2,0,1]=4 676 B9R1.11 N#CC(N)C1CCCC1 MCULE-4433246182 [0,0,0,1,0,0|2,0,1]=4 677 B9R1.11 N#CC(N)C1CCCC1 MCULE-4468700016 [0,0,0,1,0,0|2,0,1]=4 678 B9R1.11 NC(CO)C1CCCC1 MCULE-3542083676 [0,0,0,1,0,0|2,0,1]=4 679 B9R1.11 NC(CO)C1CCCC1 MCULE-5931245443 [0,0,0,1,0,0|2,0,1]=4 680 B9R1.11 NCC(F)C1CCCC1 MCULE-2563707089 [0,0,0,1,0,0|2,0,1]=4 681 B9R1.11 NCC(F)C1CCCC1 MCULE-5929697460 [0,0,0,1,0,0|2,0,1]=4 682 B9R1.11 NCC(N)C1CCCC1 MCULE-6437780642 [0,0,0,1,0,0|2,0,1]=4 683 B9R1.11 NCC(O)C1CCCC1 MCULE-1826088467 [0,0,0,1,0,0|1,0,1]=3 684 B9R1.11 NCC(O)C1CCCC1 MCULE-5186127631 [0,0,0,1,0,0|1,0,1]=3 685 B9R1.11 NCC(O)C1CCCO1 MCULE-1674634827 [0,0,0,1,0,0|2,0,1]=4 686 B9R1.11 NCC(O)C1CCOC1 MCULE-2353712692 [0,0,0,1,0,0|2,0,1]=4 687 B9R1.11 NCC(O)C1CCOC1 MCULE-2647033518 [0,0,0,1,0,0|2,0,1]=4 688 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-1672080667 [0,0,0,1,0,0|2,0,1]=4 689 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-2468572391 [0,0,0,1,0,0|2,0,1]=4 690 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-9200212417 [0,0,0,1,0,0|2,0,1]=4 691 B9R1.17 CCCCCC1CNC1 MCULE-1187200413 [0,0,0,1,0,0|2,0,1]=4 692 B9R1.17 CCCCCC1CNC1 MCULE-2508948694 [0,0,0,1,0,0|2,0,1]=4 693 B9R1.21 COC1CCC(O1)OC MCULE-3806876739 [0,0,0,1,0,0|2,0,1]=4 694 B9R1.21 NCC1CCC(O1)CN MCULE-4000228398 [0,0,0,1,0,0|2,0,1]=4 695 B9R1.21 NC[C@@H]1CC[C@@H](O1)CN MCULE-4187719094 [0,0,0,1,0,0|2,0,1]=4 696 B9R1.21 OCC1CCC(O1)CO MCULE-3334782559 [0,0,0,1,0,0|2,0,1]=4 697 B9R1.21 OC[C@@H]1CC[C@@H](O1)CO MCULE-5217154467 [0,0,0,1,0,0|2,0,1]=4 698 B9R1.49 CC1CCCC(CC1)N MCULE-7634847223 [0,0,0,1,0,0|1,0,2]=4 699 B9R1.49 CC1CCCC(NC1)C MCULE-1631903049 [0,0,0,1,0,0|2,0,1]=4 700 B9R1.49 CN1CCCC(CC1)O MCULE-6133611762 [0,0,0,1,0,0|1,0,2]=4 701 B9R1.49 CN1CCCC(CC1)O MCULE-6589317799 [0,0,0,1,0,0|1,0,2]=4 702 B9R1.49 CN1CCC[C@@H](CC1)O MCULE-2532340714 [0,0,0,1,0,0|1,0,2]=4 703 B9R1.49 CN1CCC[C@H](CC1)O MCULE-6867682041 [0,0,0,1,0,0|1,0,2]=4 704 B9R1.49 NC1CCCC(CC1)O MCULE-5371360262 [0,0,0,1,0,0|1,0,2]=4 705 B9R1.49 NC1CCCC(CC1)O MCULE-7262958041 [0,0,0,1,0,0|1,0,2]=4 706 B9R1.49 N[C@@H]1CCC[C@@H](CC1)O MCULE-1133973283 [0,0,0,1,0,0|1,0,2]=4 707 B9R1.49 N[C@@H]1CCC[C@@H](CC1)O MCULE-4169090989 [0,0,0,1,0,0|1,0,2]=4 708 B9R1.49 N[C@@H]1CCC[C@H](CC1)O MCULE-2007393276 [0,0,0,1,0,0|1,0,2]=4 709 B9R1.49 N[C@H]1CCC[C@@H](CC1)O MCULE-2524209060 [0,0,0,1,0,0|1,0,2]=4 710 B9R1.49 N[C@H]1CCC[C@H](CC1)O MCULE-3889106863 [0,0,0,1,0,0|1,0,2]=4 711 B9R1.50 BrC1=CCCCCCC1 MCULE-5795272491 [0,0,0,1,0,0|1,0,2]=4 712 B9R1.50 BrC1=CCCCCCC1 MCULE-6505985509 [0,0,0,1,0,0|1,0,2]=4 713 B9R1.50 BrC1C=CCCCCC1 MCULE-8233462837 [0,0,0,1,0,0|1,0,0]=2 714 B9R1.50 BrC1CCCCCCC1 MCULE-9261673111 [0,0,0,1,0,0|1,0,2]=4 715 B9R1.50 NC1C=CCCCCC1 MCULE-1781220815 [0,0,0,1,0,0|1,0,0]=2 716 B9R1.50 NC1C=CCCCCC1 MCULE-9435374048 [0,0,0,1,0,0|1,0,0]=2 717 B9R1.50 NC1CCCCCCC1 MCULE-6537375543 [0,0,0,1,0,0|1,0,2]=4 718 B9R1.50 NC1CCCCCNC1 MCULE-8217686828 [0,0,0,1,0,0|2,0,1]=4 719 B9R1.50 O=C1C=CCCCCC1 MCULE-8923461119 [0,0,0,1,0,0|0,0,2]=3 720 B9R1.50 OC1C=CCCCCC1 MCULE-1181214133 [0,0,0,1,0,0|0,0,0]=1 721 B9R1.50 OC1CCCCCCC1 MCULE-7379371136 [0,0,0,1,0,0|0,0,2]=3 722 B9R1.50 OC1CNCCCNC1 MCULE-3177425947 [0,0,0,1,0,0|2,0,1]=4 723 B9R1.50 OC1CNCCCNC1 MCULE-5698562435 [0,0,0,1,0,0|2,0,1]=4 724 B9R1.50 OC1CSCCCSC1 MCULE-8296129342 [0,0,0,1,0,0|2,0,1]=4 725 B9R1.79 NC(CO)CC1CCC1 MCULE-2309333579 [0,0,0,1,0,0|2,0,1]=4 726 B9R1.79 NC(CO)CC1CCC1 MCULE-6676177211 [0,0,0,1,0,0|2,0,1]=4 727 B9R1.79 NCC(F)CC1CCC1 MCULE-6989081385 [0,0,0,1,0,0|2,0,1]=4 728 B9R1.79 NCC(F)CC1CCC1 MCULE-8217653310 [0,0,0,1,0,0|2,0,1]=4 729 B9R1.89 BrCC1CCCCCC1 MCULE-3804149088 [0,0,0,1,0,0|2,0,1]=4 730 B9R1.89 BrCC1OCCCCO1 MCULE-3435142846 [0,0,0,1,0,0|2,0,1]=4 731 B9R1.89 C#CC1CCCCCC1 MCULE-7810681377 [0,0,0,1,0,0|1,0,2]=4 732 B9R1.89 C#CC1CCCCCN1 MCULE-3552819377 [0,0,0,1,0,0|1,0,2]=4 733 B9R1.89 CCC1CCCCCN1 MCULE-9043964617 [0,0,0,1,0,0|1,0,2]=4 734 B9R1.89 CCC1CNCCCO1 MCULE-5736441757 [0,0,0,1,0,0|1,0,2]=4 735 B9R1.89 CNC1CCCCCC1 MCULE-3477928342 [0,0,0,1,0,0|2,0,1]=4 736 B9R1.89 CNC1CCCCCC1 MCULE-9182986806 [0,0,0,1,0,0|2,0,1]=4 737 B9R1.89 ClCC1CCCCCN1 MCULE-7509075716 [0,0,0,1,0,0|2,0,1]=4 738 B9R1.89 ClCC1CCCCCN1 MCULE-9950332690 [0,0,0,1,0,0|2,0,1]=4 739 B9R1.89 FCC1CCNCCO1 MCULE-2885724612 [0,0,0,1,0,0|2,0,1]=4 740 B9R1.89 FCC1CCNCCO1 MCULE-5255949130 [0,0,0,1,0,0|2,0,1]=4 741 B9R1.89 FCC1CNCCCO1 MCULE-4304507356 [0,0,0,1,0,0|2,0,1]=4 742 B9R1.89 FCC1CNCCCO1 MCULE-5204425397 [0,0,0,1,0,0|2,0,1]=4 743 B9R1.89 ICC1CCCCCO1 MCULE-8717458528 [0,0,0,1,0,0|1,0,1]=3 744 B9R1.89 N#CC1CCCCCC1 MCULE-4572641162 [0,0,0,1,0,0|2,0,1]=4 745 B9R1.89 NCC1CCCCCC1 MCULE-6071072186 [0,0,0,1,0,0|2,0,1]=4 746 B9R1.89 NCC1CCCCCC1 MCULE-8981470928 [0,0,0,1,0,0|2,0,1]=4 747 B9R1.89 NNC1CCCCCC1 MCULE-1821259900 [0,0,0,1,0,0|3,0,0]=4 748 B9R1.89 NNC1CCCCCC1 MCULE-6325204009 [0,0,0,1,0,0|3,0,0]=4 749 B9R1.89 NNC1CCCCCC1 MCULE-7894671218 [0,0,0,1,0,0|3,0,0]=4 750 B9R1.89 O=CC1=CCCCCC1 MCULE-8414068028 [0,0,0,1,0,0|2,0,1]=4 751 B9R1.89 O=CC1CCCCCC1 MCULE-2750232256 [0,0,0,1,0,0|2,0,0]=3 752 B9R1.89 O=CC1CCCOCC1 MCULE-9140244119 [0,0,0,1,0,0|3,0,0]=4 753 B9R1.89 O=CN1CCCCCC1 MCULE-9803587111 [0,0,0,1,0,0|3,0,0]=4 754 B9R1.89 OCC1CCCCCC1 MCULE-1749370417 [0,0,0,1,0,0|2,0,1]=4 755 B9R1.89 OCC1CCCCCC1 MCULE-2629813419 [0,0,0,1,0,0|2,0,1]=4 756 B9R1.89 OCC1CCCCCN1 MCULE-1586506984 [0,0,0,1,0,0|2,0,1]=4 757 B9R1.89 OCC1CCNCCO1 MCULE-9176508562 [0,0,0,1,0,0|2,0,1]=4 758 B9R1.89 OCC1CNCCCO1 MCULE-7903525804 [0,0,0,1,0,0|2,0,1]=4 759 B9R1.89 OCC1CNCCCO1 MCULE-9908272497 [0,0,0,1,0,0|2,0,1]=4 760 B9R1.89 OC[C@@H]1CCCCCN1 MCULE-3068262302 [0,0,0,1,0,0|2,0,1]=4 761 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-3544932007 [0,0,0,1,0,0|2,0,1]=4 762 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-4726628241 [0,0,0,1,0,0|2,0,1]=4 763 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-5225680882 [0,0,0,1,0,0|2,0,1]=4 764 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-5475510815 [0,0,0,1,0,0|2,0,1]=4 765 B9R1.89 OC[C@H]1CNCCCO1 MCULE-2922219127 [0,0,0,1,0,0|2,0,1]=4 766 B9R1.89 OC[C@H]1CNCCCO1 MCULE-3177968218 [0,0,0,1,0,0|2,0,1]=4 767 B9R1.89 OC[C@H]1CNCCCO1 MCULE-3793527665 [0,0,0,1,0,0|2,0,1]=4 768 B9R1.89 OC[C@H]1CNCCCO1 MCULE-7260252629 [0,0,0,1,0,0|2,0,1]=4 769 B9R1.118 C#CC1(CCCCC1)C MCULE-5741070838 [0,0,0,1,0,0|1,0,2]=4 770 B9R1.118 C#CC1(CCCCC1)Cl MCULE-7868465357 [0,0,0,1,0,0|1,0,2]=4 771 B9R1.118 C#CC1(CCCCC1)N MCULE-3624994918 [0,0,0,1,0,0|1,0,2]=4 772 B9R1.118 C#CC1(CCCCC1)N MCULE-4253590078 [0,0,0,1,0,0|1,0,2]=4 773 B9R1.118 C#CC1(CCCCC1)N MCULE-5146757979 [0,0,0,1,0,0|1,0,2]=4 774 B9R1.118 C#CC1(CCCCC1)N MCULE-6592648519 [0,0,0,1,0,0|1,0,2]=4 775 B9R1.118 C#CC1(CCCCC1)O MCULE-8943429628 [0,0,0,1,0,0|0,0,2]=3 776 B9R1.118 C#CC1(CCCOC1)O MCULE-6315759535 [0,0,0,1,0,0|1,0,2]=4 777 B9R1.118 C#CC1(CCNCC1)O MCULE-7283234495 [0,0,0,1,0,0|1,0,2]=4 778 B9R1.118 C#CC1(CCNCC1)O MCULE-9532622997 [0,0,0,1,0,0|1,0,2]=4 779 B9R1.118 C#CC1(CCOCC1)O MCULE-4446957816 [0,0,0,1,0,0|1,0,2]=4 780 B9R1.118 C=CC1(CCCCC1)O MCULE-7521116261 [0,0,0,1,0,0|0,0,0]=1 781 B9R1.118 C=CC1(CCOCC1)O MCULE-1347861395 [0,0,0,1,0,0|1,0,0]=2 782 B9R1.118 CC1(CCCCC1)C#N MCULE-7897108181 [0,0,0,1,0,0|2,0,1]=4 783 B9R1.118 CC1(CCCCC1)C=O MCULE-5963131023 [0,0,0,1,0,0|2,0,0]=3 784 B9R1.118 CC1(CCCCC1)CBr MCULE-2357240305 [0,0,0,1,0,0|2,0,1]=4 785 B9R1.118 CC1(CCCCC1)CCl MCULE-9584097812 [0,0,0,1,0,0|2,0,1]=4 786 B9R1.118 CC1(CCCCC1)CN MCULE-1723013704 [0,0,0,1,0,0|2,0,1]=4 787 B9R1.118 CC1(CCCCC1)CO MCULE-7082905261 [0,0,0,1,0,0|2,0,1]=4 788 B9R1.118 CC1(CCCCC1)CS MCULE-4716166156 [0,0,0,1,0,0|2,0,1]=4 789 B9R1.118 CC1(CCCCC1)NN MCULE-3928679842 [0,0,0,1,0,0|3,0,0]=4 790 B9R1.118 CC1(CCCCC1)NN MCULE-7771268201 [0,0,0,1,0,0|3,0,0]=4 791 B9R1.118 CC1(CCCCO1)C=O MCULE-9760251174 [0,0,0,1,0,0|3,0,0]=4 792 B9R1.118 CC1(CCOCC1)C=O MCULE-8265392725 [0,0,0,1,0,0|3,0,0]=4 793 B9R1.118 CCC1(CCCCC1)Cl MCULE-5513648578 [0,0,0,1,0,0|1,0,2]=4 794 B9R1.118 CCC1(CCCCC1)N MCULE-3886661042 [0,0,0,1,0,0|1,0,2]=4 795 B9R1.118 CCC1(CCCCC1)N MCULE-3921643203 [0,0,0,1,0,0|1,0,2]=4 796 B9R1.118 CCC1(CCCCC1)O MCULE-9314704343 [0,0,0,1,0,0|0,0,2]=3 797 B9R1.118 CCC1(CCCNC1)O MCULE-2359766186 [0,0,0,1,0,0|1,0,2]=4 798 B9R1.118 CCC1(CCCNC1)O MCULE-4654641315 [0,0,0,1,0,0|1,0,2]=4 799 B9R1.118 CCC1(CCNCC1)O MCULE-5103122746 [0,0,0,1,0,0|1,0,2]=4 800 B9R1.118 CCC1(CCNCC1)O MCULE-8900140051 [0,0,0,1,0,0|1,0,2]=4 801 B9R1.118 FC1(CCCCC1)CBr MCULE-6400317289 [0,0,0,1,0,0|2,0,1]=4 802 B9R1.118 N#CC1(CCCCC1)Br MCULE-6557237238 [0,0,0,1,0,0|2,0,1]=4 803 B9R1.118 N#CC1(CCCCC1)Cl MCULE-3728304151 [0,0,0,1,0,0|2,0,1]=4 804 B9R1.118 N#CC1(CCCCC1)N MCULE-6005660314 [0,0,0,1,0,0|2,0,1]=4 805 B9R1.118 N#CC1(CCCCC1)N MCULE-8198076555 [0,0,0,1,0,0|2,0,1]=4 806 B9R1.118 N#CC1(CCCCC1)O MCULE-5791427313 [0,0,0,1,0,0|1,0,1]=3 807 B9R1.118 N#CC1(CCCNC1)O MCULE-2572229172 [0,0,0,1,0,0|2,0,1]=4 808 B9R1.118 N#CC1(CCCNC1)O MCULE-7780369642 [0,0,0,1,0,0|2,0,1]=4 809 B9R1.118 N#CC1(CCNCC1)O MCULE-1294968081 [0,0,0,1,0,0|2,0,1]=4 810 B9R1.118 N#CC1(CCNCC1)O MCULE-9444608414 [0,0,0,1,0,0|2,0,1]=4 811 B9R1.118 N#CC1(CCOCC1)O MCULE-9380009767 [0,0,0,1,0,0|2,0,1]=4 812 B9R1.118 NC1(CCCCC1)CO MCULE-5010483791 [0,0,0,1,0,0|2,0,1]=4 813 B9R1.118 NC1(CCCCC1)CO MCULE-9568898546 [0,0,0,1,0,0|2,0,1]=4 814 B9R1.118 NCC1(CCCCC1)F MCULE-7965775019 [0,0,0,1,0,0|2,0,1]=4 815 B9R1.118 NCC1(CCCCC1)F MCULE-8275233201 [0,0,0,1,0,0|2,0,1]=4 816 B9R1.118 NCC1(CCCCC1)N MCULE-1440012619 [0,0,0,1,0,0|2,0,1]=4 817 B9R1.118 NCC1(CCCCC1)N MCULE-4904885698 [0,0,0,1,0,0|2,0,1]=4 818 B9R1.118 NCC1(CCCCC1)N MCULE-5203944425 [0,0,0,1,0,0|2,0,1]=4 819 B9R1.118 NCC1(CCCCC1)O MCULE-2235926257 [0,0,0,1,0,0|1,0,1]=3 820 B9R1.118 NCC1(CCCCC1)O MCULE-3554445977 [0,0,0,1,0,0|1,0,1]=3 821 B9R1.118 NCC1(CCCOC1)O MCULE-3380684017 [0,0,0,1,0,0|2,0,1]=4 822 B9R1.118 NCC1(CCNCC1)O MCULE-2751818260 [0,0,0,1,0,0|2,0,1]=4 823 B9R1.118 NCC1(CCOCC1)O MCULE-2766533080 [0,0,0,1,0,0|2,0,1]=4 824 B9R1.118 NCC1(CCOCC1)O MCULE-9208911413 [0,0,0,1,0,0|2,0,1]=4 825 B9R1.118 NCC1(CCSCC1)O MCULE-9397305788 [0,0,0,1,0,0|2,0,1]=4 826 B9R1.118 O=CC1(CCOCC1)F MCULE-7250965761 [0,0,0,1,0,0|3,0,0]=4 827 B9R1.118 O=CC1(CCSCC1)F MCULE-5821896166 [0,0,0,1,0,0|3,0,0]=4 828 B9R1.118 O=NC1(CCCCC1)Cl MCULE-4752067659 [0,0,0,1,0,0|3,0,0]=4 829 B9R1.118 OC1(CCCCC1)CBr MCULE-3269466977 [0,0,0,1,0,0|1,0,1]=3 830 B9R1.118 OC1(CCCNC1)CF MCULE-8890034237 [0,0,0,1,0,0|2,0,1]=4 831 B9R1.118 OC1(CCCNC1)CF MCULE-9294734195 [0,0,0,1,0,0|2,0,1]=4 832 B9R1.118 OC1(CCNCC1)CF MCULE-5603599172 [0,0,0,1,0,0|2,0,1]=4 833 B9R1.118 OC1(CCNCC1)CF MCULE-7125873306 [0,0,0,1,0,0|2,0,1]=4 834 B9R1.118 OC1(CCOCC1)CBr MCULE-2440342395 [0,0,0,1,0,0|2,0,1]=4 835 B9R1.118 OCC1(CCCCC1)F MCULE-6893319227 [0,0,0,1,0,0|2,0,1]=4 836 B9R1.118 OCC1(CCCCC1)O MCULE-4401054903 [0,0,0,1,0,0|1,0,1]=3 837 B9R1.118 OCC1(CCCCC1)S MCULE-4689452330 [0,0,0,1,0,0|1,1,1]=4 838 B9R1.118 OCC1(CCCNC1)O MCULE-2181561679 [0,0,0,1,0,0|2,0,1]=4 839 B9R1.118 OCC1(CCCNC1)O MCULE-5468132031 [0,0,0,1,0,0|2,0,1]=4 840 B9R1.118 OCC1(CCNCC1)O MCULE-5825046102 [0,0,0,1,0,0|2,0,1]=4 841 B9R1.118 OCC1(CCNCC1)O MCULE-9697641993 [0,0,0,1,0,0|2,0,1]=4 842 B9R1.118 OCC1(CCOCC1)O MCULE-9700422902 [0,0,0,1,0,0|2,0,1]=4 843 B9R1.118 OCC1(CCSCC1)O MCULE-9917132643 [0,0,0,1,0,0|2,0,1]=4 844 B9R1.132 CCN1CCC(C1=O)Br MCULE-9719570091 [0,0,0,1,0,0|3,0,0]=4 845 B9R1.132 CCN1CCC(C1=O)N MCULE-1999772787 [0,0,0,1,0,0|3,0,0]=4 846 B9R1.132 CCN1CCC(C1=O)N MCULE-9509776424 [0,0,0,1,0,0|3,0,0]=4 847 B9R1.202 CC1CCCC1(C)CN MCULE-5501074724 [0,0,0,1,0,0|2,0,1]=4 848 B9R1.202 CC1CCCC1(N)C#N MCULE-6780428529 [0,0,0,1,0,0|2,0,1]=4 849 B9R1.202 CC1CCCC1(O)CN MCULE-5192081064 [0,0,0,1,0,0|1,0,1]=3 850 B9R1.202 CC1OCCC1(O)CN MCULE-1109816284 [0,0,0,1,0,0|2,0,1]=4 851 B6R0.6 BrCCCCCBr MCULE-7929769310 [2,0,0,0,0,0|2,0,0]=4 852 B6R0.6 C#CCCCC=C MCULE-2596375073 [2,0,0,0,0,0|0,0,2]=4 853 B6R0.6 C#CCCCCC MCULE-7776756434 [2,0,0,0,0,0|0,0,2]=4 854 B6R0.6 C#CCCCCO MCULE-2977997146 [2,0,0,0,0,0|0,0,2]=4 855 B6R0.6 C(=C/CCC)\CO MCULE-6491762150 [2,0,0,0,0,0|0,0,2]=4 856 B6R0.6 C/C=C/CCCC MCULE-6900331316 [2,0,0,0,0,0|0,0,2]=4 857 B6R0.6 C/C=C/CCCO MCULE-9865436125 [2,0,0,0,0,0|0,0,2]=4 858 B6R0.6 C/C=C\CCCC MCULE-8426867799 [2,0,0,0,0,0|0,0,2]=4 859 B6R0.6 C/C=C\CCCO MCULE-3169839661 [2,0,0,0,0,0|0,0,2]=4 860 B6R0.6 C=CCC/C=C/C MCULE-3936427871 [2,0,0,0,0,0|0,0,2]=4 861 B6R0.6 C=CCCC=CC MCULE-6481809840 [2,0,0,0,0,0|0,0,2]=4 862 B6R0.6 C=CCCCC#N MCULE-3708293792 [2,0,0,0,0,0|1,0,1]=4 863 B6R0.6 C=CCCCC=O MCULE-8676840281 [2,0,0,0,0,0|1,0,1]=4 864 B6R0.6 C=CCCCCBr MCULE-4313298656 [2,0,0,0,0,0|1,0,0]=3 865 B6R0.6 C=CCCCCC MCULE-5868303078 [2,0,0,0,0,0|0,0,0]=2 866 B6R0.6 C=CCCCCCl MCULE-7600727876 [2,0,0,0,0,0|1,0,0]=3 867 B6R0.6 C=CCCCCI MCULE-5694143061 [2,0,0,0,0,0|1,0,0]=3 868 B6R0.6 C=CCCCCN MCULE-1489231988 [2,0,0,0,0,0|1,0,0]=3 869 B6R0.6 C=CCCCCN MCULE-4288584778 [2,0,0,0,0,0|1,0,0]=3 870 B6R0.6 C=CCCCCO MCULE-3631432277 [2,0,0,0,0,0|1,0,0]=3 871 B6R0.6 C=CCCCNC MCULE-6696525157 [2,0,0,0,0,0|1,0,0]=3 872 B6R0.6 C=CCCCNC MCULE-7417274044 [2,0,0,0,0,0|1,0,0]=3 873 B6R0.6 C=CCCCON MCULE-6496647420 [2,0,0,0,0,0|2,0,0]=4 874 B6R0.6 C=CCCCON MCULE-7055713530 [2,0,0,0,0,0|2,0,0]=4 875 B6R0.6 C=CCNCCC MCULE-4239068147 [2,0,0,0,0,0|1,0,0]=3 876 B6R0.6 C=CCNCCC MCULE-9778489216 [2,0,0,0,0,0|1,0,0]=3 877 B6R0.6 C=CCNCCO MCULE-5860509324 [2,0,0,0,0,0|2,0,0]=4 878 B6R0.6 C=CCOCCBr MCULE-7565992230 [2,0,0,0,0,0|2,0,0]=4 879 B6R0.6 C=CCOCCCl MCULE-1353236332 [2,0,0,0,0,0|2,0,0]=4 880 B6R0.6 C=CCOCCI MCULE-8468439129 [2,0,0,0,0,0|2,0,0]=4 881 B6R0.6 C=CCOCCN MCULE-5411259412 [2,0,0,0,0,0|2,0,0]=4 882 B6R0.6 C=CCOCCN MCULE-9798285838 [2,0,0,0,0,0|2,0,0]=4 883 B6R0.6 C=CCOCCO MCULE-5718868633 [2,0,0,0,0,0|2,0,0]=4 884 B6R0.6 C=CCOCOC MCULE-6553342654 [2,0,0,0,0,0|2,0,0]=4 885 B6R0.6 C=CCSCCC MCULE-3855352363 [2,0,0,0,0,0|1,0,0]=3 886 B6R0.6 C=CCSCCN MCULE-3972995930 [2,0,0,0,0,0|2,0,0]=4 887 B6R0.6 C=CCSCCN MCULE-9922932955 [2,0,0,0,0,0|2,0,0]=4 888 B6R0.6 C=COCCCC MCULE-2025922328 [2,0,0,0,0,0|1,0,0]=3 889 B6R0.6 C=COCCCN MCULE-1669664157 [2,0,0,0,0,0|2,0,0]=4 890 B6R0.6 C=COCCCO MCULE-8325617945 [2,0,0,0,0,0|2,0,0]=4 891 B6R0.6 C=COCCOC MCULE-6845218696 [2,0,0,0,0,0|2,0,0]=4 892 B6R0.6 CC#CCCCO MCULE-6502564684 [2,0,0,0,0,0|0,0,2]=4 893 B6R0.6 CC/C=C/CCO MCULE-9853729917 [2,0,0,0,0,0|0,0,2]=4 894 B6R0.6 CC/C=C\CCO MCULE-9206958060 [2,0,0,0,0,0|0,0,2]=4 895 B6R0.6 CC=CCCCC MCULE-7277981733 [2,0,0,0,0,0|0,0,2]=4 896 B6R0.6 CC=CCCCO MCULE-1401303632 [2,0,0,0,0,0|0,0,2]=4 897 B6R0.6 CCC#CCCO MCULE-1699744538 [2,0,0,0,0,0|0,0,2]=4 898 B6R0.6 CCC=CCCO MCULE-1781375433 [2,0,0,0,0,0|0,0,2]=4 899 B6R0.6 CCCC#CCO MCULE-8352024607 [2,0,0,0,0,0|0,0,2]=4 900 B6R0.6 CCCC=CCO MCULE-3204738641 [2,0,0,0,0,0|0,0,2]=4 901 B6R0.6 CCCCCC#N MCULE-7596791521 [2,0,0,0,0,0|1,0,1]=4 902 B6R0.6 CCCCCC=O MCULE-6770578514 [2,0,0,0,0,0|1,0,0]=3 903 B6R0.6 CCCCCCBr MCULE-6022503394 [2,0,0,0,0,0|1,0,0]=3 904 B6R0.6 CCCCCCC MCULE-5817084747 [2,0,0,0,0,0|0,0,1]=3 905 B6R0.6 CCCCCCCl MCULE-3706149525 [2,0,0,0,0,0|1,0,0]=3 906 B6R0.6 CCCCCCF MCULE-4320903575 [2,0,0,0,0,0|1,0,0]=3 907 B6R0.6 CCCCCCI MCULE-1021236615 [2,0,0,0,0,0|1,0,0]=3 908 B6R0.6 CCCCCCN MCULE-2944455155 [2,0,0,0,0,0|1,0,0]=3 909 B6R0.6 CCCCCCN MCULE-6014217174 [2,0,0,0,0,0|1,0,0]=3 910 B6R0.6 CCCCCCN MCULE-6021451227 [2,0,0,0,0,0|1,0,0]=3 911 B6R0.6 CCCCCCO MCULE-4299150163 [2,0,0,0,0,0|0,0,0]=2 912 B6R0.6 CCCCCCS MCULE-5962964855 [2,0,0,0,0,0|0,1,0]=3 913 B6R0.6 CCCCCNC MCULE-8082703734 [2,0,0,0,0,0|1,0,1]=4 914 B6R0.6 CCCCCNN MCULE-5089668540 [2,0,0,0,0,0|2,0,0]=4 915 B6R0.6 CCCCCNN MCULE-7265120524 [2,0,0,0,0,0|2,0,0]=4 916 B6R0.6 CCCCCOC MCULE-3370181741 [2,0,0,0,0,0|1,0,1]=4 917 B6R0.6 CCCCCON MCULE-5372426564 [2,0,0,0,0,0|2,0,0]=4 918 B6R0.6 CCCCCON MCULE-8557641459 [2,0,0,0,0,0|2,0,0]=4 919 B6R0.6 CCCCCSC MCULE-6566108868 [2,0,0,0,0,0|1,0,1]=4 920 B6R0.6 CCCCNC=O MCULE-8821792924 [2,0,0,0,0,0|2,0,0]=4 921 B6R0.6 CCCCNCC MCULE-8816750429 [2,0,0,0,0,0|1,0,1]=4 922 B6R0.6 CCCCOC=O MCULE-4633421026 [2,0,0,0,0,0|2,0,0]=4 923 B6R0.6 CCCCOCC MCULE-5662731951 [2,0,0,0,0,0|1,0,1]=4 924 B6R0.6 CCCCOCCl MCULE-5282964693 [2,0,0,0,0,0|2,0,0]=4 925 B6R0.6 CCCCSCC MCULE-4832924468 [2,0,0,0,0,0|1,0,1]=4 926 B6R0.6 CCCCSCCl MCULE-4907770015 [2,0,0,0,0,0|2,0,0]=4 927 B6R0.6 CCCNCCC MCULE-1452672638 [2,0,0,0,0,0|1,0,1]=4 928 B6R0.6 CCCNCCC MCULE-6223802621 [2,0,0,0,0,0|1,0,1]=4 929 B6R0.6 CCCNCCC MCULE-6789654118 [2,0,0,0,0,0|1,0,1]=4 930 B6R0.6 CCCNCCN MCULE-2288945868 [2,0,0,0,0,0|2,0,0]=4 931 B6R0.6 CCCNCCO MCULE-4813687741 [2,0,0,0,0,0|1,0,0]=3 932 B6R0.6 CCCOCCC MCULE-1390130917 [2,0,0,0,0,0|1,0,1]=4 933 B6R0.6 CCCOCCCl MCULE-6561613708 [2,0,0,0,0,0|2,0,0]=4 934 B6R0.6 CCCOCCI MCULE-5330098176 [2,0,0,0,0,0|2,0,0]=4 935 B6R0.6 CCCOCCN MCULE-1987261931 [2,0,0,0,0,0|2,0,0]=4 936 B6R0.6 CCCOCCN MCULE-9033871038 [2,0,0,0,0,0|2,0,0]=4 937 B6R0.6 CCCOCCO MCULE-3263526264 [2,0,0,0,0,0|1,0,0]=3 938 B6R0.6 CCCSCCC MCULE-5531652471 [2,0,0,0,0,0|1,0,1]=4 939 B6R0.6 CCCSCCN MCULE-3934428121 [2,0,0,0,0,0|2,0,0]=4 940 B6R0.6 CCCSCCN MCULE-5705755172 [2,0,0,0,0,0|2,0,0]=4 941 B6R0.6 CCCSCCO MCULE-8371796663 [2,0,0,0,0,0|1,0,0]=3 942 B6R0.6 CCNCCCN MCULE-5811169148 [2,0,0,0,0,0|2,0,0]=4 943 B6R0.6 CCNCCCO MCULE-3251610052 [2,0,0,0,0,0|1,0,0]=3 944 B6R0.6 CCOCCC=O MCULE-1664130148 [2,0,0,0,0,0|2,0,0]=4 945 B6R0.6 CCOCCCBr MCULE-6544747281 [2,0,0,0,0,0|2,0,0]=4 946 B6R0.6 CCOCCCCl MCULE-8523618681 [2,0,0,0,0,0|2,0,0]=4 947 B6R0.6 CCOCCCI MCULE-6640732668 [2,0,0,0,0,0|2,0,0]=4 948 B6R0.6 CCOCCCN MCULE-3491529722 [2,0,0,0,0,0|2,0,0]=4 949 B6R0.6 CCOCCCO MCULE-3077567484 [2,0,0,0,0,0|1,0,0]=3 950 B6R0.6 CCSCCC=O MCULE-2493452950 [2,0,0,0,0,0|2,0,0]=4 951 B6R0.6 CCSCCCBr MCULE-5143634954 [2,0,0,0,0,0|2,0,0]=4 952 B6R0.6 CCSCCCN MCULE-4566450606 [2,0,0,0,0,0|2,0,0]=4 953 B6R0.6 CCSCCCO MCULE-6719011943 [2,0,0,0,0,0|1,0,0]=3 954 B6R0.6 CNCCCCBr MCULE-4148452640 [2,0,0,0,0,0|2,0,0]=4 955 B6R0.6 CNCCCCBr MCULE-8686440557 [2,0,0,0,0,0|2,0,0]=4 956 B6R0.6 CNCCCCCl MCULE-1170786568 [2,0,0,0,0,0|2,0,0]=4 957 B6R0.6 CNCCCCCl MCULE-1726466829 [2,0,0,0,0,0|2,0,0]=4 958 B6R0.6 CNCCCCN MCULE-2542685963 [2,0,0,0,0,0|2,0,0]=4 959 B6R0.6 CNCCCCN MCULE-7925344560 [2,0,0,0,0,0|2,0,0]=4 960 B6R0.6 CNCCCCO MCULE-9264393637 [2,0,0,0,0,0|1,0,0]=3 961 B6R0.6 COCCCC=O MCULE-2055914202 [2,0,0,0,0,0|2,0,0]=4 962 B6R0.6 COCCCCBr MCULE-7500019583 [2,0,0,0,0,0|2,0,0]=4 963 B6R0.6 COCCCCCl MCULE-3863170338 [2,0,0,0,0,0|2,0,0]=4 964 B6R0.6 COCCCCN MCULE-9584631056 [2,0,0,0,0,0|2,0,0]=4 965 B6R0.6 COCCCCO MCULE-2543196930 [2,0,0,0,0,0|1,0,0]=3 966 B6R0.6 COCCCCO MCULE-8659106280 [2,0,0,0,0,0|1,0,0]=3 967 B6R0.6 COCOCCO MCULE-8093241209 [2,0,0,0,0,0|2,0,0]=4 968 B6R0.6 CSCCCC=O MCULE-6353729217 [2,0,0,0,0,0|2,0,0]=4 969 B6R0.6 CSCCCCN MCULE-2391033479 [2,0,0,0,0,0|2,0,0]=4 970 B6R0.6 CSCCCCO MCULE-1045422424 [2,0,0,0,0,0|1,0,0]=3 971 B6R0.6 ClCCCCCBr MCULE-6767883252 [2,0,0,0,0,0|2,0,0]=4 972 B6R0.6 ClCCCCCCl MCULE-9302388009 [2,0,0,0,0,0|2,0,0]=4 973 B6R0.6 ClCCCCCI MCULE-2173931817 [2,0,0,0,0,0|2,0,0]=4 974 B6R0.6 FCCCCCBr MCULE-1314383985 [2,0,0,0,0,0|2,0,0]=4 975 B6R0.6 ICCCCCI MCULE-2889089700 [2,0,0,0,0,0|2,0,0]=4 976 B6R0.6 N#CCCCCO MCULE-4289736283 [2,0,0,0,0,0|1,0,1]=4 977 B6R0.6 NCCCCCBr MCULE-3577483607 [2,0,0,0,0,0|2,0,0]=4 978 B6R0.6 NCCCCCBr MCULE-7572691537 [2,0,0,0,0,0|2,0,0]=4 979 B6R0.6 NCCCCCF MCULE-1057270243 [2,0,0,0,0,0|2,0,0]=4 980 B6R0.6 NCCCCCN MCULE-3785554987 [2,0,0,0,0,0|2,0,0]=4 981 B6R0.6 NCCCCCN MCULE-5173983982 [2,0,0,0,0,0|2,0,0]=4 982 B6R0.6 NCCCCCO MCULE-8877250712 [2,0,0,0,0,0|1,0,0]=3 983 B6R0.6 NCCCCCS MCULE-1813104379 [2,0,0,0,0,0|1,1,0]=4 984 B6R0.6 NCCCCCS MCULE-6081835870 [2,0,0,0,0,0|1,1,0]=4 985 B6R0.6 NCCCCNO MCULE-6478748569 [2,0,0,0,0,0|2,0,0]=4 986 B6R0.6 NCCNCCO MCULE-2112359407 [2,0,0,0,0,0|2,0,0]=4 987 B6R0.6 NCCOCCO MCULE-1073574088 [2,0,0,0,0,0|2,0,0]=4 988 B6R0.6 NCCSCCO MCULE-1475378446 [2,0,0,0,0,0|2,0,0]=4 989 B6R0.6 NNCCCCO MCULE-3928748589 [2,0,0,0,0,0|2,0,0]=4 990 B6R0.6 O=CCCCCCl MCULE-1257670284 [2,0,0,0,0,0|2,0,0]=4 991 B6R0.6 O=CCCCCO MCULE-7959082228 [2,0,0,0,0,0|1,0,1]=4 992 B6R0.6 OCCCCCBr MCULE-1444733196 [2,0,0,0,0,0|1,0,0]=3 993 B6R0.6 OCCCCCCl MCULE-5666058059 [2,0,0,0,0,0|1,0,0]=3 994 B6R0.6 OCCCCCF MCULE-9253204275 [2,0,0,0,0,0|1,0,0]=3 995 B6R0.6 OCCCCCI MCULE-8707758496 [2,0,0,0,0,0|1,0,0]=3 996 B6R0.6 OCCCCCO MCULE-1044076048 [2,0,0,0,0,0|1,0,0]=3 997 B6R0.6 OCCNCCCl MCULE-7809492267 [2,0,0,0,0,0|2,0,0]=4 998 B6R0.6 OCCNCCCl MCULE-9007709158 [2,0,0,0,0,0|2,0,0]=4 999 B6R0.6 OCCNCCO MCULE-9183096746 [2,0,0,0,0,0|2,0,0]=4 1000 B6R0.6 OCCNCCO MCULE-9803420258 [2,0,0,0,0,0|2,0,0]=4 1001 B6R0.6 OCCOCCBr MCULE-2641000270 [2,0,0,0,0,0|2,0,0]=4 1002 B6R0.6 OCCOCCCl MCULE-7320539957 [2,0,0,0,0,0|2,0,0]=4 1003 B6R0.6 OCCOCCF MCULE-1780385479 [2,0,0,0,0,0|2,0,0]=4 1004 B6R0.6 OCCOCCI MCULE-1083607130 [2,0,0,0,0,0|2,0,0]=4 1005 B6R0.6 OCCOCCO MCULE-1531783732 [2,0,0,0,0,0|2,0,0]=4 1006 B6R0.6 OCCSCCO MCULE-5502656030 [2,0,0,0,0,0|2,0,0]=4 1007 B6R0.6 OCCSCCS MCULE-4418561990 [2,0,0,0,0,0|2,0,0]=4 1008 B6R0.6 SCCCCCS MCULE-4899719552 [2,0,0,0,0,0|1,1,0]=4 1009 B6R0.1 C#CC(O)CCC MCULE-6152066005 [2,0,0,0,0,0|0,0,2]=4 1010 B6R0.1 C=CC(=O)CCC MCULE-9373104880 [2,0,0,0,0,0|0,0,2]=4 1011 B6R0.1 C=CC(C)CCC MCULE-2692803387 [2,0,0,0,0,0|1,0,0]=3 1012 B6R0.1 C=CC(C)CCO MCULE-2890369298 [2,0,0,0,0,0|2,0,0]=4 1013 B6R0.1 C=CC(N)CCO MCULE-7781906138 [2,0,0,0,0,0|2,0,0]=4 1014 B6R0.1 C=CC(N)COC MCULE-3217346081 [2,0,0,0,0,0|2,0,0]=4 1015 B6R0.1 C=CC(O)CC#N MCULE-2128554895 [2,0,0,0,0,0|1,0,1]=4 1016 B6R0.1 C=CC(O)CCC MCULE-3664453040 [2,0,0,0,0,0|0,0,0]=2 1017 B6R0.1 C=CC(O)CCN MCULE-9346205308 [2,0,0,0,0,0|1,0,0]=3 1018 B6R0.1 C=CCC(O)C=C MCULE-3803883413 [2,0,0,0,0,0|0,0,2]=4 1019 B6R0.1 C=C[C@@H](O)CC#N MCULE-7370913372 [2,0,0,0,0,0|1,0,1]=4 1020 B6R0.1 CCCC(C)C=O MCULE-9756444218 [2,0,0,0,0,0|2,0,0]=4 1021 B6R0.1 CCCC(O)C#N MCULE-7017059503 [2,0,0,0,0,0|1,0,1]=4 1022 B6R0.1 CCCC(O)CBr MCULE-5186252424 [2,0,0,0,0,0|1,0,1]=4 1023 B6R0.1 CCCC(O)CC MCULE-9504041935 [2,0,0,0,0,0|0,0,2]=4 1024 B6R0.1 CCCC(O)CCl MCULE-4737360217 [2,0,0,0,0,0|1,0,1]=4 1025 B6R0.1 CCCC(O)CN MCULE-9402934997 [2,0,0,0,0,0|1,0,1]=4 1026 B6R0.1 CCCC(O)CO MCULE-5124107719 [2,0,0,0,0,0|1,0,1]=4 1027 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [2,0,0,0,0,0|0,0,2]=4 1028 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [2,0,0,0,0,0|0,0,2]=4 1029 B6R0.4 C=C(C)CCCC MCULE-1010177756 [2,0,0,0,0,0|1,0,1]=4 1030 B6R0.4 CC(O)CCCBr MCULE-5477662754 [2,0,0,0,0,0|1,0,1]=4 1031 B6R0.4 CC(O)CCCCl MCULE-6993728810 [2,0,0,0,0,0|1,0,1]=4 1032 B6R0.4 CC(O)CCCN MCULE-3754805134 [2,0,0,0,0,0|1,0,1]=4 1033 B6R0.4 CC(O)CCCO MCULE-6580326052 [2,0,0,0,0,0|1,0,1]=4 1034 B6R0.4 CCCCB(O)O MCULE-9002672645 [2,0,0,0,0,0|2,0,0]=4 1035 B6R0.4 CCCCC(=O)O MCULE-2333640078 [2,0,0,0,0,0|1,0,1]=4 1036 B6R0.4 CCCCC(C)Br MCULE-3252474574 [2,0,0,0,0,0|1,0,1]=4 1037 B6R0.4 CCCCC(C)C MCULE-7568461039 [2,0,0,0,0,0|1,0,1]=4 1038 B6R0.4 CCCCC(C)Cl MCULE-4825682003 [2,0,0,0,0,0|1,0,1]=4 1039 B6R0.4 CCCCC(C)N MCULE-5349371506 [2,0,0,0,0,0|1,0,1]=4 1040 B6R0.4 CCCCC(C)N MCULE-6696490028 [2,0,0,0,0,0|1,0,1]=4 1041 B6R0.4 CCCCC(C)O MCULE-6558228722 [2,0,0,0,0,0|0,0,1]=3 1042 B6R0.4 CCCCC(C)S MCULE-4791681848 [2,0,0,0,0,0|0,1,1]=4 1043 B6R0.4 CCCC[C@@H](C)N MCULE-2673058676 [2,0,0,0,0,0|1,0,1]=4 1044 B6R0.4 CCCC[C@@H](C)N MCULE-7666196055 [2,0,0,0,0,0|1,0,1]=4 1045 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [2,0,0,0,0,0|0,0,1]=3 1046 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [2,0,0,0,0,0|0,0,1]=3 1047 B6R0.4 CCCC[C@H](C)N MCULE-6212068145 [2,0,0,0,0,0|1,0,1]=4 1048 B6R0.4 CCCC[C@H](C)N MCULE-7818513999 [2,0,0,0,0,0|1,0,1]=4 1049 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [2,0,0,0,0,0|0,0,1]=3 1050 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [2,0,0,0,0,0|0,0,1]=3 1051 B6R0.4 CCNCC(C)O MCULE-5078068369 [2,0,0,0,0,0|1,0,1]=4 1052 B6R0.4 CCNC[C@@H](C)O MCULE-4291219061 [2,0,0,0,0,0|1,0,1]=4 1053 B6R0.4 CCNC[C@@H](C)O MCULE-8603386701 [2,0,0,0,0,0|1,0,1]=4 1054 B6R0.4 CCNC[C@H](C)O MCULE-7173470231 [2,0,0,0,0,0|1,0,1]=4 1055 B6R0.4 CCNC[C@H](C)O MCULE-9651301254 [2,0,0,0,0,0|1,0,1]=4 1056 B6R0.4 CCOCC(C)O MCULE-6224339526 [2,0,0,0,0,0|1,0,1]=4 1057 B6R0.4 CCOC[C@@H](C)O MCULE-9075407512 [2,0,0,0,0,0|1,0,1]=4 1058 B6R0.4 CNCCC(C)O MCULE-1615526002 [2,0,0,0,0,0|1,0,1]=4 1059 B6R0.4 COCCC(C)O MCULE-6536001437 [2,0,0,0,0,0|1,0,1]=4 1060 B6R0.4 CSCCC(C)O MCULE-5934844952 [2,0,0,0,0,0|1,0,1]=4 1061 B6R0.4 C[C@@H](O)CCCO MCULE-1658231016 [2,0,0,0,0,0|1,0,1]=4 1062 B8R0.1 C=CCC(=O)CCCC MCULE-4100882049 [1,1,0,0,0,0|0,0,1]=3 1063 B8R0.1 C=CCC(O)CCCC MCULE-4055894447 [1,1,0,0,0,0|0,0,0]=2 1064 B8R0.1 C=CCCC(=O)CCC MCULE-9846709255 [1,1,0,0,0,0|0,0,1]=3 1065 B8R0.1 C=CCCC(=O)OCC MCULE-4147956319 [1,1,0,0,0,0|1,0,1]=4 1066 B8R0.1 C=CCCC(C)CCC MCULE-8046771961 [1,1,0,0,0,0|0,0,0]=2 1067 B8R0.1 C=CCCC(O)CCC MCULE-4495559867 [1,1,0,0,0,0|0,0,0]=2 1068 B8R0.1 C=CCNC(C)COC MCULE-5133832185 [1,1,0,0,0,0|2,0,0]=4 1069 B8R0.1 C=CCNC(C)COC MCULE-7900399976 [1,1,0,0,0,0|2,0,0]=4 1070 B8R0.1 C=CCOC(=O)CCC MCULE-7209016839 [1,1,0,0,0,0|1,0,1]=4 1071 B8R0.1 CCCC(C)CCCBr MCULE-3368342552 [1,1,0,0,0,0|1,0,1]=4 1072 B8R0.1 CCCC(C)CCCO MCULE-9229761768 [1,1,0,0,0,0|1,0,1]=4 1073 B8R0.1 CCCC(C)COC=O MCULE-4206126891 [1,1,0,0,0,0|2,0,0]=4 1074 B8R0.1 CCCC(O)CCCO MCULE-4169738114 [1,1,0,0,0,0|1,0,1]=4 1075 B8R0.1 CCCC(O)CCCS MCULE-9595771348 [1,1,0,0,0,0|1,0,1]=4 1076 B8R0.1 CCCCC(Br)CCC MCULE-1998636531 [1,1,0,0,0,0|0,0,2]=4 1077 B8R0.1 CCCCC(C)CCO MCULE-7796394440 [1,1,0,0,0,0|1,0,1]=4 1078 B8R0.1 CCCCC(N)CCC MCULE-5245074866 [1,1,0,0,0,0|0,0,2]=4 1079 B8R0.1 CCCCC(N)CCO MCULE-1718868981 [1,1,0,0,0,0|1,0,1]=4 1080 B8R0.1 CCCCC(N)CCO MCULE-6967408250 [1,1,0,0,0,0|1,0,1]=4 1081 B8R0.1 CCCCC(N)CCO MCULE-7169926590 [1,1,0,0,0,0|1,0,1]=4 1082 B8R0.1 CCCCC(N)CCO MCULE-7195068070 [1,1,0,0,0,0|1,0,1]=4 1083 B8R0.1 CCCCC(N)COC MCULE-6869672438 [1,1,0,0,0,0|1,0,1]=4 1084 B8R0.1 CCCCC(O)CCC MCULE-6030672439 [1,1,0,0,0,0|0,0,2]=4 1085 B8R0.1 CCCCC(O)CCO MCULE-1527111701 [1,1,0,0,0,0|1,0,1]=4 1086 B8R0.1 CCCC[C@H](N)CCO MCULE-1556286414 [1,1,0,0,0,0|1,0,1]=4 1087 B8R0.1 CCCC[C@H](N)CCO MCULE-5421326968 [1,1,0,0,0,0|1,0,1]=4 1088 B8R0.1 CCCC[C@H](N)CCO MCULE-8706513986 [1,1,0,0,0,0|1,0,1]=4 1089 B8R0.4 BrCCCCCCCBr MCULE-4094304263 [1,1,0,0,0,0|1,0,1]=4 1090 B8R0.4 C#CCCCCCC=O MCULE-6168802703 [1,1,0,0,0,0|1,0,1]=4 1091 B8R0.4 C#CCCCCCCBr MCULE-9361347635 [1,1,0,0,0,0|0,0,2]=4 1092 B8R0.4 C#CCCCCCCC MCULE-5881425113 [1,1,0,0,0,0|0,0,2]=4 1093 B8R0.4 C#CCCCCCCCl MCULE-1758332024 [1,1,0,0,0,0|0,0,2]=4 1094 B8R0.4 C#CCCCCCCN MCULE-1593470538 [1,1,0,0,0,0|0,0,2]=4 1095 B8R0.4 C#CCCCCCCN MCULE-4412235962 [1,1,0,0,0,0|0,0,2]=4 1096 B8R0.4 C#CCCCCCCO MCULE-9399870702 [1,1,0,0,0,0|0,0,2]=4 1097 B8R0.4 C=CCCC/C=C/CO MCULE-8670012458 [1,1,0,0,0,0|0,0,2]=4 1098 B8R0.4 C=CCCCC=CCO MCULE-8508232522 [1,1,0,0,0,0|0,0,2]=4 1099 B8R0.4 C=CCCCCCC#N MCULE-9178830162 [1,1,0,0,0,0|0,0,1]=3 1100 B8R0.4 C=CCCCCCC=C MCULE-3963888938 [1,1,0,0,0,0|0,0,1]=3 1101 B8R0.4 C=CCCCCCC=O MCULE-9514877352 [1,1,0,0,0,0|0,0,1]=3 1102 B8R0.4 C=CCCCCCCBr MCULE-6451772855 [1,1,0,0,0,0|0,0,0]=2 1103 B8R0.4 C=CCCCCCCC MCULE-8103203416 [1,1,0,0,0,0|0,0,0]=2 1104 B8R0.4 C=CCCCCCCCl MCULE-2359680024 [1,1,0,0,0,0|0,0,0]=2 1105 B8R0.4 C=CCCCCCCI MCULE-2548377676 [1,1,0,0,0,0|0,0,0]=2 1106 B8R0.4 C=CCCCCCCN MCULE-3465800348 [1,1,0,0,0,0|0,0,0]=2 1107 B8R0.4 C=CCCCCCCN MCULE-9820466293 [1,1,0,0,0,0|0,0,0]=2 1108 B8R0.4 C=CCCCCCCO MCULE-8561904793 [1,1,0,0,0,0|0,0,0]=2 1109 B8R0.4 C=CCCCCCNC MCULE-9487840122 [1,1,0,0,0,0|0,0,0]=2 1110 B8R0.4 C=CCCCCCON MCULE-4401326316 [1,1,0,0,0,0|1,0,0]=3 1111 B8R0.4 C=CCCCCCON MCULE-7563390889 [1,1,0,0,0,0|1,0,0]=3 1112 B8R0.4 C=CCCNCCC=C MCULE-2612954905 [1,1,0,0,0,0|0,0,2]=4 1113 B8R0.4 C=CCCNCCCO MCULE-1492709649 [1,1,0,0,0,0|1,0,0]=3 1114 B8R0.4 C=CCCNCCOC MCULE-3464258553 [1,1,0,0,0,0|1,0,0]=3 1115 B8R0.4 C=CCOCCCCO MCULE-6517087003 [1,1,0,0,0,0|1,0,0]=3 1116 B8R0.4 C=CCSSSCCC MCULE-9939190592 [1,1,0,0,0,0|2,0,0]=4 1117 B8R0.4 C=COCCOCCO MCULE-3936607633 [1,1,0,0,0,0|2,0,0]=4 1118 B8R0.4 CC=CCCCCCC MCULE-2766900913 [1,1,0,0,0,0|0,0,0]=2 1119 B8R0.4 CC=CCSCCCC MCULE-7318808486 [1,1,0,0,0,0|1,0,0]=3 1120 B8R0.4 CCCCBCCCC MCULE-3163100787 [1,1,0,0,0,0|0,0,2]=4 1121 B8R0.4 CCCCBCCCC MCULE-6578781762 [1,1,0,0,0,0|0,0,2]=4 1122 B8R0.4 CCCCC/C=C/C=O MCULE-9410244042 [1,1,0,0,0,0|0,0,1]=3 1123 B8R0.4 CCCCC/C=C/CO MCULE-2538979274 [1,1,0,0,0,0|0,0,2]=4 1124 B8R0.4 CCCCCC#CC=O MCULE-6367130572 [1,1,0,0,0,0|0,0,2]=4 1125 B8R0.4 CCCCCC=CC=O MCULE-7640230490 [1,1,0,0,0,0|0,0,1]=3 1126 B8R0.4 CCCCCC=CCO MCULE-7026544339 [1,1,0,0,0,0|0,0,2]=4 1127 B8R0.4 CCCCCCC=CI MCULE-3614174427 [1,1,0,0,0,0|0,0,0]=2 1128 B8R0.4 CCCCCCCC#N MCULE-3399476727 [1,1,0,0,0,0|0,0,2]=4 1129 B8R0.4 CCCCCCCC=O MCULE-7111365457 [1,1,0,0,0,0|0,0,1]=3 1130 B8R0.4 CCCCCCCCBr MCULE-7484248707 [1,1,0,0,0,0|0,0,2]=4 1131 B8R0.4 CCCCCCCCC MCULE-1865327912 [1,1,0,0,0,0|0,0,2]=4 1132 B8R0.4 CCCCCCCCCl MCULE-5953637232 [1,1,0,0,0,0|0,0,2]=4 1133 B8R0.4 CCCCCCCCF MCULE-5641912511 [1,1,0,0,0,0|0,0,2]=4 1134 B8R0.4 CCCCCCCCI MCULE-7304806902 [1,1,0,0,0,0|0,0,2]=4 1135 B8R0.4 CCCCCCCCN MCULE-6095227778 [1,1,0,0,0,0|0,0,2]=4 1136 B8R0.4 CCCCCCCCN MCULE-7012389700 [1,1,0,0,0,0|0,0,2]=4 1137 B8R0.4 CCCCCCCCN MCULE-7076053015 [1,1,0,0,0,0|0,0,2]=4 1138 B8R0.4 CCCCCCCCO MCULE-2656577895 [1,1,0,0,0,0|0,0,2]=4 1139 B8R0.4 CCCCCCCCS MCULE-5212273874 [1,1,0,0,0,0|0,0,2]=4 1140 B8R0.4 CCCCCCCNC MCULE-1143610772 [1,1,0,0,0,0|0,0,2]=4 1141 B8R0.4 CCCCCCCNN MCULE-7800659587 [1,1,0,0,0,0|1,0,1]=4 1142 B8R0.4 CCCCCCCON MCULE-6380236924 [1,1,0,0,0,0|1,0,1]=4 1143 B8R0.4 CCCCCCCON MCULE-6581043184 [1,1,0,0,0,0|1,0,1]=4 1144 B8R0.4 CCCCCCCSC MCULE-5211260102 [1,1,0,0,0,0|0,0,2]=4 1145 B8R0.4 CCCCCCN=C=O MCULE-6808788959 [1,1,0,0,0,0|1,0,1]=4 1146 B8R0.4 CCCCCCN=C=S MCULE-6056221769 [1,1,0,0,0,0|1,0,1]=4 1147 B8R0.4 CCCCCCN=N#N MCULE-6665514222 [1,1,0,0,0,0|2,0,0]=4 1148 B8R0.4 CCCCCCNC=O MCULE-3719637754 [1,1,0,0,0,0|1,0,0]=3 1149 B8R0.4 CCCCCCOC=O MCULE-1329787181 [1,1,0,0,0,0|1,0,0]=3 1150 B8R0.4 CCCCCCON=O MCULE-9048754026 [1,1,0,0,0,0|2,0,0]=4 1151 B8R0.4 CCCCCCSC#N MCULE-2302732160 [1,1,0,0,0,0|1,0,1]=4 1152 B8R0.4 CCCCCCSCC MCULE-1449428108 [1,1,0,0,0,0|0,0,2]=4 1153 B8R0.4 CCCCCNCCC MCULE-7697830316 [1,1,0,0,0,0|0,0,2]=4 1154 B8R0.4 CCCCCNCCN MCULE-5873419228 [1,1,0,0,0,0|1,0,1]=4 1155 B8R0.4 CCCCCNCCO MCULE-7662965930 [1,1,0,0,0,0|1,0,1]=4 1156 B8R0.4 CCCCCOCCO MCULE-3393695257 [1,1,0,0,0,0|1,0,1]=4 1157 B8R0.4 CCCCCSCCCl MCULE-7680431310 [1,1,0,0,0,0|1,0,1]=4 1158 B8R0.4 CCCCCSCCO MCULE-1239137782 [1,1,0,0,0,0|1,0,1]=4 1159 B8R0.4 CCCCNCCC#N MCULE-1395411662 [1,1,0,0,0,0|1,0,1]=4 1160 B8R0.4 CCCCNCCCC MCULE-1338595384 [1,1,0,0,0,0|0,0,2]=4 1161 B8R0.4 CCCCNCCCC MCULE-4720016177 [1,1,0,0,0,0|0,0,2]=4 1162 B8R0.4 CCCCNCCCC MCULE-6002936904 [1,1,0,0,0,0|0,0,2]=4 1163 B8R0.4 CCCCNCCCC MCULE-8673755112 [1,1,0,0,0,0|0,0,2]=4 1164 B8R0.4 CCCCNCCCCl MCULE-6595599220 [1,1,0,0,0,0|1,0,1]=4 1165 B8R0.4 CCCCNCCCCl MCULE-8225115019 [1,1,0,0,0,0|1,0,1]=4 1166 B8R0.4 CCCCNCCCN MCULE-6098022466 [1,1,0,0,0,0|1,0,1]=4 1167 B8R0.4 CCCCNCCCO MCULE-7171357018 [1,1,0,0,0,0|1,0,1]=4 1168 B8R0.4 CCCCNCCOC MCULE-5142206385 [1,1,0,0,0,0|1,0,1]=4 1169 B8R0.4 CCCCOCCC#N MCULE-6848830768 [1,1,0,0,0,0|1,0,1]=4 1170 B8R0.4 CCCCOCCCC MCULE-8568026186 [1,1,0,0,0,0|0,0,2]=4 1171 B8R0.4 CCCCOCCCN MCULE-2107763231 [1,1,0,0,0,0|1,0,1]=4 1172 B8R0.4 CCCCOCCCO MCULE-2797403638 [1,1,0,0,0,0|1,0,1]=4 1173 B8R0.4 CCCCOCCOC MCULE-4497601798 [1,1,0,0,0,0|1,0,1]=4 1174 B8R0.4 CCCCSCCCC MCULE-3121918458 [1,1,0,0,0,0|0,0,2]=4 1175 B8R0.4 CCCCSCCCN MCULE-6519812920 [1,1,0,0,0,0|1,0,1]=4 1176 B8R0.4 CCCC[NH2+]CCCC MCULE-4333811997 [1,1,0,0,0,0|0,0,2]=4 1177 B8R0.4 CCCC[NH2+]CCCC MCULE-8030655880 [1,1,0,0,0,0|0,0,2]=4 1178 B8R0.4 CCCNCCCCN MCULE-1576152293 [1,1,0,0,0,0|1,0,1]=4 1179 B8R0.4 CCCNCCCCN MCULE-2764845788 [1,1,0,0,0,0|1,0,1]=4 1180 B8R0.4 CCCNCCCNC MCULE-5061364734 [1,1,0,0,0,0|1,0,1]=4 1181 B8R0.4 CCCSCCCCN MCULE-7923615539 [1,1,0,0,0,0|1,0,1]=4 1182 B8R0.4 CCNCCCCCN MCULE-1094310455 [1,1,0,0,0,0|1,0,1]=4 1183 B8R0.4 CCOCCOCC=O MCULE-4431979706 [1,1,0,0,0,0|2,0,0]=4 1184 B8R0.4 CNCCCCCCN MCULE-3241182046 [1,1,0,0,0,0|1,0,1]=4 1185 B8R0.4 CNCCCCCCO MCULE-2582847385 [1,1,0,0,0,0|1,0,1]=4 1186 B8R0.4 COCCCCCCBr MCULE-8590853100 [1,1,0,0,0,0|1,0,1]=4 1187 B8R0.4 COCCCCCCO MCULE-5454628686 [1,1,0,0,0,0|1,0,1]=4 1188 B8R0.4 COCCCCCOC MCULE-5066626930 [1,1,0,0,0,0|1,0,1]=4 1189 B8R0.4 COCCOCCC=O MCULE-4095630051 [1,1,0,0,0,0|2,0,0]=4 1190 B8R0.4 CSCCCCCC#N MCULE-8965259284 [1,1,0,0,0,0|1,0,1]=4 1191 B8R0.4 CSCCCCCCN MCULE-3785645703 [1,1,0,0,0,0|1,0,1]=4 1192 B8R0.4 CSCCCCCCO MCULE-1590282643 [1,1,0,0,0,0|1,0,1]=4 1193 B8R0.4 CSCCCCCSC MCULE-3097194542 [1,1,0,0,0,0|1,0,1]=4 1194 B8R0.4 ClCCCCCCCBr MCULE-6518226792 [1,1,0,0,0,0|1,0,1]=4 1195 B8R0.4 ClCCCCCCCCl MCULE-9270407250 [1,1,0,0,0,0|1,0,1]=4 1196 B8R0.4 N#CCCCCCCBr MCULE-9322605267 [1,1,0,0,0,0|1,0,1]=4 1197 B8R0.4 NCCCCCCCBr MCULE-2103124315 [1,1,0,0,0,0|1,0,1]=4 1198 B8R0.4 NCCCCCCCBr MCULE-9591138313 [1,1,0,0,0,0|1,0,1]=4 1199 B8R0.4 NCCCCCCCN MCULE-3408586405 [1,1,0,0,0,0|1,0,1]=4 1200 B8R0.4 NCCCCCCCO MCULE-6098435698 [1,1,0,0,0,0|1,0,1]=4 1201 B8R0.4 NCCCCCCCO MCULE-8352830275 [1,1,0,0,0,0|1,0,1]=4 1202 B8R0.4 O=CCCCCCC=O MCULE-7016999051 [1,1,0,0,0,0|1,0,1]=4 1203 B8R0.4 O=CCCCCCCBr MCULE-3046622133 [1,1,0,0,0,0|1,0,0]=3 1204 B8R0.4 OCCCCCCCBr MCULE-2559114853 [1,1,0,0,0,0|1,0,1]=4 1205 B8R0.4 OCCCCCCCCl MCULE-4143586059 [1,1,0,0,0,0|1,0,1]=4 1206 B8R0.4 OCCCCCCCI MCULE-3420024644 [1,1,0,0,0,0|1,0,1]=4 1207 B8R0.4 OCCCCCCCO MCULE-1201837142 [1,1,0,0,0,0|1,0,1]=4 1208 B8R0.7 C=C(Br)CCCCC#N MCULE-7605078612 [1,1,0,0,0,0|1,0,1]=4 1209 B8R0.7 C=C(Br)CCCCCC MCULE-3502674829 [1,1,0,0,0,0|0,0,0]=2 1210 B8R0.7 C=C(Br)CCCCCCl MCULE-8350652246 [1,1,0,0,0,0|1,0,0]=3 1211 B8R0.7 C=C(Br)CNCCCC MCULE-5896177180 [1,1,0,0,0,0|1,0,0]=3 1212 B8R0.7 C=C(Br)CNCCCC MCULE-9529942902 [1,1,0,0,0,0|1,0,0]=3 1213 B8R0.7 C=C(C)CCCCC#N MCULE-5170658288 [1,1,0,0,0,0|1,0,1]=4 1214 B8R0.7 C=C(C)CCCCCC MCULE-2243788093 [1,1,0,0,0,0|0,0,0]=2 1215 B8R0.7 C=C(C)CCCCCCl MCULE-5646492015 [1,1,0,0,0,0|1,0,0]=3 1216 B8R0.7 C=C(C)CSCCCC MCULE-7053589995 [1,1,0,0,0,0|1,0,0]=3 1217 B8R0.7 C=C(Cl)CCCCC#N MCULE-9800519169 [1,1,0,0,0,0|1,0,1]=4 1218 B8R0.7 C=C(Cl)CCCCCC MCULE-4545659103 [1,1,0,0,0,0|0,0,0]=2 1219 B8R0.7 C=C(Cl)CCCCCCl MCULE-3447520654 [1,1,0,0,0,0|1,0,0]=3 1220 B8R0.7 C=CCCCCB(O)O MCULE-5017277637 [1,1,0,0,0,0|2,0,0]=4 1221 B8R0.7 C=CCCCCC(=O)C MCULE-4268619428 [1,1,0,0,0,0|0,0,1]=3 1222 B8R0.7 C=CCCCCC(=O)O MCULE-1991116122 [1,1,0,0,0,0|1,0,1]=4 1223 B8R0.7 C=CCCCCC(C)N MCULE-2841967762 [1,1,0,0,0,0|0,0,0]=2 1224 B8R0.7 C=CCCCCN(=O)=O MCULE-9629476544 [1,1,0,0,0,0|2,0,0]=4 1225 B8R0.7 C=CCCCOC(=O)C MCULE-2972695808 [1,1,0,0,0,0|1,0,1]=4 1226 B8R0.7 C=CCCNCC(C)C MCULE-5787359946 [1,1,0,0,0,0|1,0,0]=3 1227 B8R0.7 CC(=O)CCCCCBr MCULE-8946921118 [1,1,0,0,0,0|1,0,1]=4 1228 B8R0.7 CC(=O)CCCCCN MCULE-3568024595 [1,1,0,0,0,0|1,0,1]=4 1229 B8R0.7 CC(=O)CCCCCN MCULE-9938894581 [1,1,0,0,0,0|1,0,1]=4 1230 B8R0.7 CC(C)CCCCC=O MCULE-9268976664 [1,1,0,0,0,0|1,0,0]=3 1231 B8R0.7 CC(C)CCCCCBr MCULE-6339659463 [1,1,0,0,0,0|1,0,1]=4 1232 B8R0.7 CC(C)CCCCCN MCULE-4764798524 [1,1,0,0,0,0|1,0,1]=4 1233 B8R0.7 CC(C)CCCCCO MCULE-2133434329 [1,1,0,0,0,0|1,0,1]=4 1234 B8R0.7 CCCCCCB(O)O MCULE-6503959495 [1,1,0,0,0,0|2,0,0]=4 1235 B8R0.7 CCCCCCC(=O)C MCULE-1152821440 [1,1,0,0,0,0|0,0,1]=3 1236 B8R0.7 CCCCCCC(=O)Cl MCULE-8559884798 [1,1,0,0,0,0|1,0,0]=3 1237 B8R0.7 CCCCCCC(=O)N MCULE-1210996881 [1,1,0,0,0,0|1,0,0]=3 1238 B8R0.7 CCCCCCC(=O)O MCULE-1489137568 [1,1,0,0,0,0|1,0,0]=3 1239 B8R0.7 CCCCCCC(=O)[O-] MCULE-1711655800 [1,1,0,0,0,0|1,0,0]=3 1240 B8R0.7 CCCCCCC(Br)Br MCULE-5790254532 [1,1,0,0,0,0|1,0,1]=4 1241 B8R0.7 CCCCCCC(C)Br MCULE-1528804584 [1,1,0,0,0,0|0,0,2]=4 1242 B8R0.7 CCCCCCC(C)C MCULE-5799144994 [1,1,0,0,0,0|0,0,2]=4 1243 B8R0.7 CCCCCCC(C)I MCULE-1825555561 [1,1,0,0,0,0|0,0,2]=4 1244 B8R0.7 CCCCCCC(C)N MCULE-9884342317 [1,1,0,0,0,0|0,0,2]=4 1245 B8R0.7 CCCCCCC(C)O MCULE-4635370769 [1,1,0,0,0,0|0,0,2]=4 1246 B8R0.7 CCCCCCC(C)O MCULE-5095200181 [1,1,0,0,0,0|0,0,2]=4 1247 B8R0.7 CCCCCCN(=O)=O MCULE-8283658415 [1,1,0,0,0,0|2,0,0]=4 1248 B8R0.7 CCCCCCN(C)C MCULE-4445968611 [1,1,0,0,0,0|1,0,1]=4 1249 B8R0.7 CCCCCCP(Cl)Cl MCULE-4074248554 [1,1,0,0,0,0|2,0,0]=4 1250 B8R0.7 CCCCCC[C@@H](C)N MCULE-1174114183 [1,1,0,0,0,0|0,0,2]=4 1251 B8R0.7 CCCCCC[C@@H](C)N MCULE-2566479481 [1,1,0,0,0,0|0,0,2]=4 1252 B8R0.7 CCCCCC[C@@H](C)N MCULE-9213725375 [1,1,0,0,0,0|0,0,2]=4 1253 B8R0.7 CCCCCC[C@@H](C)O MCULE-5245235461 [1,1,0,0,0,0|0,0,2]=4 1254 B8R0.7 CCCCCC[C@@H](C)O MCULE-8537503782 [1,1,0,0,0,0|0,0,2]=4 1255 B8R0.7 CCCCCC[C@H](C)N MCULE-1870649953 [1,1,0,0,0,0|0,0,2]=4 1256 B8R0.7 CCCCCC[C@H](C)N MCULE-1893221172 [1,1,0,0,0,0|0,0,2]=4 1257 B8R0.7 CCCCCC[C@H](C)N MCULE-7722036180 [1,1,0,0,0,0|0,0,2]=4 1258 B8R0.7 CCCCCC[C@H](C)O MCULE-2655815413 [1,1,0,0,0,0|0,0,2]=4 1259 B8R0.7 CCCCCC[C@H](C)O MCULE-7784149103 [1,1,0,0,0,0|0,0,2]=4 1260 B8R0.7 CCCCCNC(=O)N MCULE-3139270247 [1,1,0,0,0,0|2,0,0]=4 1261 B8R0.7 CCCCCOC(=O)C MCULE-4911325533 [1,1,0,0,0,0|1,0,1]=4 1262 B8R0.7 CCCCCOC(=O)Cl MCULE-2896207255 [1,1,0,0,0,0|2,0,0]=4 1263 B8R0.7 CCCCCOC(=S)[S-] MCULE-2950713727 [1,1,0,0,0,0|2,0,0]=4 1264 B8R0.7 CCCCCOC(=S)[S-] MCULE-3707330245 [1,1,0,0,0,0|2,0,0]=4 1265 B8R0.7 CCCCCSC(=N)N MCULE-5906999949 [1,1,0,0,0,0|2,0,0]=4 1266 B8R0.7 CCCCCSC(=N)N MCULE-7508276539 [1,1,0,0,0,0|2,0,0]=4 1267 B8R0.7 CCCCNCC(=O)N MCULE-1276341431 [1,1,0,0,0,0|2,0,0]=4 1268 B8R0.7 CCCCNCC(=O)N MCULE-6579402071 [1,1,0,0,0,0|2,0,0]=4 1269 B8R0.7 CCCCNCC(=O)O MCULE-4725221957 [1,1,0,0,0,0|2,0,0]=4 1270 B8R0.7 CCCCOCC(=O)O MCULE-9634255761 [1,1,0,0,0,0|2,0,0]=4 1271 B8R0.7 CCCCSCC(=N)N MCULE-5468671942 [1,1,0,0,0,0|2,0,0]=4 1272 B8R0.7 CCCCSCC(=O)O MCULE-3580384865 [1,1,0,0,0,0|2,0,0]=4 1273 B8R0.7 CCCNCCC(=O)N MCULE-2654608736 [1,1,0,0,0,0|2,0,0]=4 1274 B8R0.7 CCCNCCC(=O)N MCULE-2683588523 [1,1,0,0,0,0|2,0,0]=4 1275 B8R0.7 CCCNCCC(=O)O MCULE-3144740259 [1,1,0,0,0,0|2,0,0]=4 1276 B8R0.7 CCCNCCC(=O)O MCULE-3866165037 [1,1,0,0,0,0|2,0,0]=4 1277 B8R0.7 CCCOCCC(=O)O MCULE-1927238608 [1,1,0,0,0,0|2,0,0]=4 1278 B8R0.7 CCCSCCC(=O)O MCULE-6454518290 [1,1,0,0,0,0|2,0,0]=4 1279 B8R0.7 CCNCCCC(=O)O MCULE-7019386199 [1,1,0,0,0,0|2,0,0]=4 1280 B8R0.7 CCNCCCC(=O)O MCULE-8568253592 [1,1,0,0,0,0|2,0,0]=4 1281 B8R0.7 CCOCCCC(=O)O MCULE-9064011886 [1,1,0,0,0,0|2,0,0]=4 1282 B8R0.7 CNCCCCC(=O)O MCULE-4298567521 [1,1,0,0,0,0|2,0,0]=4 1283 B8R0.7 CNCCCCC(=O)O MCULE-5688320983 [1,1,0,0,0,0|2,0,0]=4 1284 B8R0.7 COCCCCC(=O)O MCULE-1268596288 [1,1,0,0,0,0|2,0,0]=4 1285 B8R0.7 CSCCCCC(=O)O MCULE-4498129620 [1,1,0,0,0,0|2,0,0]=4 1286 B8R0.7 NC(=O)CCCCCBr MCULE-6938202710 [1,1,0,0,0,0|2,0,0]=4 1287 B8R0.7 NC(=O)CCCCCO MCULE-2654184294 [1,1,0,0,0,0|2,0,0]=4 1288 B8R0.7 NCCCCCC(=O)N MCULE-1692086577 [1,1,0,0,0,0|2,0,0]=4 1289 B8R0.7 NCCCCCC(=O)N MCULE-2191237198 [1,1,0,0,0,0|2,0,0]=4 1290 B8R0.7 NCCCCCC(=O)O MCULE-3640363033 [1,1,0,0,0,0|2,0,0]=4 1291 B8R0.7 NCCCCCC(=O)O MCULE-6389520144 [1,1,0,0,0,0|2,0,0]=4 1292 B8R0.7 NCCCCCC(=O)[O-] MCULE-7336458907 [1,1,0,0,0,0|2,0,0]=4 1293 B8R0.7 O=C(Cl)CCCCCBr MCULE-4314610726 [1,1,0,0,0,0|2,0,0]=4 1294 B8R0.7 O=C(Cl)CCCCCCl MCULE-4526081631 [1,1,0,0,0,0|2,0,0]=4 1295 B8R0.7 O=C(O)CCCCCBr MCULE-2086088700 [1,1,0,0,0,0|2,0,0]=4 1296 B8R0.7 O=C(O)CCCCCCl MCULE-3419329115 [1,1,0,0,0,0|2,0,0]=4 1297 B8R0.7 O=C(O)CCCCCF MCULE-6736431365 [1,1,0,0,0,0|2,0,0]=4 1298 B8R0.7 O=C(O)CCCCCO MCULE-9202536119 [1,1,0,0,0,0|2,0,0]=4 1299 B8R0.7 O=C(O)CCCCCS MCULE-1414350107 [1,1,0,0,0,0|2,0,0]=4 1300 B8R0.7 O=C([O-])CCCCCCl MCULE-7341419838 [1,1,0,0,0,0|2,0,0]=4 1301 B8R0.7 O=C([O-])CCCCCO MCULE-5897469112 [1,1,0,0,0,0|2,0,0]=4 1302 B8R0.7 O=C([O-])CCCCCO MCULE-9397608140 [1,1,0,0,0,0|2,0,0]=4 1303 B8R0.3 C#CC(O)C(C)CCC MCULE-8667738033 [1,1,0,0,0,0|0,0,2]=4 1304 B8R0.3 C=CC(O)C(=O)OCC MCULE-6322032023 [1,1,0,0,0,0|1,0,1]=4 1305 B8R0.3 CCCC(C)C(O)CC MCULE-5128705007 [1,1,0,0,0,0|0,0,2]=4 1306 B8R0.8 C(N)(CCCC)C(=O)N MCULE-1406613793 [1,1,0,0,0,0|2,0,0]=4 1307 B8R0.8 C(N)(CCCC)C(=O)N MCULE-4692008742 [1,1,0,0,0,0|2,0,0]=4 1308 B8R0.8 CCCCC(Br)C(=O)N MCULE-9831415558 [1,1,0,0,0,0|2,0,0]=4 1309 B8R0.8 CCCCC(Br)C(=O)O MCULE-5428502537 [1,1,0,0,0,0|2,0,0]=4 1310 B8R0.8 CCCCC(C)C(=O)C MCULE-2303839464 [1,1,0,0,0,0|1,0,1]=4 1311 B8R0.8 CCCCC(C)C(=O)Cl MCULE-1718383314 [1,1,0,0,0,0|2,0,0]=4 1312 B8R0.8 CCCCC(C)C(=O)N MCULE-6062124512 [1,1,0,0,0,0|2,0,0]=4 1313 B8R0.8 CCCCC(C)C(=O)O MCULE-7933263354 [1,1,0,0,0,0|2,0,0]=4 1314 B8R0.8 CCCCC(F)C(=O)O MCULE-2276381656 [1,1,0,0,0,0|2,0,0]=4 1315 B8R0.8 CCCCC(N)C(=O)C MCULE-2471947344 [1,1,0,0,0,0|1,0,1]=4 1316 B8R0.8 CCCCC(N)C(=O)C MCULE-4947552776 [1,1,0,0,0,0|1,0,1]=4 1317 B8R0.8 CCCCC(N)C(=O)O MCULE-4930484202 [1,1,0,0,0,0|2,0,0]=4 1318 B8R0.8 CCCCC(O)C(=O)N MCULE-1063256537 [1,1,0,0,0,0|1,0,0]=3 1319 B8R0.8 CCCCC(O)C(=O)O MCULE-2557585903 [1,1,0,0,0,0|1,0,0]=3 1320 B8R0.8 CCCCC(O)C(C)C MCULE-3997068945 [1,1,0,0,0,0|0,0,2]=4 1321 B8R0.8 CCCC[C@@H](C)C(=O)O MCULE-3454696473 [1,1,0,0,0,0|2,0,0]=4 1322 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-3687527484 [1,1,0,0,0,0|2,0,0]=4 1323 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-9410581572 [1,1,0,0,0,0|2,0,0]=4 1324 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9016844851 [1,1,0,0,0,0|2,0,0]=4 1325 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9437190196 [1,1,0,0,0,0|2,0,0]=4 1326 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-1555661156 [1,1,0,0,0,0|2,0,0]=4 1327 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9202467107 [1,1,0,0,0,0|2,0,0]=4 1328 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9573872199 [1,1,0,0,0,0|2,0,0]=4 1329 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9773159994 [1,1,0,0,0,0|2,0,0]=4 1330 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-3656145338 [1,1,0,0,0,0|2,0,0]=4 1331 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-7427914532 [1,1,0,0,0,0|2,0,0]=4 1332 B8R0.8 CSCCC(O)C(=O)N MCULE-9019971815 [1,1,0,0,0,0|2,0,0]=4 1333 B8R0.8 CSCCC(O)C(=O)O MCULE-3684026487 [1,1,0,0,0,0|2,0,0]=4 1334 B8R0.8 O=C(O)C(O)CCCO MCULE-9386031706 [1,1,0,0,0,0|2,0,0]=4 1335 B8R0.8 O=C([O-])C(O)CCCO MCULE-5137868319 [1,1,0,0,0,0|2,0,0]=4 1336 B8R0.9 CCC(O)CCC(C)C MCULE-6499043854 [1,1,0,0,0,0|0,0,2]=4 1337 B8R0.11 CCCCC(C=O)CC MCULE-1141216024 [1,1,0,0,0,0|2,0,0]=4 1338 B8R0.11 CCCCC(CC)CO MCULE-1768780358 [1,1,0,0,0,0|0,0,2]=4 1339 B8R0.11 CCCCC(CO)CO MCULE-4148067977 [1,1,0,0,0,0|1,0,1]=4 1340 B8R0.11 CCCCC(CO)NC MCULE-5217517371 [1,1,0,0,0,0|1,0,1]=4 1341 B8R0.19 CCC(C)CC(O)CC MCULE-9706306627 [1,1,0,0,0,0|0,0,2]=4 1342 B8R0.19 CC[C@@H](O)C[C@H](O)CC MCULE-8992338479 [1,1,0,0,0,0|0,0,2]=4 1343 B8R0.19 CC[C@H](O)C[C@@H](O)CC MCULE-4286526192 [1,1,0,0,0,0|0,0,2]=4 1344 B8R0.25 C#CC(C)(O)CCCC MCULE-9896867315 [1,1,0,0,0,0|0,0,2]=4 1345 B8R0.25 C=CC(C)(C)CCCN MCULE-2170214201 [1,1,0,0,0,0|2,0,0]=4 1346 B8R0.25 C=CS(=O)(=O)CCCC MCULE-6337553602 [1,1,0,0,0,0|1,0,1]=4 1347 B8R0.25 CCCCC(C)(C)C=O MCULE-2890084431 [1,1,0,0,0,0|2,0,0]=4 1348 B8R0.25 CCCCC(C)(O)CC MCULE-4324011914 [1,1,0,0,0,0|0,0,2]=4 1349 B8R0.5 C=C(C)CC(C)CCC MCULE-7442491404 [1,1,0,0,0,0|1,0,1]=4 1350 B8R0.5 CC(O)CC(O)CCO MCULE-4888514297 [1,1,0,0,0,0|1,0,1]=4 1351 B8R0.5 CCCC(C)CC(=O)O MCULE-6002154473 [1,1,0,0,0,0|1,0,1]=4 1352 B8R0.5 CCCC(C)CC(C)C MCULE-4080546731 [1,1,0,0,0,0|1,0,1]=4 1353 B8R0.5 CCCC(C)CC(C)O MCULE-3968478752 [1,1,0,0,0,0|0,0,1]=3 1354 B8R0.5 CCCC(N)CC(=O)O MCULE-1356349547 [1,1,0,0,0,0|1,0,1]=4 1355 B8R0.5 CCCC(N)CC(=O)O MCULE-4946770886 [1,1,0,0,0,0|1,0,1]=4 1356 B8R0.5 CCCC(N)CC(=O)O MCULE-5502250330 [1,1,0,0,0,0|1,0,1]=4 1357 B8R0.5 CCCC(N)CC(=O)O MCULE-9959180111 [1,1,0,0,0,0|1,0,1]=4 1358 B8R0.5 CCCC(O)CC(=O)O MCULE-3158579605 [1,1,0,0,0,0|1,0,1]=4 1359 B8R0.5 CCC[C@@H](N)CC(=O)O MCULE-9961668094 [1,1,0,0,0,0|1,0,1]=4 1360 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-1726586898 [1,1,0,0,0,0|1,0,1]=4 1361 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5359238908 [1,1,0,0,0,0|1,0,1]=4 1362 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5593873511 [1,1,0,0,0,0|1,0,1]=4 1363 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-7588873691 [1,1,0,0,0,0|1,0,1]=4 1364 B8R0.21 CC(C)(O)CCCCO MCULE-2749019232 [1,1,0,0,0,0|1,0,1]=4 1365 B8R0.21 CCCCCC(C)(C)C MCULE-4223197735 [1,1,0,0,0,0|1,0,1]=4 1366 B8R0.21 CCCCCC(C)(C)O MCULE-8173858480 [1,1,0,0,0,0|0,0,1]=3 1367 B8R0.21 CCCCCC(F)(F)F MCULE-5622455379 [1,1,0,0,0,0|2,0,0]=4 1368 B8R0.21 CCCCCS(=O)(=O)O MCULE-3941343492 [1,1,0,0,0,0|2,0,0]=4 1369 B8R0.21 CCCNCC(C)(C)O MCULE-1675746605 [1,1,0,0,0,0|1,0,1]=4 1370 B8R0.28 C=C(C)CCCC(C)C MCULE-5830488183 [1,1,0,0,0,0|1,0,1]=4 1371 B8R0.28 CC(C)CCCC(=O)O MCULE-3645348479 [1,1,0,0,0,0|1,0,1]=4 1372 B8R0.28 CC(C)CCCC(C)N MCULE-6797729647 [1,1,0,0,0,0|1,0,1]=4 1373 B8R0.28 CC(C)CCCC(C)O MCULE-6655675430 [1,1,0,0,0,0|0,0,1]=3 1374 B8R0.28 CC(C)CCCC(C)[NH3+] MCULE-1949973327 [1,1,0,0,0,0|1,0,1]=4 1375 B8R0.28 CC(C)CNCC(C)O MCULE-5110606510 [1,1,0,0,0,0|1,0,1]=4 1376 B8R0.28 CC(C)COCC(C)O MCULE-2243697829 [1,1,0,0,0,0|1,0,1]=4 1377 B8R0.28 CC(O)CCCC(=O)O MCULE-6696855762 [1,1,0,0,0,0|1,0,1]=4 1378 B8R0.28 CC(O)CNCC(C)O MCULE-2715190259 [1,1,0,0,0,0|1,0,1]=4 1379 B8R0.28 CC(O)COCC(C)O MCULE-9464290948 [1,1,0,0,0,0|1,0,1]=4 1380 B10R0.3 CC(C)CCCC(C)CC=O MCULE-2720089798 [0,2,0,0,0,0|1,0,1]=4 1381 B10R0.44 C=CC(=C)CC(O)CC(C)C MCULE-9715710452 [0,2,0,0,0,0|1,0,1]=4 1382 B10R0.44 C=CC(C)CC(=O)CC(C)C MCULE-9529946782 [0,2,0,0,0,0|1,0,1]=4 1383 B10R0.60 C=CC(C)CCCC(C)(C)O MCULE-6074859352 [0,2,0,0,0,0|1,0,0]=3 1384 B10R0.65 C=CC(C)(O)CCC=C(C)C MCULE-2407576698 [0,2,0,0,0,0|0,0,2]=4 1385 B10R0.65 C=CC(C)(O)CCCC(C)C MCULE-6361351355 [0,2,0,0,0,0|0,0,0]=2 1386 B10R0.65 C=C[C@@](C)(O)CCC=C(C)C MCULE-4104124685 [0,2,0,0,0,0|0,0,2]=4 1387 B10R0.65 C=C[C@](C)(O)CCC=C(C)C MCULE-2892441793 [0,2,0,0,0,0|0,0,2]=4 1388 B10R0.65 C=C[C@](C)(O)CCC=C(C)C MCULE-4783414409 [0,2,0,0,0,0|0,0,2]=4 1389 B10R0.65 CCC(C)(O)CCCC(C)C MCULE-6045213582 [0,2,0,0,0,0|0,0,2]=4 1390 B10R0.98 CC(C)CCCC(C)C(=O)O MCULE-3667108752 [0,2,0,0,0,0|2,0,0]=4 1391 B10R0.98 CC(C)CCCC(N)C(=O)O MCULE-5699505174 [0,2,0,0,0,0|2,0,0]=4 1392 B10R0.98 CC(C)CCCC(N)C(=O)O MCULE-8151358815 [0,2,0,0,0,0|2,0,0]=4 1393 B10R0.98 CC(C)CCC[C@H](N)C(=O)O MCULE-3341158972 [0,2,0,0,0,0|2,0,0]=4 1394 B10R0.98 CC(C)CCC[C@H](N)C(=O)O MCULE-6452147303 [0,2,0,0,0,0|2,0,0]=4 1395 B10R0.98 CC(N)CCCC(C)C(=O)O MCULE-5130020295 [0,2,0,0,0,0|2,0,0]=4 1396 B10R0.98 CC(N)CCCC(C)C(=O)O MCULE-6070288614 [0,2,0,0,0,0|2,0,0]=4 1397 B10R0.1 C=CCC(C)CCCCCC MCULE-9669056285 [0,2,0,0,0,0|1,0,0]=3 1398 B10R0.1 CCCCCCC(O)CCC MCULE-2307566607 [0,2,0,0,0,0|0,0,2]=4 1399 B10R0.1 CCCCCCC(O)CCO MCULE-4512993407 [0,2,0,0,0,0|0,0,2]=4 1400 B10R0.1 CCCCCC[C@H](O)CCC MCULE-3592520258 [0,2,0,0,0,0|0,0,2]=4 1401 B10R0.1 CCCCCC[C@H](O)CCC MCULE-8969624714 [0,2,0,0,0,0|0,0,2]=4 1402 B10R0.6 C=C(C)CC(C)CCCCC MCULE-9311251673 [0,2,0,0,0,0|1,0,0]=3 1403 B10R0.6 CCCCCC(C)CC(=O)C MCULE-9366517192 [0,2,0,0,0,0|1,0,1]=4 1404 B10R0.6 CCCCCC(C)CC(=O)O MCULE-2066533125 [0,2,0,0,0,0|1,0,1]=4 1405 B10R0.6 CCCCCC(C)OC(=O)Cl MCULE-6347220296 [0,2,0,0,0,0|2,0,0]=4 1406 B10R0.6 CCCCCC(N)CC(=O)O MCULE-1332766356 [0,2,0,0,0,0|1,0,1]=4 1407 B10R0.6 CCCCCC(N)CC(=O)O MCULE-6217126659 [0,2,0,0,0,0|1,0,1]=4 1408 B10R0.6 CCCCCC(O)CC(=O)O MCULE-4825961688 [0,2,0,0,0,0|0,0,1]=3 1409 B10R0.6 CCCCC[C@@H](O)CC(=O)O MCULE-2570880673 [0,2,0,0,0,0|0,0,1]=3 1410 B10R0.6 CCCCC[C@H](O)CC(=O)O MCULE-3222730819 [0,2,0,0,0,0|0,0,1]=3 1411 B10R0.6 CCCCC[C@H](O)CC(=O)O MCULE-6407518730 [0,2,0,0,0,0|0,0,1]=3 1412 B10R0.24 C=CCC(CC)CCCCC MCULE-3685970860 [0,2,0,0,0,0|1,0,0]=3 1413 B10R0.24 CCCCCC(CC)CCO MCULE-1248981110 [0,2,0,0,0,0|0,0,2]=4 1414 B10R0.24 CCCCCC(CO)CCC MCULE-6284162552 [0,2,0,0,0,0|0,0,2]=4 1415 B10R0.83 CCCCCC(N)C(=O)NC MCULE-6020353560 [0,2,0,0,0,0|1,0,1]=4 1416 B10R0.83 CCCCCC(N)C(=O)OC MCULE-2018052401 [0,2,0,0,0,0|1,0,1]=4 1417 B10R0.83 CCCCCC(N)C(=O)OC MCULE-5487541008 [0,2,0,0,0,0|1,0,1]=4 1418 B10R0.83 CCCCCC(O)C(=O)OC MCULE-9996510127 [0,2,0,0,0,0|0,0,1]=3 1419 B10R0.83 CCCCCC(O)C(O)CO MCULE-9228799760 [0,2,0,0,0,0|0,0,2]=4 1420 B10R0.83 CCCCC[C@H](N)C(=O)NC MCULE-9979996978 [0,2,0,0,0,0|1,0,1]=4 1421 B10R0.91 C#CCCC(O)CCCCC MCULE-4675172890 [0,2,0,0,0,0|0,0,2]=4 1422 B10R0.91 C#CCCCC(O)C=CC=O MCULE-4498847426 [0,2,0,0,0,0|0,0,2]=4 1423 B10R0.91 C=CCCC(C)CCCCC MCULE-1706757342 [0,2,0,0,0,0|1,0,0]=3 1424 B10R0.91 C=CCOC(=O)CCCCC MCULE-4870253803 [0,2,0,0,0,0|0,0,2]=4 1425 B10R0.91 CCCCCC(=O)C=CC=O MCULE-7288937112 [0,2,0,0,0,0|0,0,2]=4 1426 B10R0.91 CCCCCC(C)CCC=O MCULE-9659356194 [0,2,0,0,0,0|1,0,1]=4 1427 B10R0.91 CCCCCC(O)/C=C/C=O MCULE-7787544395 [0,2,0,0,0,0|0,0,0]=2 1428 B10R0.91 CCCCCC(O)C=CC=O MCULE-4013578316 [0,2,0,0,0,0|0,0,0]=2 1429 B10R0.91 CCCCCC(O)CCCC MCULE-4028571026 [0,2,0,0,0,0|0,0,2]=4 1430 B10R0.91 CCCCC[C@H](O)CCCC MCULE-3767339379 [0,2,0,0,0,0|0,0,2]=4 1431 B10R0.91 CCCCC[C@H](O)CCCC MCULE-8364286143 [0,2,0,0,0,0|0,0,2]=4 1432 B10R0.156 CCCCCC(C)(O)CCC MCULE-5266896365 [0,2,0,0,0,0|0,0,2]=4 1433 B10R0.46 O=CC(O)C(O)CC(O)CO MCULE-2344766964 [0,2,0,0,0,0|2,0,0]=4 1434 B10R0.46 O=C[C@H](O)C[C@H](O)[C@H](O)CO MCULE-9547679189 [0,2,0,0,0,0|2,0,0]=4 1435 B10R0.81 CCCCC(N)C(O)C(=O)O MCULE-9772584692 [0,2,0,0,0,0|1,0,0]=3 1436 B10R0.81 CCCC[C@@H](N)[C@H](O)C(=O)O MCULE-8826953669 [0,2,0,0,0,0|1,0,0]=3 1437 B10R0.81 CCCC[C@H](N)[C@H](O)C(=O)O MCULE-6737057860 [0,2,0,0,0,0|1,0,0]=3 1438 B10R0.85 C#CC(O)C(CC)CCCC MCULE-2208627746 [0,2,0,0,0,0|0,0,2]=4 1439 B10R0.85 CCCCC(CC)C(O)CC MCULE-1882089644 [0,2,0,0,0,0|0,0,2]=4 1440 B10R0.124 CCCCC(F)(F)[C@H](O)CO MCULE-3847333391 [0,2,0,0,0,0|1,0,1]=4 1441 B10R0.42 CCCCCC(C)(C)C(=O)O MCULE-7728669545 [0,2,0,0,0,0|2,0,0]=4 1442 B10R0.42 CCCCCC(C)(O)C(C)C MCULE-7902834676 [0,2,0,0,0,0|0,0,2]=4 1443 B10R0.62 C#CC(C)(O)CCCCCC MCULE-4550111004 [0,2,0,0,0,0|0,0,2]=4 1444 B10R0.62 CCCCCCC(C)(O)CC MCULE-8222249515 [0,2,0,0,0,0|0,0,2]=4 1445 B10R0.62 CCCCCCC(Cl)(Cl)C=O MCULE-1983463862 [0,2,0,0,0,0|2,0,0]=4 1446 B10R0.45 CCC(O)CCC(CC)CC MCULE-8720844146 [0,2,0,0,0,0|0,0,2]=4 1447 B10R0.18 CCCCS(=O)CC(O)CCl MCULE-9236858784 [0,2,0,0,0,0|1,0,1]=4 1448 B10R0.26 CCCC(C)CC(N)C(=O)O MCULE-8848436054 [0,2,0,0,0,0|2,0,0]=4 1449 B10R0.41 CCCCCCC(CC)CO MCULE-4162010879 [0,2,0,0,0,0|0,0,2]=4 1450 B10R0.41 CCCCCCC(CO)CO MCULE-5492904032 [0,2,0,0,0,0|1,0,1]=4 1451 B10R0.41 CCCCCCC(OC)OC MCULE-3152834505 [0,2,0,0,0,0|1,0,1]=4 1452 B10R0.74 C=CC(=O)NCOCCCC MCULE-2564380457 [0,2,0,0,0,0|0,0,2]=4 1453 B10R0.74 C=CC(=O)OCCCCCC MCULE-5221212930 [0,2,0,0,0,0|0,0,2]=4 1454 B10R0.74 C=CC(=O)OCCCCCO MCULE-8331922167 [0,2,0,0,0,0|0,0,2]=4 1455 B10R0.74 C=CC(O)CCCCCCC MCULE-2034118054 [0,2,0,0,0,0|0,0,0]=2 1456 B10R0.74 CCCCCCCC(C)C=O MCULE-6740449093 [0,2,0,0,0,0|2,0,0]=4 1457 B10R0.74 CCCCCCCC(O)CC MCULE-5420300699 [0,2,0,0,0,0|0,0,2]=4 1458 B10R0.74 CCCCCCCC(O)CO MCULE-4511310759 [0,2,0,0,0,0|1,0,1]=4 1459 B10R0.74 CCOCCOCC(O)CCl MCULE-8707944006 [0,2,0,0,0,0|1,0,1]=4 1460 B10R0.74 CCOCCOCC(O)CN MCULE-2298197856 [0,2,0,0,0,0|1,0,1]=4 1461 B10R0.74 OCCCCCCC(O)CO MCULE-1673794211 [0,2,0,0,0,0|1,0,1]=4 1462 B10R0.75 C=C(C)C(=O)OCCCCC MCULE-5104917865 [0,2,0,0,0,0|0,0,2]=4 1463 B10R0.75 CCCCCCC(Br)C(=O)Br MCULE-8391154868 [0,2,0,0,0,0|2,0,0]=4 1464 B10R0.75 CCCCCCC(Br)C(=O)O MCULE-3532642872 [0,2,0,0,0,0|2,0,0]=4 1465 B10R0.75 CCCCCCC(C)C(=O)C MCULE-2296587993 [0,2,0,0,0,0|1,0,1]=4 1466 B10R0.75 CCCCCCC(C)C(=O)Cl MCULE-4801747974 [0,2,0,0,0,0|2,0,0]=4 1467 B10R0.75 CCCCCCC(C)C(=O)O MCULE-6664640382 [0,2,0,0,0,0|2,0,0]=4 1468 B10R0.75 CCCCCCC(F)C(=O)O MCULE-3865739259 [0,2,0,0,0,0|2,0,0]=4 1469 B10R0.75 CCCCCCC(N)C(=O)O MCULE-2527731470 [0,2,0,0,0,0|2,0,0]=4 1470 B10R0.75 CCCCCCC(N)C(=O)O MCULE-5498377990 [0,2,0,0,0,0|2,0,0]=4 1471 B10R0.75 CCCCCCC(O)C(=O)O MCULE-1679305682 [0,2,0,0,0,0|1,0,0]=3 1472 B10R0.75 CCCCCC[C@@H](N)C(=O)O MCULE-9163680563 [0,2,0,0,0,0|2,0,0]=4 1473 B10R0.75 CCCCCC[C@@H](N)C(=O)O MCULE-9959237270 [0,2,0,0,0,0|2,0,0]=4 1474 B10R0.75 CCCCCC[C@H](N)C(=O)O MCULE-6660531044 [0,2,0,0,0,0|2,0,0]=4 1475 B10R0.75 CCCCCC[C@H](N)C(=O)O MCULE-7151037911 [0,2,0,0,0,0|2,0,0]=4 1476 B10R0.75 CCCCSC[C@@H](N)C(=O)O MCULE-8737283640 [0,2,0,0,0,0|2,0,0]=4 1477 B10R0.75 CCCCSC[C@H](N)C(=O)O MCULE-5383064231 [0,2,0,0,0,0|2,0,0]=4 1478 B10R0.75 CNCCCCC(N)C(=O)O MCULE-5703952072 [0,2,0,0,0,0|2,0,0]=4 1479 B10R0.75 CNCCCCC(N)C(=O)O MCULE-8267439974 [0,2,0,0,0,0|2,0,0]=4 1480 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-4130643324 [0,2,0,0,0,0|2,0,0]=4 1481 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-5394599260 [0,2,0,0,0,0|2,0,0]=4 1482 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-6328038825 [0,2,0,0,0,0|2,0,0]=4 1483 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-6736060504 [0,2,0,0,0,0|2,0,0]=4 1484 B10R0.75 NCCCCC[C@@H](N)C(=O)O MCULE-7846811170 [0,2,0,0,0,0|2,0,0]=4 1485 B10R0.75 NCCCCC[C@@H](N)C(=O)O MCULE-8562914837 [0,2,0,0,0,0|2,0,0]=4 1486 B10R0.75 NCCCCC[C@H](N)C(=O)O MCULE-4522889843 [0,2,0,0,0,0|2,0,0]=4 1487 B10R0.75 NCCCCC[C@H](N)C(=O)O MCULE-9026496023 [0,2,0,0,0,0|2,0,0]=4 1488 B10R0.5 CCCCCC(O)C(C)(C)C MCULE-3127545342 [0,2,0,0,0,0|0,0,2]=4 1489 B10R0.5 CCCCC[C@H](O)C(F)(F)F MCULE-4400426157 [0,2,0,0,0,0|1,0,1]=4 1490 B10R0.86 CCCCCC(CC)C(=O)C MCULE-1913128605 [0,2,0,0,0,0|1,0,1]=4 1491 B10R0.86 CCCCCC(CC)C(=O)O MCULE-3515775261 [0,2,0,0,0,0|0,0,2]=4 1492 B8R1.2 BrC=C1CCCCC1 MCULE-1203677785 [1,0,0,1,0,0|1,0,1]=4 1493 B8R1.2 BrCC1C=CCCC1 MCULE-3497010416 [1,0,0,1,0,0|1,0,0]=3 1494 B8R1.2 BrCC1CCCCC1 MCULE-1732610761 [1,0,0,1,0,0|1,0,1]=4 1495 B8R1.2 C#CC1CCCCC1 MCULE-1010712187 [1,0,0,1,0,0|0,0,2]=4 1496 B8R1.2 C1(CCCCO1)CC MCULE-5189391029 [1,0,0,1,0,0|1,0,1]=4 1497 B8R1.2 C=CC1CC=CCC1 MCULE-1027409234 [1,0,0,1,0,0|0,0,2]=4 1498 B8R1.2 C=CC1CCCCC1 MCULE-5657998956 [1,0,0,1,0,0|0,0,0]=2 1499 B8R1.2 C=CC1CCCCN1 MCULE-1327502475 [1,0,0,1,0,0|1,0,0]=3 1500 B8R1.2 C=CC1CCCCN1 MCULE-7059257921 [1,0,0,1,0,0|1,0,0]=3 1501 B8R1.2 C=CC1CCCNC1 MCULE-4200920592 [1,0,0,1,0,0|1,0,0]=3 1502 B8R1.2 C=CC1CCCNC1 MCULE-5849078027 [1,0,0,1,0,0|1,0,0]=3 1503 B8R1.2 C=CC1CCNCC1 MCULE-1082479185 [1,0,0,1,0,0|1,0,0]=3 1504 B8R1.2 C=CC1CCNCC1 MCULE-1750757751 [1,0,0,1,0,0|1,0,0]=3 1505 B8R1.2 CC=C1CCCCC1 MCULE-6327883518 [1,0,0,1,0,0|0,0,2]=4 1506 B8R1.2 CCC1=CCCC=C1 MCULE-7185315314 [1,0,0,1,0,0|0,0,2]=4 1507 B8R1.2 CCC1CCCCC1 MCULE-9302115958 [1,0,0,1,0,0|0,0,2]=4 1508 B8R1.2 CCC1CCCCN1 MCULE-1463828922 [1,0,0,1,0,0|1,0,1]=4 1509 B8R1.2 CCC1CCCCN1 MCULE-4345537199 [1,0,0,1,0,0|1,0,1]=4 1510 B8R1.2 CCC1CCCCN1 MCULE-4598810496 [1,0,0,1,0,0|1,0,1]=4 1511 B8R1.2 CCC1CCCCN1 MCULE-6373382965 [1,0,0,1,0,0|1,0,1]=4 1512 B8R1.2 CCC1CCCNC1 MCULE-1867940470 [1,0,0,1,0,0|1,0,1]=4 1513 B8R1.2 CCC1CCCNC1 MCULE-4023638399 [1,0,0,1,0,0|1,0,1]=4 1514 B8R1.2 CC[C@@H]1CCCCN1 MCULE-1012550179 [1,0,0,1,0,0|1,0,1]=4 1515 B8R1.2 CC[C@@H]1CCCCN1 MCULE-6669069574 [1,0,0,1,0,0|1,0,1]=4 1516 B8R1.2 CC[C@@H]1CCCCN1 MCULE-7355467130 [1,0,0,1,0,0|1,0,1]=4 1517 B8R1.2 CC[C@@H]1CCCCN1 MCULE-7542229673 [1,0,0,1,0,0|1,0,1]=4 1518 B8R1.2 CC[C@H]1CCCCN1 MCULE-2554275022 [1,0,0,1,0,0|1,0,1]=4 1519 B8R1.2 CC[C@H]1CCCCN1 MCULE-3433938348 [1,0,0,1,0,0|1,0,1]=4 1520 B8R1.2 CC[C@H]1CCCCN1 MCULE-5134937129 [1,0,0,1,0,0|1,0,1]=4 1521 B8R1.2 CC[C@H]1CCCCN1 MCULE-9567977241 [1,0,0,1,0,0|1,0,1]=4 1522 B8R1.2 CNC1CCCCC1 MCULE-8593678924 [1,0,0,1,0,0|1,0,1]=4 1523 B8R1.2 COC1C=CCCC1 MCULE-4692829014 [1,0,0,1,0,0|1,0,0]=3 1524 B8R1.2 COC1CCCCC1 MCULE-2340244681 [1,0,0,1,0,0|1,0,1]=4 1525 B8R1.2 CSC1CCCCC1 MCULE-5570458252 [1,0,0,1,0,0|1,0,1]=4 1526 B8R1.2 ClCC1CCCCC1 MCULE-2364408988 [1,0,0,1,0,0|1,0,1]=4 1527 B8R1.2 IC=C1CCCCC1 MCULE-9165742833 [1,0,0,1,0,0|1,0,1]=4 1528 B8R1.2 ICC1CCCCC1 MCULE-7820192716 [1,0,0,1,0,0|1,0,1]=4 1529 B8R1.2 N#CC1CCCCC1 MCULE-2156159345 [1,0,0,1,0,0|1,0,1]=4 1530 B8R1.2 NCC1CCCCC1 MCULE-3156148976 [1,0,0,1,0,0|1,0,1]=4 1531 B8R1.2 NCC1CCCCC1 MCULE-7375566253 [1,0,0,1,0,0|1,0,1]=4 1532 B8R1.2 NCC1CCCCC1 MCULE-8029432210 [1,0,0,1,0,0|1,0,1]=4 1533 B8R1.2 NNC1CCCCC1 MCULE-1043288751 [1,0,0,1,0,0|2,0,0]=4 1534 B8R1.2 NNC1CCCCC1 MCULE-2654277681 [1,0,0,1,0,0|2,0,0]=4 1535 B8R1.2 NNC1CCCCC1 MCULE-3543475794 [1,0,0,1,0,0|2,0,0]=4 1536 B8R1.2 NOC1CCCCC1 MCULE-1475995970 [1,0,0,1,0,0|2,0,0]=4 1537 B8R1.2 NOC1CCCCC1 MCULE-3638462708 [1,0,0,1,0,0|2,0,0]=4 1538 B8R1.2 O=CC1C=CCCC1 MCULE-7360804121 [1,0,0,1,0,0|1,0,1]=4 1539 B8R1.2 O=CC1CCCCC1 MCULE-7345097178 [1,0,0,1,0,0|1,0,0]=3 1540 B8R1.2 O=CC1CCCCN1 MCULE-7681438476 [1,0,0,1,0,0|2,0,0]=4 1541 B8R1.2 O=CC1CCCCN1 MCULE-9370686295 [1,0,0,1,0,0|2,0,0]=4 1542 B8R1.2 O=CC1CCCCO1 MCULE-6497412510 [1,0,0,1,0,0|2,0,0]=4 1543 B8R1.2 O=CC1CCCNC1 MCULE-4037480911 [1,0,0,1,0,0|2,0,0]=4 1544 B8R1.2 O=CC1CCCNC1 MCULE-9205787069 [1,0,0,1,0,0|2,0,0]=4 1545 B8R1.2 O=CC1CCCOC1 MCULE-6841728518 [1,0,0,1,0,0|2,0,0]=4 1546 B8R1.2 O=CC1CCCSC1 MCULE-8369808876 [1,0,0,1,0,0|2,0,0]=4 1547 B8R1.2 O=CC1CCNCC1 MCULE-3856245073 [1,0,0,1,0,0|2,0,0]=4 1548 B8R1.2 O=CC1CCNCC1 MCULE-8439609130 [1,0,0,1,0,0|2,0,0]=4 1549 B8R1.2 O=CC1CCOCC1 MCULE-6884786677 [1,0,0,1,0,0|2,0,0]=4 1550 B8R1.2 O=CC1CCSCC1 MCULE-4728594373 [1,0,0,1,0,0|2,0,0]=4 1551 B8R1.2 O=CN1CCCCC1 MCULE-3028605826 [1,0,0,1,0,0|2,0,0]=4 1552 B8R1.2 OCC1C=CCCC1 MCULE-3264381346 [1,0,0,1,0,0|1,0,0]=3 1553 B8R1.2 OCC1C=CCCN1 MCULE-1476642397 [1,0,0,1,0,0|2,0,0]=4 1554 B8R1.2 OCC1CCCCC1 MCULE-6571547092 [1,0,0,1,0,0|1,0,1]=4 1555 B8R1.2 ONC1CCCCC1 MCULE-7854482550 [1,0,0,1,0,0|2,0,0]=4 1556 B8R1.2 O[NH2+]C1CCCCC1 MCULE-5578731568 [1,0,0,1,0,0|2,0,0]=4 1557 B8R1.2 S=CN1CCCCC1 MCULE-9360358622 [1,0,0,1,0,0|2,0,0]=4 1558 B8R1.2 SCC1CCCCC1 MCULE-4073711524 [1,0,0,1,0,0|1,0,1]=4 1559 B8R1.5 C=C1CCCCC1O MCULE-3853228524 [1,0,0,1,0,0|1,0,0]=3 1560 B8R1.5 C=C1CCCCC1O MCULE-5911864977 [1,0,0,1,0,0|1,0,0]=3 1561 B8R1.5 C=C1COCCC1N MCULE-4966385224 [1,0,0,1,0,0|2,0,0]=4 1562 B8R1.5 CC1CCCCC1=O MCULE-6363555535 [1,0,0,1,0,0|1,0,0]=3 1563 B8R1.5 CC1CCCCC1C MCULE-9841432259 [1,0,0,1,0,0|0,0,2]=4 1564 B8R1.5 CC1CCCCC1N MCULE-3041016580 [1,0,0,1,0,0|1,0,1]=4 1565 B8R1.5 CC1CCCCC1N MCULE-4294403075 [1,0,0,1,0,0|1,0,1]=4 1566 B8R1.5 CC1CCCCC1O MCULE-2704647488 [1,0,0,1,0,0|1,0,1]=4 1567 B8R1.5 CC1CCCCN1C MCULE-8197728941 [1,0,0,1,0,0|1,0,1]=4 1568 B8R1.5 CC1CCCCN1N MCULE-8724967874 [1,0,0,1,0,0|2,0,0]=4 1569 B8R1.5 CC1CCCNC1=O MCULE-5295531632 [1,0,0,1,0,0|2,0,0]=4 1570 B8R1.5 CC1CCCOC1=O MCULE-5926029136 [1,0,0,1,0,0|2,0,0]=4 1571 B8R1.5 CC1CCNCC1=O MCULE-8618050685 [1,0,0,1,0,0|2,0,0]=4 1572 B8R1.5 CC1CCNCC1=O MCULE-9238977073 [1,0,0,1,0,0|2,0,0]=4 1573 B8R1.5 CC1CCOCC1=O MCULE-2481965177 [1,0,0,1,0,0|2,0,0]=4 1574 B8R1.5 CC1CNCCC1=O MCULE-6306655160 [1,0,0,1,0,0|2,0,0]=4 1575 B8R1.5 CC1CNCCC1=O MCULE-9018912988 [1,0,0,1,0,0|2,0,0]=4 1576 B8R1.5 CC1COCCC1=O MCULE-2694187526 [1,0,0,1,0,0|2,0,0]=4 1577 B8R1.5 CC1CSCCC1=O MCULE-4565033608 [1,0,0,1,0,0|2,0,0]=4 1578 B8R1.5 CC1NCCCC1=O MCULE-1303642695 [1,0,0,1,0,0|2,0,0]=4 1579 B8R1.5 CC1NCCCC1=O MCULE-6618358169 [1,0,0,1,0,0|2,0,0]=4 1580 B8R1.5 CC1SCCCC1=O MCULE-7641066964 [1,0,0,1,0,0|2,0,0]=4 1581 B8R1.5 CN1CCCCC1=O MCULE-9619129797 [1,0,0,1,0,0|2,0,0]=4 1582 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-2207912311 [1,0,0,1,0,0|1,0,1]=4 1583 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-3227199256 [1,0,0,1,0,0|1,0,1]=4 1584 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-4948677049 [1,0,0,1,0,0|1,0,1]=4 1585 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-6377741621 [1,0,0,1,0,0|1,0,1]=4 1586 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-8426223529 [1,0,0,1,0,0|1,0,1]=4 1587 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-9542068395 [1,0,0,1,0,0|1,0,1]=4 1588 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-3547716632 [1,0,0,1,0,0|1,0,1]=4 1589 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-9259793572 [1,0,0,1,0,0|1,0,1]=4 1590 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-2021817746 [1,0,0,1,0,0|1,0,1]=4 1591 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-3944837592 [1,0,0,1,0,0|1,0,1]=4 1592 B8R1.5 C[C@H]1CCCC[C@@H]1C MCULE-3536263334 [1,0,0,1,0,0|0,0,2]=4 1593 B8R1.5 C[C@H]1CCCC[C@@H]1C MCULE-5867798019 [1,0,0,1,0,0|0,0,2]=4 1594 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-3841584035 [1,0,0,1,0,0|1,0,1]=4 1595 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-4158219749 [1,0,0,1,0,0|1,0,1]=4 1596 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-8973971252 [1,0,0,1,0,0|1,0,1]=4 1597 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-9885453921 [1,0,0,1,0,0|1,0,1]=4 1598 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-4879328575 [1,0,0,1,0,0|1,0,1]=4 1599 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-7331434797 [1,0,0,1,0,0|1,0,1]=4 1600 B8R1.5 C[C@H]1CCCC[C@H]1C MCULE-9131794520 [1,0,0,1,0,0|0,0,2]=4 1601 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-1533998857 [1,0,0,1,0,0|1,0,1]=4 1602 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5254242664 [1,0,0,1,0,0|1,0,1]=4 1603 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5432486645 [1,0,0,1,0,0|1,0,1]=4 1604 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-7149509445 [1,0,0,1,0,0|1,0,1]=4 1605 B8R1.5 C[C@H]1CNCCC1=O MCULE-8062269317 [1,0,0,1,0,0|2,0,0]=4 1606 B8R1.5 C[C@H]1CNCCC1=O MCULE-9510433313 [1,0,0,1,0,0|2,0,0]=4 1607 B8R1.5 C[C@H]1COCCC1=O MCULE-3103478095 [1,0,0,1,0,0|2,0,0]=4 1608 B8R1.5 NC1CCCCC1=O MCULE-2382898926 [1,0,0,1,0,0|2,0,0]=4 1609 B8R1.5 NC1CCCCC1=O MCULE-9230455128 [1,0,0,1,0,0|2,0,0]=4 1610 B8R1.5 O=C1CCCCC1Br MCULE-9356057483 [1,0,0,1,0,0|2,0,0]=4 1611 B8R1.5 O=C1CCCCC1Cl MCULE-1580566298 [1,0,0,1,0,0|2,0,0]=4 1612 B8R1.5 O=C1CCCCC1F MCULE-6406930837 [1,0,0,1,0,0|2,0,0]=4 1613 B8R1.5 O=C1CCCCC1O MCULE-7509366699 [1,0,0,1,0,0|2,0,0]=4 1614 B8R1.8 BrCCC1CCCC1 MCULE-2388060322 [1,0,0,1,0,0|1,0,1]=4 1615 B8R1.8 C#CCC1CCCC1 MCULE-4429206625 [1,0,0,1,0,0|0,0,2]=4 1616 B8R1.8 C=CCC1CCCC1 MCULE-6306576171 [1,0,0,1,0,0|0,0,0]=2 1617 B8R1.8 C=CCC1CCCN1 MCULE-2522287788 [1,0,0,1,0,0|1,0,0]=3 1618 B8R1.8 C=CCC1CCCN1 MCULE-9373442327 [1,0,0,1,0,0|1,0,0]=3 1619 B8R1.8 C=CCC1CCNC1 MCULE-5642666668 [1,0,0,1,0,0|1,0,0]=3 1620 B8R1.8 C=CCC1CCNC1 MCULE-9528500681 [1,0,0,1,0,0|1,0,0]=3 1621 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-1619177702 [1,0,0,1,0,0|1,0,0]=3 1622 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-1817861281 [1,0,0,1,0,0|1,0,0]=3 1623 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-4058658588 [1,0,0,1,0,0|1,0,0]=3 1624 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-5972924318 [1,0,0,1,0,0|1,0,0]=3 1625 B8R1.8 C=CC[C@H]1CCCN1 MCULE-4617277800 [1,0,0,1,0,0|1,0,0]=3 1626 B8R1.8 C=CC[C@H]1CCCN1 MCULE-6182243336 [1,0,0,1,0,0|1,0,0]=3 1627 B8R1.8 CCCC1C=CCC1 MCULE-9112058760 [1,0,0,1,0,0|0,0,0]=2 1628 B8R1.8 CCCC1C=CCN1 MCULE-1517781133 [1,0,0,1,0,0|1,0,0]=3 1629 B8R1.8 CCCC1CCCN1 MCULE-5407564403 [1,0,0,1,0,0|1,0,1]=4 1630 B8R1.8 CCCC1CCCN1 MCULE-7322918348 [1,0,0,1,0,0|1,0,1]=4 1631 B8R1.8 CCCC1CCNC1 MCULE-1009147377 [1,0,0,1,0,0|1,0,1]=4 1632 B8R1.8 CCCC1CCNC1 MCULE-4463468269 [1,0,0,1,0,0|1,0,1]=4 1633 B8R1.8 CNCC1CCCC1 MCULE-4663524039 [1,0,0,1,0,0|1,0,1]=4 1634 B8R1.8 CNCC1CCCC1 MCULE-9254222767 [1,0,0,1,0,0|1,0,1]=4 1635 B8R1.8 ClCCC1CCCC1 MCULE-1599799155 [1,0,0,1,0,0|1,0,1]=4 1636 B8R1.8 ICCC1CCCC1 MCULE-8881590696 [1,0,0,1,0,0|1,0,1]=4 1637 B8R1.8 N#CCC1CCCC1 MCULE-2061207221 [1,0,0,1,0,0|1,0,1]=4 1638 B8R1.8 NCCC1CCCC1 MCULE-1321612615 [1,0,0,1,0,0|1,0,1]=4 1639 B8R1.8 NCCC1CCCC1 MCULE-2815985200 [1,0,0,1,0,0|1,0,1]=4 1640 B8R1.8 NCCC1CCCC1 MCULE-4452900288 [1,0,0,1,0,0|1,0,1]=4 1641 B8R1.8 NNCC1CCCC1 MCULE-2668762237 [1,0,0,1,0,0|2,0,0]=4 1642 B8R1.8 NNCC1CCCC1 MCULE-3562283620 [1,0,0,1,0,0|2,0,0]=4 1643 B8R1.8 NNCC1CCCC1 MCULE-4656086960 [1,0,0,1,0,0|2,0,0]=4 1644 B8R1.8 NOCC1CCCC1 MCULE-4591181284 [1,0,0,1,0,0|2,0,0]=4 1645 B8R1.8 NOCC1CCCC1 MCULE-5675248010 [1,0,0,1,0,0|2,0,0]=4 1646 B8R1.8 O=CCC1CCCC1 MCULE-1337960294 [1,0,0,1,0,0|1,0,0]=3 1647 B8R1.8 O=CCC1CCOC1 MCULE-3891672561 [1,0,0,1,0,0|2,0,0]=4 1648 B8R1.8 O=CCN1CCCC1 MCULE-4391534239 [1,0,0,1,0,0|2,0,0]=4 1649 B8R1.8 O=CNC1CCCC1 MCULE-1453368274 [1,0,0,1,0,0|2,0,0]=4 1650 B8R1.8 OCCC1CCCC1 MCULE-3680571056 [1,0,0,1,0,0|1,0,1]=4 1651 B8R1.10 BrCCCC1CCC1 MCULE-7589486180 [1,0,0,1,0,0|1,0,1]=4 1652 B8R1.10 C=CCOC1CNC1 MCULE-3986622444 [1,0,0,1,0,0|2,0,0]=4 1653 B8R1.10 C=CCOC1COC1 MCULE-7294844808 [1,0,0,1,0,0|2,0,0]=4 1654 B8R1.10 CCCCC1CNC1 MCULE-2618835987 [1,0,0,1,0,0|1,0,1]=4 1655 B8R1.10 CCCCC1CNC1 MCULE-9205198054 [1,0,0,1,0,0|1,0,1]=4 1656 B8R1.10 CNCCC1CCC1 MCULE-2745819281 [1,0,0,1,0,0|1,0,1]=4 1657 B8R1.10 CNCCC1CCC1 MCULE-3567323475 [1,0,0,1,0,0|1,0,1]=4 1658 B8R1.10 NCCCC1CCC1 MCULE-7549286728 [1,0,0,1,0,0|1,0,1]=4 1659 B8R1.10 O=CCCC1CCC1 MCULE-9673511848 [1,0,0,1,0,0|1,0,0]=3 1660 B8R1.10 O=CCCC1CCO1 MCULE-1882673341 [1,0,0,1,0,0|2,0,0]=4 1661 B8R1.10 OCCCC1CCC1 MCULE-1577610703 [1,0,0,1,0,0|1,0,1]=4 1662 B8R1.11 CC1CCCC1C#N MCULE-4638858957 [1,0,0,1,0,0|1,0,1]=4 1663 B8R1.11 CC1CCCC1CN MCULE-3896736641 [1,0,0,1,0,0|1,0,1]=4 1664 B8R1.11 CC1CCCC1CN MCULE-8678978716 [1,0,0,1,0,0|1,0,1]=4 1665 B8R1.11 CC1CCCC1CO MCULE-9356546543 [1,0,0,1,0,0|1,0,1]=4 1666 B8R1.11 CC1OCCC1C=O MCULE-5505705817 [1,0,0,1,0,0|2,0,0]=4 1667 B8R1.11 CCC1CCCC1=O MCULE-1884299455 [1,0,0,1,0,0|1,0,0]=3 1668 B8R1.11 CCC1CCCC1N MCULE-3368757457 [1,0,0,1,0,0|1,0,1]=4 1669 B8R1.11 CCC1CCNC1=O MCULE-8307536027 [1,0,0,1,0,0|2,0,0]=4 1670 B8R1.11 CCC1CCOC1=O MCULE-2375464273 [1,0,0,1,0,0|2,0,0]=4 1671 B8R1.11 CCC1COCC1=O MCULE-5486171882 [1,0,0,1,0,0|2,0,0]=4 1672 B8R1.11 CCN1CCCC1=O MCULE-7206309773 [1,0,0,1,0,0|2,0,0]=4 1673 B8R1.11 CCN1CCCC1=O MCULE-7415495937 [1,0,0,1,0,0|2,0,0]=4 1674 B8R1.11 CC[C@@H]1CCC[C@H]1N MCULE-6461151240 [1,0,0,1,0,0|1,0,1]=4 1675 B8R1.11 CN1CCC[C@H]1C=O MCULE-5852490757 [1,0,0,1,0,0|2,0,0]=4 1676 B8R1.11 COC1CCCC1=O MCULE-2741778082 [1,0,0,1,0,0|2,0,0]=4 1677 B8R1.11 NCC1CCCC1=O MCULE-4144323636 [1,0,0,1,0,0|2,0,0]=4 1678 B8R1.11 NCC1CCCC1=O MCULE-8761719757 [1,0,0,1,0,0|2,0,0]=4 1679 B8R1.11 O=C1CCCC1CO MCULE-9171970685 [1,0,0,1,0,0|2,0,0]=4 1680 B8R1.13 C=CCC1CCC1=O MCULE-1128394688 [1,0,0,1,0,0|1,0,1]=4 1681 B8R1.13 CCCC1CCC1=O MCULE-7626165824 [1,0,0,1,0,0|1,0,0]=3 1682 B8R1.13 O=C1CCC1CCCl MCULE-1577834742 [1,0,0,1,0,0|2,0,0]=4 1683 B8R1.22 BrC1=CCCCCC1 MCULE-1629255872 [1,0,0,1,0,0|1,0,1]=4 1684 B8R1.22 BrC1C=CCCCC1 MCULE-3305569927 [1,0,0,1,0,0|1,0,0]=3 1685 B8R1.22 BrC1CCCCCC1 MCULE-4670856107 [1,0,0,1,0,0|1,0,1]=4 1686 B8R1.22 C=C1CCCNCC1 MCULE-2798255197 [1,0,0,1,0,0|1,0,0]=3 1687 B8R1.22 C=C1CCCNCC1 MCULE-4874852480 [1,0,0,1,0,0|1,0,0]=3 1688 B8R1.22 C=C1CNCCOC1 MCULE-6114191545 [1,0,0,1,0,0|2,0,0]=4 1689 B8R1.22 C=C1CNCCOC1 MCULE-6722705565 [1,0,0,1,0,0|2,0,0]=4 1690 B8R1.22 C=C1COCCOC1 MCULE-3194930888 [1,0,0,1,0,0|2,0,0]=4 1691 B8R1.22 C=C1OCCCCO1 MCULE-8283334358 [1,0,0,1,0,0|2,0,0]=4 1692 B8R1.22 CC1CCCCCN1 MCULE-2095896439 [1,0,0,1,0,0|1,0,1]=4 1693 B8R1.22 CC1CCCCCN1 MCULE-5848089936 [1,0,0,1,0,0|1,0,1]=4 1694 B8R1.22 CC1CCCCNC1 MCULE-4872471007 [1,0,0,1,0,0|1,0,1]=4 1695 B8R1.22 CC1CCCCNC1 MCULE-6320007925 [1,0,0,1,0,0|1,0,1]=4 1696 B8R1.22 C[C@@H]1CCCCCN1 MCULE-6288089261 [1,0,0,1,0,0|1,0,1]=4 1697 B8R1.22 C[C@@H]1CCCCCN1 MCULE-9958468096 [1,0,0,1,0,0|1,0,1]=4 1698 B8R1.22 C[C@H]1CCCCCN1 MCULE-2291249179 [1,0,0,1,0,0|1,0,1]=4 1699 B8R1.22 C[C@H]1CCCCCN1 MCULE-2695293080 [1,0,0,1,0,0|1,0,1]=4 1700 B8R1.22 ClC1CCCCCC1 MCULE-9172347842 [1,0,0,1,0,0|1,0,1]=4 1701 B8R1.22 NC1=NCCCCC1 MCULE-2757008672 [1,0,0,1,0,0|2,0,0]=4 1702 B8R1.22 NC1=NCCCCC1 MCULE-7781415779 [1,0,0,1,0,0|2,0,0]=4 1703 B8R1.22 NC1C=CCCCC1 MCULE-4893389838 [1,0,0,1,0,0|1,0,0]=3 1704 B8R1.22 NC1CCCCCC1 MCULE-6214185878 [1,0,0,1,0,0|1,0,1]=4 1705 B8R1.22 NN1CCCCCC1 MCULE-6118274368 [1,0,0,1,0,0|2,0,0]=4 1706 B8R1.22 O=C1C=CCCCC1 MCULE-5281461360 [1,0,0,1,0,0|1,0,1]=4 1707 B8R1.22 O=C1CCCCCC1 MCULE-3507111924 [1,0,0,1,0,0|1,0,0]=3 1708 B8R1.22 O=C1CCCCCN1 MCULE-4544579564 [1,0,0,1,0,0|2,0,0]=4 1709 B8R1.22 O=C1CCCCCO1 MCULE-3051096014 [1,0,0,1,0,0|2,0,0]=4 1710 B8R1.22 O=C1CCCCNC1 MCULE-8257380915 [1,0,0,1,0,0|2,0,0]=4 1711 B8R1.22 O=C1CCCCNC1 MCULE-8344538815 [1,0,0,1,0,0|2,0,0]=4 1712 B8R1.22 O=C1CCCNCC1 MCULE-3201401906 [1,0,0,1,0,0|2,0,0]=4 1713 B8R1.22 O=C1CCCNCC1 MCULE-8264253371 [1,0,0,1,0,0|2,0,0]=4 1714 B8R1.22 O=C1CCCOCC1 MCULE-9595066384 [1,0,0,1,0,0|2,0,0]=4 1715 B8R1.22 O=C1CCCSCC1 MCULE-9359592851 [1,0,0,1,0,0|2,0,0]=4 1716 B8R1.22 OC1CCCCCC1 MCULE-2514105258 [1,0,0,1,0,0|1,0,1]=4 1717 B8R1.22 S=C1CCCCCN1 MCULE-6573611309 [1,0,0,1,0,0|2,0,0]=4 1718 B8R1.22 SC1CCCCCC1 MCULE-7667420050 [1,0,0,1,0,0|1,0,1]=4 1719 B8R1.36 BrCCCCC1CC1 MCULE-7569356786 [1,0,0,1,0,0|1,0,1]=4 1720 B8R1.36 C=CCNCC1CC1 MCULE-4173667604 [1,0,0,1,0,0|1,0,0]=3 1721 B8R1.36 C=CCOCC1CO1 MCULE-9873812974 [1,0,0,1,0,0|2,0,0]=4 1722 B8R1.36 CCCCCC1CO1 MCULE-2249864409 [1,0,0,1,0,0|1,0,1]=4 1723 B8R1.36 NCCCCC1CC1 MCULE-8530038799 [1,0,0,1,0,0|1,0,1]=4 1724 B8R1.36 O=CCCCC1CC1 MCULE-4652283620 [1,0,0,1,0,0|1,0,0]=3 1725 B8R1.36 OCCCCC1CC1 MCULE-6334640431 [1,0,0,1,0,0|1,0,1]=4 1726 B8R1.49 C1=CCCC=CCC1 MCULE-3211373383 [1,0,0,1,0,0|0,0,2]=4 1727 B8R1.49 C1=CCCC=CCC1 MCULE-9901206319 [1,0,0,1,0,0|0,0,2]=4 1728 B8R1.49 C1=CCCCCC=C1 MCULE-4007077583 [1,0,0,1,0,0|0,0,2]=4 1729 B8R1.49 C1=CCCCCC=C1 MCULE-6072460693 [1,0,0,1,0,0|0,0,2]=4 1730 B8R1.49 C1=CCCCCCC1 MCULE-9704495201 [1,0,0,1,0,0|0,0,0]=2 1731 B8R1.49 C1=CCCCCCC1 MCULE-9874244790 [1,0,0,1,0,0|0,0,0]=2 1732 B8R1.49 C1CCCCCCC1 MCULE-2574589959 [1,0,0,1,0,0|0,0,2]=4 1733 B8R1.49 C1CCCNCCC1 MCULE-5976326835 [1,0,0,1,0,0|1,0,1]=4 1734 B8R1.49 C1CCCNCCC1 MCULE-9979746026 [1,0,0,1,0,0|1,0,1]=4 1735 B8R1.1 CC1CCC(C1)C=O MCULE-9381232427 [1,0,0,1,0,0|2,0,0]=4 1736 B8R1.1 CC1CCC(O1)CI MCULE-2805289539 [1,0,0,1,0,0|1,0,1]=4 1737 B8R1.1 CC1CCC(O1)CN MCULE-4161233821 [1,0,0,1,0,0|1,0,1]=4 1738 B8R1.1 CC1CCC(O1)CO MCULE-1587985152 [1,0,0,1,0,0|1,0,1]=4 1739 B8R1.1 C[C@@H]1CC[C@@H](O1)CO MCULE-1981408927 [1,0,0,1,0,0|1,0,1]=4 1740 B8R1.1 C[C@@H]1CC[C@@H](O1)CO MCULE-2750103072 [1,0,0,1,0,0|1,0,1]=4 1741 B8R1.1 C[C@H]1CC[C@H](O1)CO MCULE-2585928492 [1,0,0,1,0,0|1,0,1]=4 1742 B8R1.1 C[C@H]1CC[C@H](O1)CO MCULE-3715649264 [1,0,0,1,0,0|1,0,1]=4 1743 B8R1.1 NC1C=CC(C1)CO MCULE-6409966211 [1,0,0,1,0,0|2,0,0]=4 1744 B8R1.1 NC1C=CC(C1)CO MCULE-9217183744 [1,0,0,1,0,0|2,0,0]=4 1745 B8R1.1 N[C@@H]1C=C[C@@H](C1)CO MCULE-6317024482 [1,0,0,1,0,0|2,0,0]=4 1746 B8R1.1 N[C@@H]1C=C[C@@H](C1)CO MCULE-7574782144 [1,0,0,1,0,0|2,0,0]=4 1747 B8R1.1 N[C@@H]1C=C[C@@H](C1)CO MCULE-7925480161 [1,0,0,1,0,0|2,0,0]=4 1748 B8R1.1 N[C@@H]1C=C[C@@H](C1)CO MCULE-8008829330 [1,0,0,1,0,0|2,0,0]=4 1749 B8R1.1 N[C@H]1C=C[C@H](C1)CO MCULE-3324290612 [1,0,0,1,0,0|2,0,0]=4 1750 B8R1.1 N[C@H]1C=C[C@H](C1)CO MCULE-3860506121 [1,0,0,1,0,0|2,0,0]=4 1751 B8R1.1 N[C@H]1C=C[C@H](C1)CO MCULE-4118050926 [1,0,0,1,0,0|2,0,0]=4 1752 B8R1.1 N[C@H]1C=C[C@H](C1)CO MCULE-4136002750 [1,0,0,1,0,0|2,0,0]=4 1753 B8R1.1 N[C@H]1C=C[C@H](C1)CO MCULE-4159108338 [1,0,0,1,0,0|2,0,0]=4 1754 B8R1.1 [C@H]1(C=C[C@@H](C1)N)CO MCULE-5721231711 [1,0,0,1,0,0|2,0,0]=4 1755 B8R1.3 CC1C=CC(=O)CC1 MCULE-6972928704 [1,0,0,1,0,0|0,0,2]=4 1756 B8R1.3 CC1CCC(CC1)O MCULE-7501628471 [1,0,0,1,0,0|0,0,2]=4 1757 B8R1.3 CC1CCC(CN1)O MCULE-1965969511 [1,0,0,1,0,0|1,0,1]=4 1758 B8R1.3 CC1CCC(CN1)O MCULE-8922826910 [1,0,0,1,0,0|1,0,1]=4 1759 B8R1.3 CC1CCC(CO1)O MCULE-8416383333 [1,0,0,1,0,0|1,0,1]=4 1760 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-1181513126 [1,0,0,1,0,0|1,0,1]=4 1761 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-1902739569 [1,0,0,1,0,0|1,0,1]=4 1762 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-4923873245 [1,0,0,1,0,0|1,0,1]=4 1763 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-5091971479 [1,0,0,1,0,0|1,0,1]=4 1764 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-7440788820 [1,0,0,1,0,0|1,0,1]=4 1765 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-8869692501 [1,0,0,1,0,0|1,0,1]=4 1766 B8R1.3 C[C@@H]1CC[C@H](CN1)O MCULE-8099689887 [1,0,0,1,0,0|1,0,1]=4 1767 B8R1.3 C[C@@H]1CC[C@H](CN1)O MCULE-8746216012 [1,0,0,1,0,0|1,0,1]=4 1768 B8R1.3 C[C@@H]1CC[C@H](CN1)O MCULE-9870191339 [1,0,0,1,0,0|1,0,1]=4 1769 B8R1.3 C[C@H]1CC[C@@H](CC1)O MCULE-9131864343 [1,0,0,1,0,0|0,0,2]=4 1770 B8R1.3 C[C@H]1CC[C@@H](CN1)O MCULE-4342382470 [1,0,0,1,0,0|1,0,1]=4 1771 B8R1.3 C[C@H]1CC[C@@H](CN1)O MCULE-7588845174 [1,0,0,1,0,0|1,0,1]=4 1772 B8R1.3 C[C@H]1CC[C@H](CC1)O MCULE-3495737054 [1,0,0,1,0,0|0,0,2]=4 1773 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-1161766631 [1,0,0,1,0,0|1,0,1]=4 1774 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-1646727489 [1,0,0,1,0,0|1,0,1]=4 1775 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-4706855730 [1,0,0,1,0,0|1,0,1]=4 1776 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-6031163394 [1,0,0,1,0,0|1,0,1]=4 1777 B8R1.3 O[C@@H]1C=C[C@H](CC1)O MCULE-6358884039 [1,0,0,1,0,0|1,0,0]=3 1778 B8R1.3 O[C@H]1C=C[C@@H](CC1)O MCULE-2727087872 [1,0,0,1,0,0|1,0,0]=3 1779 B8R1.3 O[C@H]1C=C[C@@H](CC1)O MCULE-9017888653 [1,0,0,1,0,0|1,0,0]=3 1780 B8R1.38 C=CC(N)C1CCC1 MCULE-3645428001 [1,0,0,1,0,0|1,0,0]=3 1781 B8R1.38 CC(C=O)C1CCC1 MCULE-5860376202 [1,0,0,1,0,0|2,0,0]=4 1782 B8R1.38 CCC(O)C1CCC1 MCULE-5180007399 [1,0,0,1,0,0|0,0,2]=4 1783 B8R1.38 NCC(O)C1CCC1 MCULE-3437732656 [1,0,0,1,0,0|1,0,1]=4 1784 B8R1.38 NCC(O)C1CCC1 MCULE-3764801914 [1,0,0,1,0,0|1,0,1]=4 1785 B8R1.38 OCC(O)C1CCC1 MCULE-5695655912 [1,0,0,1,0,0|1,0,1]=4 1786 B8R1.40 C=CC(=O)CC1CC1 MCULE-2286262087 [1,0,0,1,0,0|0,0,2]=4 1787 B8R1.41 CCCCC1(CC1)O MCULE-3219412686 [1,0,0,1,0,0|0,0,2]=4 1788 B8R1.50 CC1CCC(C1=O)C MCULE-1473375660 [1,0,0,1,0,0|2,0,0]=4 1789 B8R1.50 CC1CCC(C1O)O MCULE-3292232581 [1,0,0,1,0,0|1,0,1]=4 1790 B8R1.50 CN1CCC(C1=O)O MCULE-6867263123 [1,0,0,1,0,0|2,0,0]=4 1791 B8R1.52 C#CC1(CCCC1)O MCULE-7428088952 [1,0,0,1,0,0|0,0,2]=4 1792 B8R1.52 C=C[Si]1(CCCC1)C MCULE-3298566075 [1,0,0,1,0,0|1,1,0]=4 1793 B8R1.52 CC1(CCCC1)C=O MCULE-2794420297 [1,0,0,1,0,0|2,0,0]=4 1794 B8R1.52 CCC1(CCCC1)O MCULE-2200843488 [1,0,0,1,0,0|0,0,2]=4 1795 B8R1.52 N#CC1(CCCC1)O MCULE-6757441617 [1,0,0,1,0,0|1,0,1]=4 1796 B8R1.52 NCC1(CCCC1)O MCULE-7890258140 [1,0,0,1,0,0|1,0,1]=4 1797 B8R1.52 NCC1(CCCC1)O MCULE-7985204108 [1,0,0,1,0,0|1,0,1]=4 1798 B8R1.52 O=CC1(CCCC1)F MCULE-6748021302 [1,0,0,1,0,0|2,0,0]=4 1799 B8R1.52 OCC1(CCCC1)O MCULE-2433996412 [1,0,0,1,0,0|1,0,1]=4 1800 B8R1.4 C1(CCCN(C1)C)O MCULE-3423318871 [1,0,0,1,0,0|1,0,1]=4 1801 B8R1.4 CC1=CC(CCC1)O MCULE-3389687006 [1,0,0,1,0,0|0,0,1]=3 1802 B8R1.4 CC1CC(CCN1)O MCULE-6498081704 [1,0,0,1,0,0|1,0,1]=4 1803 B8R1.4 CC1CC(CCN1)O MCULE-7903568675 [1,0,0,1,0,0|1,0,1]=4 1804 B8R1.4 CC1CC(CCO1)O MCULE-4865141445 [1,0,0,1,0,0|1,0,1]=4 1805 B8R1.4 CC1CCCC(=O)O1 MCULE-4000069856 [1,0,0,1,0,0|1,0,1]=4 1806 B8R1.4 CC1CCCC(C1)Br MCULE-5316207726 [1,0,0,1,0,0|1,0,1]=4 1807 B8R1.4 CC1CCCC(C1)C MCULE-4586744389 [1,0,0,1,0,0|1,0,1]=4 1808 B8R1.4 CC1CCCC(C1)N MCULE-5556282713 [1,0,0,1,0,0|1,0,1]=4 1809 B8R1.4 CC1CCCC(C1)N MCULE-8731144009 [1,0,0,1,0,0|1,0,1]=4 1810 B8R1.4 CC1CCCC(C1)O MCULE-5839979596 [1,0,0,1,0,0|0,0,1]=3 1811 B8R1.4 CC1CCCC(C1)S MCULE-6656207820 [1,0,0,1,0,0|0,1,1]=4 1812 B8R1.4 CC1CCCC(N1)C MCULE-1701252671 [1,0,0,1,0,0|1,0,1]=4 1813 B8R1.4 CC1CCCC(N1)C MCULE-3781585788 [1,0,0,1,0,0|1,0,1]=4 1814 B8R1.4 CC1CCC[C@@H](N1)C MCULE-6717885612 [1,0,0,1,0,0|1,0,1]=4 1815 B8R1.4 CC1CCC[C@@H](N1)C MCULE-8850784160 [1,0,0,1,0,0|1,0,1]=4 1816 B8R1.4 CC1CCC[C@H](C1)O MCULE-8817611474 [1,0,0,1,0,0|0,0,1]=3 1817 B8R1.4 CC1CCC[C@H](N1)C MCULE-3950492914 [1,0,0,1,0,0|1,0,1]=4 1818 B8R1.4 CC1CCC[C@H](N1)C MCULE-6363665850 [1,0,0,1,0,0|1,0,1]=4 1819 B8R1.4 CC1CCOC(O1)C MCULE-1813287934 [1,0,0,1,0,0|1,0,1]=4 1820 B8R1.4 CC1CNCC(C1)O MCULE-3984160340 [1,0,0,1,0,0|1,0,1]=4 1821 B8R1.4 CC1CNCC(C1)O MCULE-8485435970 [1,0,0,1,0,0|1,0,1]=4 1822 B8R1.4 CC1CNCC(O1)C MCULE-1246186846 [1,0,0,1,0,0|1,0,1]=4 1823 B8R1.4 CC1CNCC(O1)C MCULE-4536319828 [1,0,0,1,0,0|1,0,1]=4 1824 B8R1.4 CN1CCCC(C1)O MCULE-1282411969 [1,0,0,1,0,0|1,0,1]=4 1825 B8R1.4 CN1CCCC(C1)O MCULE-5914090374 [1,0,0,1,0,0|1,0,1]=4 1826 B8R1.4 CN1CCC[C@@H](C1)O MCULE-7507199450 [1,0,0,1,0,0|1,0,1]=4 1827 B8R1.4 CN1CCC[C@@H](C1)O MCULE-7595542900 [1,0,0,1,0,0|1,0,1]=4 1828 B8R1.4 CN1CCC[C@H](C1)O MCULE-1943345564 [1,0,0,1,0,0|1,0,1]=4 1829 B8R1.4 CN1CCC[C@H](C1)O MCULE-2523873601 [1,0,0,1,0,0|1,0,1]=4 1830 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-6306078053 [1,0,0,1,0,0|1,0,1]=4 1831 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-7616070208 [1,0,0,1,0,0|1,0,1]=4 1832 B8R1.4 C[C@@H]1CCC[C@@H](C1)N MCULE-4415985299 [1,0,0,1,0,0|1,0,1]=4 1833 B8R1.4 C[C@@H]1CCC[C@@H](C1)N MCULE-8377118927 [1,0,0,1,0,0|1,0,1]=4 1834 B8R1.4 C[C@@H]1CCC[C@@H](C1)O MCULE-9818117668 [1,0,0,1,0,0|0,0,1]=3 1835 B8R1.4 C[C@@H]1CCC[C@H](C1)C MCULE-3238245504 [1,0,0,1,0,0|1,0,1]=4 1836 B8R1.4 C[C@@H]1CCC[C@H](C1)C MCULE-5078558305 [1,0,0,1,0,0|1,0,1]=4 1837 B8R1.4 C[C@@H]1CCC[C@H](C1)N MCULE-8122076410 [1,0,0,1,0,0|1,0,1]=4 1838 B8R1.4 C[C@@H]1CCC[C@H](C1)N MCULE-8755565938 [1,0,0,1,0,0|1,0,1]=4 1839 B8R1.4 C[C@@H]1CCC[C@H](N1)C MCULE-3698881454 [1,0,0,1,0,0|1,0,1]=4 1840 B8R1.4 C[C@@H]1CCC[C@H](N1)C MCULE-9551065058 [1,0,0,1,0,0|1,0,1]=4 1841 B8R1.4 C[C@@H]1CNC[C@H](O1)C MCULE-8338777291 [1,0,0,1,0,0|1,0,1]=4 1842 B8R1.4 C[C@@H]1CNC[C@H](O1)C MCULE-9597572516 [1,0,0,1,0,0|1,0,1]=4 1843 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-4140093728 [1,0,0,1,0,0|1,0,1]=4 1844 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-5163618886 [1,0,0,1,0,0|1,0,1]=4 1845 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-7763919398 [1,0,0,1,0,0|1,0,1]=4 1846 B8R1.4 C[C@@H]1C[C@@H](CCN1)O MCULE-8618284571 [1,0,0,1,0,0|1,0,1]=4 1847 B8R1.4 C[C@@H]1C[C@@H](CCO1)O MCULE-6251959536 [1,0,0,1,0,0|1,0,1]=4 1848 B8R1.4 C[C@@H]1C[C@H](CCN1)O MCULE-6703272966 [1,0,0,1,0,0|1,0,1]=4 1849 B8R1.4 C[C@H]1CCC[C@@H](N1)C MCULE-1147260663 [1,0,0,1,0,0|1,0,1]=4 1850 B8R1.4 C[C@H]1CCC[C@@H](N1)C MCULE-9029116005 [1,0,0,1,0,0|1,0,1]=4 1851 B8R1.4 C[C@H]1CCC[C@H](C1)C MCULE-7889833647 [1,0,0,1,0,0|1,0,1]=4 1852 B8R1.4 C[C@H]1CCC[C@H](C1)N MCULE-5054508849 [1,0,0,1,0,0|1,0,1]=4 1853 B8R1.4 C[C@H]1CCC[C@H](C1)O MCULE-9355825371 [1,0,0,1,0,0|0,0,1]=3 1854 B8R1.4 C[C@H]1CCC[C@H](N1)C MCULE-5870895189 [1,0,0,1,0,0|1,0,1]=4 1855 B8R1.4 C[C@H]1CCC[C@H](N1)C MCULE-9926277933 [1,0,0,1,0,0|1,0,1]=4 1856 B8R1.4 C[C@H]1CNC[C@@H](O1)C MCULE-3690703731 [1,0,0,1,0,0|1,0,1]=4 1857 B8R1.4 C[C@H]1CNC[C@@H](O1)C MCULE-4390136549 [1,0,0,1,0,0|1,0,1]=4 1858 B8R1.4 C[C@H]1CNC[C@@H](O1)C MCULE-6341510399 [1,0,0,1,0,0|1,0,1]=4 1859 B8R1.4 C[C@H]1CNC[C@H](O1)C MCULE-8184385886 [1,0,0,1,0,0|1,0,1]=4 1860 B8R1.4 C[C@H]1C[C@@H](CCN1)O MCULE-1694554479 [1,0,0,1,0,0|1,0,1]=4 1861 B8R1.4 C[C@H]1C[C@@H](CCO1)O MCULE-3846187212 [1,0,0,1,0,0|1,0,1]=4 1862 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2129467220 [1,0,0,1,0,0|1,0,1]=4 1863 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2293561927 [1,0,0,1,0,0|1,0,1]=4 1864 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2465229358 [1,0,0,1,0,0|1,0,1]=4 1865 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-2588665539 [1,0,0,1,0,0|1,0,1]=4 1866 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-4194322726 [1,0,0,1,0,0|1,0,1]=4 1867 B8R1.4 C[C@H]1C[C@H](CCN1)O MCULE-4666938059 [1,0,0,1,0,0|1,0,1]=4 1868 B8R1.4 C[C@H]1C[C@H](CCO1)O MCULE-3007764630 [1,0,0,1,0,0|1,0,1]=4 1869 B8R1.4 NC1CCCC(C1)O MCULE-6642881941 [1,0,0,1,0,0|1,0,1]=4 1870 B8R1.4 NC1CCCC(C1)O MCULE-7481733301 [1,0,0,1,0,0|1,0,1]=4 1871 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-2185895220 [1,0,0,1,0,0|1,0,1]=4 1872 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-6878512399 [1,0,0,1,0,0|1,0,1]=4 1873 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-7794771906 [1,0,0,1,0,0|1,0,1]=4 1874 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-9600913098 [1,0,0,1,0,0|1,0,1]=4 1875 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-3943542357 [1,0,0,1,0,0|1,0,1]=4 1876 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-7462583711 [1,0,0,1,0,0|1,0,1]=4 1877 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-8163415958 [1,0,0,1,0,0|1,0,1]=4 1878 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-9050533878 [1,0,0,1,0,0|1,0,1]=4 1879 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-2088777566 [1,0,0,1,0,0|1,0,1]=4 1880 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-6052884406 [1,0,0,1,0,0|1,0,1]=4 1881 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-7145455722 [1,0,0,1,0,0|1,0,1]=4 1882 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-8458598098 [1,0,0,1,0,0|1,0,1]=4 1883 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-1402442931 [1,0,0,1,0,0|1,0,1]=4 1884 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-2566868682 [1,0,0,1,0,0|1,0,1]=4 1885 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-8263508625 [1,0,0,1,0,0|1,0,1]=4 1886 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-9158452946 [1,0,0,1,0,0|1,0,1]=4 1887 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-9908500977 [1,0,0,1,0,0|1,0,1]=4 1888 B8R1.4 OC1CCCC(C1)O MCULE-5377622416 [1,0,0,1,0,0|1,0,1]=4 1889 B8R1.4 O[C@@H]1CCC[C@H](C1)O MCULE-1135108851 [1,0,0,1,0,0|1,0,1]=4 1890 B8R1.4 O[C@@H]1CCC[C@H](C1)O MCULE-4488851523 [1,0,0,1,0,0|1,0,1]=4 1891 B8R1.4 O[C@H]1CCC[C@@H](C1)O MCULE-4718573149 [1,0,0,1,0,0|1,0,1]=4 1892 B8R1.4 O[C@H]1CCC[C@H](C1)O MCULE-9402957017 [1,0,0,1,0,0|1,0,1]=4 1893 B8R1.4 [C@@H]1(CCC[C@@H](C1)N)C MCULE-3863430976 [1,0,0,1,0,0|1,0,1]=4 1894 B8R1.4 [C@H]1(CCC[C@H](C1)O)N MCULE-1919170190 [1,0,0,1,0,0|1,0,1]=4 1895 B8R1.4 [C@H]1(CCC[C@H](C1)O)N MCULE-2985238129 [1,0,0,1,0,0|1,0,1]=4 1896 B8R1.6 CCCN1CC(C1)O MCULE-5732134072 [1,0,0,1,0,0|1,0,1]=4 1897 B8R1.6 CCNC1CC(C1)O MCULE-2764655211 [1,0,0,1,0,0|1,0,1]=4 1898 B8R1.6 CCNC1CC(C1)O MCULE-3171451274 [1,0,0,1,0,0|1,0,1]=4 1899 B8R1.6 CCOC1CC(C1)O MCULE-6259730085 [1,0,0,1,0,0|1,0,1]=4 1900 B8R1.6 COCC1CC(C1)O MCULE-2862800319 [1,0,0,1,0,0|1,0,1]=4 1901 B8R1.6 NCCC1CC(C1)O MCULE-6387064695 [1,0,0,1,0,0|1,0,1]=4 1902 B8R1.6 NCCC1CC(C1)O MCULE-9498169113 [1,0,0,1,0,0|1,0,1]=4 1903 B8R1.6 NCC[C@H]1C[C@H](C1)O MCULE-1788933104 [1,0,0,1,0,0|1,0,1]=4 1904 B8R1.6 NCC[C@H]1C[C@H](C1)O MCULE-5167300652 [1,0,0,1,0,0|1,0,1]=4 1905 B8R1.7 CC(Br)C1CCCC1 MCULE-9104958283 [1,0,0,1,0,0|1,0,1]=4 1906 B8R1.7 CC(C)C1CCCC1 MCULE-4905120936 [1,0,0,1,0,0|1,0,1]=4 1907 B8R1.7 CC(N)C1CCCC1 MCULE-1576719851 [1,0,0,1,0,0|1,0,1]=4 1908 B8R1.7 CC(N)C1CCCC1 MCULE-9047229690 [1,0,0,1,0,0|1,0,1]=4 1909 B8R1.7 CC(O)C1CCCC1 MCULE-6730583511 [1,0,0,1,0,0|0,0,1]=3 1910 B8R1.7 CC(O)C1CCCO1 MCULE-2804362263 [1,0,0,1,0,0|1,0,1]=4 1911 B8R1.7 CC(O)C1CCNC1 MCULE-3316354505 [1,0,0,1,0,0|1,0,1]=4 1912 B8R1.7 CC(O)C1CCNC1 MCULE-6188875194 [1,0,0,1,0,0|1,0,1]=4 1913 B8R1.7 CC(O)C1CCOC1 MCULE-1059653145 [1,0,0,1,0,0|1,0,1]=4 1914 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-2532670333 [1,0,0,1,0,0|1,0,1]=4 1915 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-7828853056 [1,0,0,1,0,0|1,0,1]=4 1916 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-8150036197 [1,0,0,1,0,0|1,0,1]=4 1917 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-8243361407 [1,0,0,1,0,0|1,0,1]=4 1918 B8R1.7 C[C@@H](O)C1CCCC1 MCULE-2530250478 [1,0,0,1,0,0|0,0,1]=3 1919 B8R1.7 C[C@@H](O)[C@H]1CCCO1 MCULE-6393902221 [1,0,0,1,0,0|1,0,1]=4 1920 B8R1.7 C[C@H](N)C1CCCC1 MCULE-4224874512 [1,0,0,1,0,0|1,0,1]=4 1921 B8R1.7 C[C@H](N)C1CCCC1 MCULE-6435654240 [1,0,0,1,0,0|1,0,1]=4 1922 B8R1.7 C[C@H](N)C1CCCC1 MCULE-8124130642 [1,0,0,1,0,0|1,0,1]=4 1923 B8R1.7 C[C@H](N)C1CCCC1 MCULE-9554309821 [1,0,0,1,0,0|1,0,1]=4 1924 B8R1.7 C[C@H](O)C1CCCC1 MCULE-9054245488 [1,0,0,1,0,0|0,0,1]=3 1925 B8R1.7 C[C@H](O)C1CCCO1 MCULE-5402066981 [1,0,0,1,0,0|1,0,1]=4 1926 B8R1.7 C[C@H](O)C1CCOC1 MCULE-9092941508 [1,0,0,1,0,0|1,0,1]=4 1927 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5014228849 [1,0,0,1,0,0|1,0,1]=4 1928 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5063876687 [1,0,0,1,0,0|1,0,1]=4 1929 B8R1.7 C[C@H](O)[C@@H]1CCCO1 MCULE-3917713920 [1,0,0,1,0,0|1,0,1]=4 1930 B8R1.7 O=C(O)C1CCCC1 MCULE-6415159340 [1,0,0,1,0,0|1,0,1]=4 1931 B8R1.7 OB(O)C1CCCC1 MCULE-7101191940 [1,0,0,1,0,0|2,0,0]=4 1932 B8R1.19 CC1(CCCC1N)O MCULE-3396541731 [1,0,0,1,0,0|1,0,1]=4 1933 B8R1.19 CC1(CCCC1O)O MCULE-7509860049 [1,0,0,1,0,0|1,0,1]=4 1934 B8R1.19 CC1COCC1(C)O MCULE-8635665597 [1,0,0,1,0,0|1,0,1]=4 1935 B8R1.19 C[C@@H]1COC[C@]1(C)O MCULE-2882517612 [1,0,0,1,0,0|1,0,1]=4 1936 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-4508286005 [1,0,0,1,0,0|1,0,1]=4 1937 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-9668737274 [1,0,0,1,0,0|1,0,1]=4 1938 B8R1.19 C[C@@]1(CCC[C@H]1N)O MCULE-2369187970 [1,0,0,1,0,0|1,0,1]=4 1939 B8R1.19 C[C@H]1COC[C@@]1(C)O MCULE-6225656472 [1,0,0,1,0,0|1,0,1]=4 1940 B8R1.19 C[C@]1(CCC[C@@H]1N)O MCULE-2644040109 [1,0,0,1,0,0|1,0,1]=4 1941 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-2446086306 [1,0,0,1,0,0|1,0,1]=4 1942 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-8959851594 [1,0,0,1,0,0|1,0,1]=4 1943 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-9937788175 [1,0,0,1,0,0|1,0,1]=4 1944 B8R1.19 [C@@H]1(COC[C@@]1(C)O)C MCULE-5554336121 [1,0,0,1,0,0|1,0,1]=4 1945 B8R1.20 CC1CC1CC(=O)O MCULE-3151390667 [1,0,0,1,0,0|1,0,1]=4 1946 B8R1.31 CC(O)C1CCC1F MCULE-2872972823 [1,0,0,1,0,0|1,0,1]=4 1947 B8R1.31 CC1CCC1C(=O)O MCULE-2755332087 [1,0,0,1,0,0|1,0,1]=4 1948 B8R1.34 CC(N)CC1CCC1 MCULE-4587444267 [1,0,0,1,0,0|1,0,1]=4 1949 B8R1.34 CC(N)CC1CCC1 MCULE-8222419555 [1,0,0,1,0,0|1,0,1]=4 1950 B8R1.34 CC(O)CN1CCC1 MCULE-5888012727 [1,0,0,1,0,0|1,0,1]=4 1951 B8R1.34 O=C(O)CC1CCC1 MCULE-3720911045 [1,0,0,1,0,0|1,0,1]=4 1952 B8R1.35 CC(N)CCC1CC1 MCULE-7679176240 [1,0,0,1,0,0|1,0,1]=4 1953 B8R1.35 CC(O)CNC1CC1 MCULE-6273561896 [1,0,0,1,0,0|1,0,1]=4 1954 B8R1.35 O=C(O)CCC1CC1 MCULE-1377442346 [1,0,0,1,0,0|1,0,1]=4 1955 B8R1.43 CCC1CC1C(=O)O MCULE-2993174891 [1,0,0,1,0,0|1,0,1]=4 1956 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O MCULE-8944777861 [1,0,0,1,0,0|1,0,1]=4 1957 B8R1.72 CC1(CCCCC1)Br MCULE-7638162883 [1,0,0,1,0,0|1,0,1]=4 1958 B8R1.72 CC1(CCCCC1)C MCULE-1034948429 [1,0,0,1,0,0|1,0,1]=4 1959 B8R1.72 CC1(CCCCC1)Cl MCULE-9694989677 [1,0,0,1,0,0|1,0,1]=4 1960 B8R1.72 CC1(CCCCC1)N MCULE-4578526281 [1,0,0,1,0,0|1,0,1]=4 1961 B8R1.72 CC1(CCCCC1)N MCULE-7255401200 [1,0,0,1,0,0|1,0,1]=4 1962 B8R1.72 CC1(CCCCC1)O MCULE-9091358177 [1,0,0,1,0,0|0,0,1]=3 1963 B8R1.72 CC1(CCCNC1)O MCULE-5451972522 [1,0,0,1,0,0|1,0,1]=4 1964 B8R1.72 CC1(CCCNC1)O MCULE-8102952158 [1,0,0,1,0,0|1,0,1]=4 1965 B8R1.72 CC1(CCNCC1)O MCULE-9361316232 [1,0,0,1,0,0|1,0,1]=4 1966 B8R1.72 CC1(CCNCC1)O MCULE-9693067330 [1,0,0,1,0,0|1,0,1]=4 1967 B8R1.72 CC1(CCOCC1)O MCULE-8543825418 [1,0,0,1,0,0|1,0,1]=4 1968 B8R1.72 CC1(CCSCC1)O MCULE-2057155888 [1,0,0,1,0,0|1,0,1]=4 1969 B8R1.72 C[C@@]1(CCCNC1)O MCULE-4258412383 [1,0,0,1,0,0|1,0,1]=4 1970 B8R1.72 C[C@@]1(CCCNC1)O MCULE-4809428117 [1,0,0,1,0,0|1,0,1]=4 1971 B8R1.72 C[C@@]1(CCCNC1)O MCULE-5529196606 [1,0,0,1,0,0|1,0,1]=4 1972 B8R1.72 C[C@]1(CCCNC1)O MCULE-1848066803 [1,0,0,1,0,0|1,0,1]=4 1973 B8R1.72 C[C@]1(CCCNC1)O MCULE-4327624120 [1,0,0,1,0,0|1,0,1]=4 1974 B8R1.72 C[C@]1(CCCNC1)O MCULE-4586680651 [1,0,0,1,0,0|1,0,1]=4 1975 B8R1.72 C[C@]1(CCCNC1)O MCULE-5076504348 [1,0,0,1,0,0|1,0,1]=4 1976 B8R1.72 FC1(CCCCC1)F MCULE-7225537600 [1,0,0,1,0,0|2,0,0]=4 1977 B8R1.72 OC1(CCNCC1)O MCULE-8628233615 [1,0,0,1,0,0|2,0,0]=4 1978 B8R1.72 OC1(CCNCC1)O MCULE-9932298071 [1,0,0,1,0,0|2,0,0]=4 1979 B10R1.13 C=C(C)[C@H]1C=C[C@@H](CC1)C MCULE-4843276428 [0,1,0,1,0,0|1,0,1]=4 1980 B10R1.13 C=C1C=CC(CC1)C(C)C MCULE-3969034493 [0,1,0,1,0,0|1,0,1]=4 1981 B10R1.13 CC(C)C1C=CC(=O)CC1 MCULE-4237895406 [0,1,0,1,0,0|0,0,2]=4 1982 B10R1.13 CC(C)C1CCC(CC1)O MCULE-5386143158 [0,1,0,1,0,0|0,0,2]=4 1983 B10R1.13 CC(C)[C@@H]1C=CC(=O)CC1 MCULE-7627894901 [0,1,0,1,0,0|0,0,2]=4 1984 B10R1.13 CC(C)[C@H]1CC[C@H](CC1)O MCULE-4118555776 [0,1,0,1,0,0|0,0,2]=4 1985 B10R1.13 [C@@H]1(CC[C@@H](CC1)C(C)C)O MCULE-6846114441 [0,1,0,1,0,0|0,0,2]=4 1986 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9089135115 [0,1,0,1,0,0|2,0,0]=4 1987 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9951781675 [0,1,0,1,0,0|2,0,0]=4 1988 B10R1.54 CC(=O)OC1C=CC(C1)O MCULE-6689209340 [0,1,0,1,0,0|1,0,1]=4 1989 B10R1.54 CC(=O)O[C@@H]1C=C[C@@H](C1)O MCULE-7020670709 [0,1,0,1,0,0|1,0,1]=4 1990 B10R1.54 CC(=O)O[C@@H]1C=C[C@@H](C1)O MCULE-9136558773 [0,1,0,1,0,0|1,0,1]=4 1991 B10R1.54 CC(=O)O[C@@H]1C=C[C@H](C1)O MCULE-3237879509 [0,1,0,1,0,0|1,0,1]=4 1992 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](C1)O MCULE-4684454825 [0,1,0,1,0,0|1,0,1]=4 1993 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](C1)O MCULE-7756903175 [0,1,0,1,0,0|1,0,1]=4 1994 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](C1)O MCULE-8920693523 [0,1,0,1,0,0|1,0,1]=4 1995 B10R1.54 CC(=O)O[C@H]1C=C[C@H](C1)O MCULE-2981517362 [0,1,0,1,0,0|1,0,1]=4 1996 B10R1.54 CC(=O)O[C@H]1C=C[C@H](C1)O MCULE-5260414695 [0,1,0,1,0,0|1,0,1]=4 1997 B10R1.54 [C@H]1(C=C[C@@H](C1)OC(=O)C)O MCULE-8509096456 [0,1,0,1,0,0|1,0,1]=4 1998 B10R1.79 O[C@H]1CCC[C@H](CCC1)O MCULE-2172146338 [0,1,0,1,0,0|0,0,2]=4 1999 B10R1.153 NCC(O)COCC1CC1 MCULE-4025869800 [0,1,0,1,0,0|1,0,1]=4 2000 B10R1.171 CC1(CCCC(C1)C=O)C MCULE-2204954553 [0,1,0,1,0,0|2,0,0]=4 2001 B10R1.171 CC1(CCCC(O1)CBr)C MCULE-5779384506 [0,1,0,1,0,0|1,0,1]=4 2002 B10R1.171 CC1(CCCC(O1)CN)C MCULE-3816264715 [0,1,0,1,0,0|1,0,1]=4 2003 B10R1.171 CC1(CCCC(O1)CO)C MCULE-1867067691 [0,1,0,1,0,0|1,0,1]=4 2004 B10R1.301 CC1(CCCC(C1=O)Cl)C MCULE-6998065064 [0,1,0,1,0,0|2,0,0]=4 2005 B10R1.301 CC1(CCCC(C1=O)F)C MCULE-9527807140 [0,1,0,1,0,0|2,0,0]=4 2006 B10R1.301 CC1CCCC(C1=O)(C)C MCULE-3194713697 [0,1,0,1,0,0|2,0,0]=4 2007 B10R1.479 CC1(CCCC1(O)CN)C MCULE-2509795498 [0,1,0,1,0,0|1,0,1]=4 2008 B10R1.485 C#CC1(CCCC(C1)N)O MCULE-5007406862 [0,1,0,1,0,0|0,0,2]=4 2009 B10R1.485 CC1CCCC(C1)(O)C#N MCULE-3826837366 [0,1,0,1,0,0|1,0,1]=4 2010 B10R1.485 CC1CCCC(C1)(O)CN MCULE-1845541401 [0,1,0,1,0,0|1,0,1]=4 2011 B10R1.485 CC1CCCC(C1)(O)CN MCULE-9637857562 [0,1,0,1,0,0|1,0,1]=4 2012 B10R1.10 CC1CCCC(O1)CC#N MCULE-2242192010 [0,1,0,1,0,0|0,0,2]=4 2013 B10R1.10 CCCC1CCCC(C1)O MCULE-6301598723 [0,1,0,1,0,0|0,0,2]=4 2014 B10R1.11 N#CCC(O)C1CCCC1 MCULE-5868086101 [0,1,0,1,0,0|0,0,2]=4 2015 B10R1.11 N#CC[C@H](O)C1CCCC1 MCULE-5419430208 [0,1,0,1,0,0|0,0,2]=4 2016 B10R1.11 N#CC[C@H](O)C1CCCC1 MCULE-9109438367 [0,1,0,1,0,0|0,0,2]=4 2017 B10R1.11 NCCC(O)C1CCCC1 MCULE-3312004577 [0,1,0,1,0,0|0,0,2]=4 2018 B10R1.19 C=CN1CCCCCC1=O MCULE-4648583346 [0,1,0,1,0,0|0,0,2]=4 2019 B10R1.19 CCC1CCCCCC1=O MCULE-8032779658 [0,1,0,1,0,0|2,0,0]=4 2020 B10R1.19 COC1CCCCCC1N MCULE-5223841003 [0,1,0,1,0,0|1,0,1]=4 2021 B10R1.19 N#CC1CCCCCC1=O MCULE-1907886746 [0,1,0,1,0,0|2,0,0]=4 2022 B10R1.19 NC1CCCCCC1CO MCULE-2803910179 [0,1,0,1,0,0|1,0,1]=4 2023 B10R1.19 O=C1CCCCCC1=C[O-] MCULE-4278440378 [0,1,0,1,0,0|0,0,2]=4 2024 B10R1.19 O=C1CCCCCC1=C[O-] MCULE-9636385402 [0,1,0,1,0,0|0,0,2]=4 2025 B10R1.19 O=C1CCCCCN1CO MCULE-8622356666 [0,1,0,1,0,0|2,0,0]=4 2026 B10R1.19 O=C1NCCCCC1CO MCULE-8501668247 [0,1,0,1,0,0|2,0,0]=4 2027 B10R1.19 O=CC1CCCCCC1Cl MCULE-2719076051 [0,1,0,1,0,0|1,0,1]=4 2028 B10R1.21 CCCCCC1=CC=CO1 MCULE-7495475438 [0,1,0,1,0,0|0,0,1]=3 2029 B10R1.21 CCCCCC1=CC=CS1 MCULE-5834588939 [0,1,0,1,0,0|0,1,1]=4 2030 B10R1.21 CCCCCC1=CSC=C1 MCULE-3765336287 [0,1,0,1,0,0|0,1,1]=4 2031 B10R1.21 CCCCCC1OCCO1 MCULE-1814222548 [0,1,0,1,0,0|0,0,2]=4 2032 B10R1.21 CCCCCN1C=CN=C1 MCULE-3700918778 [0,1,0,1,0,0|2,0,0]=4 2033 B10R1.21 CCCCCN1C=CN=N1 MCULE-3375923007 [0,1,0,1,0,0|2,0,0]=4 2034 B10R1.21 CCCNCC1=CC=CO1 MCULE-6122894463 [0,1,0,1,0,0|1,0,1]=4 2035 B10R1.21 CCCNCC1=CC=CO1 MCULE-8770938830 [0,1,0,1,0,0|1,0,1]=4 2036 B10R1.21 CNCCCC1=CC=CO1 MCULE-7583228791 [0,1,0,1,0,0|1,0,1]=4 2037 B10R1.24 CCCCCC1CC(=O)C1 MCULE-5494050284 [0,1,0,1,0,0|1,0,1]=4 2038 B10R1.25 CCC1CCC(CC1=O)C MCULE-6201444288 [0,1,0,1,0,0|1,0,1]=4 2039 B10R1.85 C=CCC1CCCCCC1 MCULE-7344516120 [0,1,0,1,0,0|1,0,0]=3 2040 B10R1.85 O=CCC1CCCCCC1 MCULE-6382907203 [0,1,0,1,0,0|1,0,1]=4 2041 B10R1.130 CCCN1C[C@H](CC1=O)O MCULE-6013783989 [0,1,0,1,0,0|1,0,1]=4 2042 B10R1.245 CC1CCCC(N1C=O)C MCULE-1960868095 [0,1,0,1,0,0|2,0,0]=4 2043 B10R1.377 C#CCC1(CCCCC1)O MCULE-2973576344 [0,1,0,1,0,0|0,0,2]=4 2044 B10R1.377 C=CCC1(CCCCC1)N MCULE-1008545775 [0,1,0,1,0,0|1,0,0]=3 2045 B10R1.377 C=CCC1(CCCCC1)O MCULE-2678449677 [0,1,0,1,0,0|0,0,0]=2 2046 B10R1.377 C=CCC1(CCNCC1)O MCULE-8976091742 [0,1,0,1,0,0|1,0,0]=3 2047 B10R1.377 C=CCC1(CCNCC1)O MCULE-9090307677 [0,1,0,1,0,0|1,0,0]=3 2048 B10R1.377 C=CCC1(CCOCC1)N MCULE-4847163192 [0,1,0,1,0,0|2,0,0]=4 2049 B10R1.377 C=CCC1(CCOCC1)O MCULE-1138503019 [0,1,0,1,0,0|1,0,0]=3 2050 B10R1.377 CC#CC1(CCCCC1)O MCULE-7831350385 [0,1,0,1,0,0|0,0,2]=4 2051 B10R1.377 CCCC1(CCCCC1)O MCULE-7596295635 [0,1,0,1,0,0|0,0,2]=4 2052 B10R1.377 NCCC1(CCCCC1)O MCULE-2073176555 [0,1,0,1,0,0|0,0,2]=4 2053 B10R1.377 NCCC1(CCCCC1)O MCULE-3543989277 [0,1,0,1,0,0|0,0,2]=4 2054 B10R1.377 O=CCC1(CCOCC1)O MCULE-1529294494 [0,1,0,1,0,0|1,0,1]=4 2055 B10R1.377 OC1(CCCCC1)C#CBr MCULE-3496500170 [0,1,0,1,0,0|0,0,2]=4 2056 B10R1.377 OCCC1(CCCCC1)O MCULE-1396342033 [0,1,0,1,0,0|0,0,2]=4 2057 B10R1.7 CC1CCCCCCC1=O MCULE-5002473983 [0,1,0,1,0,0|1,0,1]=4 2058 B10R1.7 NC1CCCCCCC1O MCULE-9142911119 [0,1,0,1,0,0|0,0,2]=4 2059 B10R1.7 N[C@@H]1CCCCCC[C@@H]1O MCULE-1728493798 [0,1,0,1,0,0|0,0,2]=4 2060 B10R1.7 N[C@@H]1CCCCCC[C@H]1O MCULE-8702565765 [0,1,0,1,0,0|0,0,2]=4 2061 B10R1.7 N[C@H]1CCCCCC[C@@H]1O MCULE-4894585058 [0,1,0,1,0,0|0,0,2]=4 2062 B10R1.7 N[C@H]1CCCCCC[C@H]1O MCULE-3214389652 [0,1,0,1,0,0|0,0,2]=4 2063 B10R1.7 O=C1CCCCCC=C1F MCULE-8826870713 [0,1,0,1,0,0|0,0,2]=4 2064 B10R1.7 O=C1NCCCCCC1I MCULE-6621175147 [0,1,0,1,0,0|2,0,0]=4 2065 B10R1.7 OC1CCCCCCC1O MCULE-4573160076 [0,1,0,1,0,0|0,0,2]=4 2066 B10R1.7 O[C@H]1CCCCCC[C@H]1O MCULE-3578348851 [0,1,0,1,0,0|0,0,2]=4 2067 B10R1.15 C#CC(O)C1CCCCC1 MCULE-1450923869 [0,1,0,1,0,0|0,0,2]=4 2068 B10R1.15 C=CC(=O)C1CCCCC1 MCULE-2668727628 [0,1,0,1,0,0|0,0,2]=4 2069 B10R1.15 C=CC(=O)N1CCCCC1 MCULE-4232061367 [0,1,0,1,0,0|0,0,2]=4 2070 B10R1.15 C=CC(N)C1CCOCC1 MCULE-5582342577 [0,1,0,1,0,0|1,0,0]=3 2071 B10R1.15 C=CC(O)C1CCCCC1 MCULE-4108928861 [0,1,0,1,0,0|0,0,0]=2 2072 B10R1.15 CC(C=O)C1CCCCC1 MCULE-8646762788 [0,1,0,1,0,0|2,0,0]=4 2073 B10R1.15 CCC(O)C1CCCCC1 MCULE-2881249865 [0,1,0,1,0,0|0,0,2]=4 2074 B10R1.15 CCC(O)C1CCCCN1 MCULE-7730134295 [0,1,0,1,0,0|0,0,2]=4 2075 B10R1.15 CCC(O)C1CCNCC1 MCULE-6028347565 [0,1,0,1,0,0|0,0,2]=4 2076 B10R1.15 CCC(O)C1CCOCC1 MCULE-5455110043 [0,1,0,1,0,0|0,0,2]=4 2077 B10R1.15 CC[C@@H](O)[C@@H]1CCCCN1 MCULE-5363275416 [0,1,0,1,0,0|0,0,2]=4 2078 B10R1.15 N#CC(O)C1CCCCC1 MCULE-2814689309 [0,1,0,1,0,0|1,0,1]=4 2079 B10R1.15 NCC(O)C1CCCCC1 MCULE-7199366772 [0,1,0,1,0,0|1,0,1]=4 2080 B10R1.15 NCC(O)C1CCCCC1 MCULE-8529609856 [0,1,0,1,0,0|1,0,1]=4 2081 B10R1.15 NCC(O)C1CCOCC1 MCULE-6676500413 [0,1,0,1,0,0|1,0,1]=4 2082 B10R1.15 NCC(O)C1CCOCC1 MCULE-7393315444 [0,1,0,1,0,0|1,0,1]=4 2083 B10R1.15 OC(CBr)C1CCCCC1 MCULE-4672715356 [0,1,0,1,0,0|1,0,1]=4 2084 B10R1.15 OC(CCl)C1CCCCC1 MCULE-2813494650 [0,1,0,1,0,0|1,0,1]=4 2085 B10R1.15 OC(CF)C1CCCCC1 MCULE-2558300635 [0,1,0,1,0,0|1,0,1]=4 2086 B10R1.15 OC(CI)C1CCCCC1 MCULE-8401899170 [0,1,0,1,0,0|1,0,1]=4 2087 B10R1.15 OCC(O)C1CCCCN1 MCULE-6655190494 [0,1,0,1,0,0|1,0,1]=4 2088 B10R1.15 OCC(O)C1CCCCO1 MCULE-2204525592 [0,1,0,1,0,0|1,0,1]=4 2089 B10R1.15 OCC(O)C1CCNCC1 MCULE-1554215254 [0,1,0,1,0,0|1,0,1]=4 2090 B10R1.15 OCC(O)C1CCNCC1 MCULE-4689262741 [0,1,0,1,0,0|1,0,1]=4 2091 B10R1.15 OC[C@@H](O)C1CCNCC1 MCULE-9617632132 [0,1,0,1,0,0|1,0,1]=4 2092 B10R1.119 CC1CCC(C(C1=O)C)C MCULE-4588148046 [0,1,0,1,0,0|2,0,0]=4 2093 B10R1.119 CC1CCC(C(C1C)O)C MCULE-7881553516 [0,1,0,1,0,0|0,0,2]=4 2094 B10R1.176 C=CC1CCC(C(C1)O)N MCULE-4070893267 [0,1,0,1,0,0|2,0,0]=4 2095 B10R1.230 C#C[C@@]1(CCCC[C@@H]1N)O MCULE-2980219862 [0,1,0,1,0,0|0,0,2]=4 2096 B10R1.230 CC1CCCCC1(O)C#N MCULE-3047697353 [0,1,0,1,0,0|1,0,1]=4 2097 B10R1.230 CC1CCCCC1(O)CN MCULE-2093676567 [0,1,0,1,0,0|1,0,1]=4 2098 B10R1.230 CC1CCCCC1(O)CO MCULE-4407995674 [0,1,0,1,0,0|1,0,1]=4 2099 B10R1.275 CC1CCCCN(C1=O)C MCULE-9029797301 [0,1,0,1,0,0|2,0,0]=4 2100 B10R1.275 CN1CCCCC(C1=O)N MCULE-1128026770 [0,1,0,1,0,0|2,0,0]=4 2101 B10R1.275 CN1CCCCC(C1=O)N MCULE-5720348878 [0,1,0,1,0,0|2,0,0]=4 2102 B10R1.275 CN1CCCC[C@@H](C1=O)N MCULE-2695124435 [0,1,0,1,0,0|2,0,0]=4 2103 B10R1.275 CN1CCCC[C@@H](C1=O)N MCULE-5087189943 [0,1,0,1,0,0|2,0,0]=4 2104 B10R1.275 CN1CCCC[C@@H](C1=O)N MCULE-8004795447 [0,1,0,1,0,0|2,0,0]=4 2105 B10R1.275 CN1CCCC[C@@H](C1=O)N MCULE-8596695391 [0,1,0,1,0,0|2,0,0]=4 2106 B10R1.275 CN1CCCC[C@H](C1=O)N MCULE-3422308826 [0,1,0,1,0,0|2,0,0]=4 2107 B10R1.275 CN1CCCC[C@H](C1=O)N MCULE-6992352501 [0,1,0,1,0,0|2,0,0]=4 2108 B10R1.275 N[C@@H]1CCCC[C@H]([C@@H]1O)O MCULE-8809733803 [0,1,0,1,0,0|1,0,1]=4 2109 B10R1.411 N#CC(O)C1(CCCC1)F MCULE-9665363445 [0,1,0,1,0,0|1,0,1]=4 2110 B10R1.6 C=CS(=O)(=O)C1CCCC1 MCULE-9842024283 [0,1,0,1,0,0|1,0,1]=4 2111 B10R1.232 C#CC1(CCCCCC1)O MCULE-3463068322 [0,1,0,1,0,0|0,0,2]=4 2112 B10R1.232 CC1(CCCCCC1)C=O MCULE-5506985890 [0,1,0,1,0,0|2,0,0]=4 2113 B10R1.232 NCC1(CCCCCC1)O MCULE-3327612117 [0,1,0,1,0,0|1,0,1]=4 2114 B10R1.232 NCC1(CCCCCC1)O MCULE-6301223397 [0,1,0,1,0,0|1,0,1]=4 2115 B10R1.232 OC1(CCCCNC1)CF MCULE-4844300242 [0,1,0,1,0,0|1,0,1]=4 2116 B10R1.232 OC1(CCCCNC1)CF MCULE-5282987199 [0,1,0,1,0,0|1,0,1]=4 2117 B10R1.232 OC1(CCCNCC1)CF MCULE-2837000697 [0,1,0,1,0,0|1,0,1]=4 2118 B10R1.232 OC1(CCCNCC1)CF MCULE-6932830843 [0,1,0,1,0,0|1,0,1]=4 2119 B10R1.232 OCC1(CCCCCC1)O MCULE-9814612692 [0,1,0,1,0,0|1,0,1]=4 2120 B10R1.232 OCC1(CCCNCC1)O MCULE-3461379297 [0,1,0,1,0,0|1,0,1]=4 2121 B10R1.232 OCC1(CCCNCC1)O MCULE-5976611841 [0,1,0,1,0,0|1,0,1]=4 2122 B10R1.300 O=C1CCCCCC1(F)F MCULE-2460590566 [0,1,0,1,0,0|2,0,0]=4 2123 B10R1.521 CCC1(CCC(O1)CN)C MCULE-5734842976 [0,1,0,1,0,0|1,0,1]=4 2124 B10R1.3 C=CC1CCC(OC1)C=C MCULE-7834588459 [0,1,0,1,0,0|0,0,2]=4 2125 B10R1.3 C=C[C@H]1CC[C@@H](CC1)CC MCULE-7218088471 [0,1,0,1,0,0|1,0,0]=3 2126 B10R1.3 CCC1CCC(CC1)C=O MCULE-3949790436 [0,1,0,1,0,0|2,0,0]=4 2127 B10R1.3 CCC1CCC(CC1)CO MCULE-5789758945 [0,1,0,1,0,0|0,0,2]=4 2128 B10R1.3 CC[C@H]1CC[C@@H](CC1)C=O MCULE-2034914930 [0,1,0,1,0,0|2,0,0]=4 2129 B10R1.3 CC[C@H]1CC[C@@H](CC1)CO MCULE-3116112684 [0,1,0,1,0,0|0,0,2]=4 2130 B10R1.473 C=CC1(CCC(CC1)C)O MCULE-3946402880 [0,1,0,1,0,0|0,0,0]=2 2131 B10R1.473 CC1CCC(CC1)(C)C=O MCULE-8964888241 [0,1,0,1,0,0|2,0,0]=4 2132 B10R1.473 CC1CCC(CC1)(O)CN MCULE-1027868134 [0,1,0,1,0,0|1,0,1]=4 2133 B10R1.473 CC1CCC(CC1)(O)CO MCULE-5883222689 [0,1,0,1,0,0|1,0,1]=4 2134 B10R1.473 CCC1(C=CC(=O)CC1)C MCULE-2068467338 [0,1,0,1,0,0|0,0,2]=4 2135 B10R1.473 CCC1(CCC(CC1)N)O MCULE-4977817727 [0,1,0,1,0,0|0,0,2]=4 2136 B10R1.473 N#CC1(CCC(CC1)N)O MCULE-4843020155 [0,1,0,1,0,0|1,0,1]=4 2137 B10R1.473 NC1CCC(CC1)(O)CO MCULE-1185705520 [0,1,0,1,0,0|1,0,1]=4 2138 B10R1.473 N[C@H]1CC[C@@](CC1)(O)CO MCULE-5157519451 [0,1,0,1,0,0|1,0,1]=4 2139 B10R1.473 N[C@H]1CC[C@](CC1)(O)CO MCULE-6622041735 [0,1,0,1,0,0|1,0,1]=4 2140 B10R1.8 CC1CC(CC(C1)C=O)C MCULE-8057927767 [0,1,0,1,0,0|2,0,0]=4 2141 B10R1.27 C=CC(=O)NC1CCCC1 MCULE-7763559152 [0,1,0,1,0,0|0,0,2]=4 2142 B10R1.27 CCC(O)CN1CCCC1 MCULE-5824673052 [0,1,0,1,0,0|0,0,2]=4 2143 B10R1.27 CCC(O)C[NH+]1CCCC1 MCULE-4433741385 [0,1,0,1,0,0|0,0,2]=4 2144 B10R1.27 NCC(O)CN1CCCC1 MCULE-9325741480 [0,1,0,1,0,0|1,0,1]=4 2145 B10R1.27 OCC(O)CN1CCCC1 MCULE-5801014059 [0,1,0,1,0,0|1,0,1]=4 2146 B10R1.149 C=CC(=O)N1CCCC1C MCULE-6296751053 [0,1,0,1,0,0|0,0,2]=4 2147 B10R1.1 CCCC1CCC(CC1)O MCULE-1063543963 [0,1,0,1,0,0|0,0,2]=4 2148 B10R1.1 CCC[C@H]1CC[C@@H](CC1)O MCULE-2982122695 [0,1,0,1,0,0|0,0,2]=4 2149 B10R1.1 NCCC1CCC(CC1)O MCULE-6058469002 [0,1,0,1,0,0|0,0,2]=4 2150 B10R1.1 OCCC1CCC(CC1)O MCULE-3760583629 [0,1,0,1,0,0|0,0,2]=4 2151 B10R1.2 CCN1CCCC(C1=O)Br MCULE-5639139354 [0,1,0,1,0,0|2,0,0]=4 2152 B10R1.2 CCN1CCCC(C1=O)N MCULE-2399653981 [0,1,0,1,0,0|2,0,0]=4 2153 B10R1.2 CCN1CCCC(C1=O)N MCULE-3889384741 [0,1,0,1,0,0|2,0,0]=4 2154 B10R1.2 CN1CCCC(C1=O)CO MCULE-5938378256 [0,1,0,1,0,0|2,0,0]=4 2155 B10R1.2 CN[C@@H]1CCC[C@H]([C@@H]1O)O MCULE-2638179747 [0,1,0,1,0,0|1,0,1]=4 2156 B10R1.16 CCCCN1C=CN(C1)C MCULE-2637268835 [0,1,0,1,0,0|2,0,0]=4 2157 B10R1.16 CCCCN1C=CN(C1)C MCULE-8018864347 [0,1,0,1,0,0|2,0,0]=4 2158 B10R1.16 [NH+]1(C=CN(C1)CCCC)C MCULE-5619277909 [0,1,0,1,0,0|2,0,0]=4 2159 B10R1.87 CCSC1CCC1(O)CN MCULE-5124446976 [0,1,0,1,0,0|1,0,1]=4 2160 B10R1.161 BrCC1OCCCCCO1 MCULE-3056414225 [0,1,0,1,0,0|1,0,1]=4 2161 B10R1.161 C=CC1CCCCCCC1 MCULE-4062427042 [0,1,0,1,0,0|1,0,0]=3 2162 B10R1.161 COC1=CCCCCCC1 MCULE-3500334234 [0,1,0,1,0,0|0,0,2]=4 2163 B10R1.161 COC1=CCCCCCC1 MCULE-4140921077 [0,1,0,1,0,0|0,0,2]=4 2164 B10R1.161 O=CC1CCCCCCC1 MCULE-6277104874 [0,1,0,1,0,0|2,0,0]=4 2165 B10R1.161 OCC1CCCCCCC1 MCULE-1512335429 [0,1,0,1,0,0|0,0,2]=4 2166 B10R1.172 CCC1CC(CCO1)C=O MCULE-9356610887 [0,1,0,1,0,0|2,0,0]=4 2167 B10R1.172 CCC1CCCC(C1)C=O MCULE-4357346988 [0,1,0,1,0,0|2,0,0]=4 2168 B10R1.172 CCC1CNCC(O1)CC MCULE-5035089082 [0,1,0,1,0,0|0,0,2]=4 2169 B10R1.172 CCN1CCCC(C1)C=O MCULE-1064231674 [0,1,0,1,0,0|2,0,0]=4 2170 B10R1.172 CCN1CCCC(C1)C=O MCULE-4278474818 [0,1,0,1,0,0|2,0,0]=4 2171 B10R1.23 CC(C(=O)O)C1CCCC1 MCULE-5802736245 [0,1,0,1,0,0|2,0,0]=4 2172 B10R1.23 NC(=O)C(F)C1CCCC1 MCULE-2132325699 [0,1,0,1,0,0|2,0,0]=4 2173 B10R1.23 NC(=O)C(N)C1CCCC1 MCULE-5304987336 [0,1,0,1,0,0|2,0,0]=4 2174 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-7146175523 [0,1,0,1,0,0|2,0,0]=4 2175 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-7746486136 [0,1,0,1,0,0|2,0,0]=4 2176 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-9888348666 [0,1,0,1,0,0|2,0,0]=4 2177 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 MCULE-2078695461 [0,1,0,1,0,0|2,0,0]=4 2178 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 MCULE-7548517913 [0,1,0,1,0,0|2,0,0]=4 2179 B10R1.23 N[C@H](C(=O)O)C1CCCC1 MCULE-1391706498 [0,1,0,1,0,0|2,0,0]=4 2180 B10R1.23 N[C@H](C(=O)O)C1CCCC1 MCULE-5447481000 [0,1,0,1,0,0|2,0,0]=4 2181 B10R1.23 O=C(O)C(Br)C1CCCC1 MCULE-1051918450 [0,1,0,1,0,0|2,0,0]=4 2182 B10R1.23 O=C(O)C(F)C1CCCC1 MCULE-8637303916 [0,1,0,1,0,0|2,0,0]=4 2183 B10R1.23 O=C(O)C(O)C1CCCC1 MCULE-1471598195 [0,1,0,1,0,0|1,0,0]=3 2184 B10R1.23 O=C(O)C(O)C1CCNC1 MCULE-8304713060 [0,1,0,1,0,0|2,0,0]=4 2185 B10R1.23 O=C(O)[C@@H](Br)C1CCCC1 MCULE-6560406332 [0,1,0,1,0,0|2,0,0]=4 2186 B10R1.23 O=C(O)[C@H](O)C1CCCC1 MCULE-1883242923 [0,1,0,1,0,0|1,0,0]=3 2187 B10R1.93 CCCC1CC(C1)C(=O)O MCULE-7182602664 [0,1,0,1,0,0|2,0,0]=4 2188 B10R1.113 CC1CCCC(C1)C(=O)O MCULE-1709216331 [0,1,0,1,0,0|2,0,0]=4 2189 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-2752928027 [0,1,0,1,0,0|2,0,0]=4 2190 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7361502591 [0,1,0,1,0,0|2,0,0]=4 2191 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7906995060 [0,1,0,1,0,0|2,0,0]=4 2192 B10R1.113 CC1CCCC(O1)C(=O)O MCULE-2545962496 [0,1,0,1,0,0|1,0,0]=3 2193 B10R1.113 CC1CNCC(O1)C(=O)N MCULE-4373996098 [0,1,0,1,0,0|2,0,0]=4 2194 B10R1.113 CC1CNCC(O1)C(=O)O MCULE-4851002529 [0,1,0,1,0,0|2,0,0]=4 2195 B10R1.113 C[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-4534640450 [0,1,0,1,0,0|2,0,0]=4 2196 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6827473516 [0,1,0,1,0,0|2,0,0]=4 2197 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6916060172 [0,1,0,1,0,0|2,0,0]=4 2198 B10R1.113 C[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2658835025 [0,1,0,1,0,0|2,0,0]=4 2199 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-1640808929 [0,1,0,1,0,0|2,0,0]=4 2200 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-5152957457 [0,1,0,1,0,0|2,0,0]=4 2201 B10R1.113 C[C@H]1CCC[C@@H](C1)C(=O)O MCULE-2151963828 [0,1,0,1,0,0|2,0,0]=4 2202 B10R1.113 C[C@H]1CCC[C@H](C1)C(=O)O MCULE-9191189376 [0,1,0,1,0,0|2,0,0]=4 2203 B10R1.113 [C@@H]1(CCCC(N1)C)C(=O)O MCULE-7930307305 [0,1,0,1,0,0|2,0,0]=4 2204 B10R1.144 CCCCC1CC1C(=O)O MCULE-5737299312 [0,1,0,1,0,0|2,0,0]=4 2205 B10R1.204 CC(CC1CCC1)C(=O)O MCULE-9404107634 [0,1,0,1,0,0|2,0,0]=4 2206 B10R1.204 NC(=O)C(F)CC1CCC1 MCULE-6493382532 [0,1,0,1,0,0|2,0,0]=4 2207 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-3218968630 [0,1,0,1,0,0|2,0,0]=4 2208 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-4504908507 [0,1,0,1,0,0|2,0,0]=4 2209 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-9377321223 [0,1,0,1,0,0|2,0,0]=4 2210 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-1216111783 [0,1,0,1,0,0|2,0,0]=4 2211 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-5390134859 [0,1,0,1,0,0|2,0,0]=4 2212 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-5493935992 [0,1,0,1,0,0|2,0,0]=4 2213 B10R1.204 N[C@H](CC1CCC1)C(=O)O MCULE-3225528393 [0,1,0,1,0,0|2,0,0]=4 2214 B10R1.204 N[C@H](CC1CCC1)C(=O)O MCULE-7473428983 [0,1,0,1,0,0|2,0,0]=4 2215 B10R1.204 O=C(O)C(F)CC1CCC1 MCULE-4701098034 [0,1,0,1,0,0|2,0,0]=4 2216 B10R1.204 O=C(O)[C@H](O)CC1CCC1 MCULE-8975040339 [0,1,0,1,0,0|1,0,0]=3 2217 B10R1.291 CC1CCCC1(C)C(=O)O MCULE-3149463709 [0,1,0,1,0,0|2,0,0]=4 2218 B10R1.348 CC(=O)C1CCCCCC1 MCULE-9324503120 [0,1,0,1,0,0|1,0,1]=4 2219 B10R1.348 N=C(N)C1CCCCCC1 MCULE-2361950713 [0,1,0,1,0,0|2,0,0]=4 2220 B10R1.348 N=C(N)C1CCCCCC1 MCULE-8756683037 [0,1,0,1,0,0|2,0,0]=4 2221 B10R1.348 NC(=O)C1CCCCCC1 MCULE-2005648941 [0,1,0,1,0,0|2,0,0]=4 2222 B10R1.348 O=C(Cl)C1CCCCCC1 MCULE-4659434885 [0,1,0,1,0,0|2,0,0]=4 2223 B10R1.348 O=C(O)C1CCCCCC1 MCULE-7903672891 [0,1,0,1,0,0|2,0,0]=4 2224 B10R1.348 O=C(O)C1CCCCCN1 MCULE-2741684183 [0,1,0,1,0,0|2,0,0]=4 2225 B10R1.348 O=C(O)C1CCCCCN1 MCULE-7374703751 [0,1,0,1,0,0|2,0,0]=4 2226 B10R1.348 O=C(O)C1CNCCCO1 MCULE-2282415374 [0,1,0,1,0,0|2,0,0]=4 2227 B10R1.348 O=C(O)C1CNCCCO1 MCULE-3064687044 [0,1,0,1,0,0|2,0,0]=4 2228 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2016813857 [0,1,0,1,0,0|2,0,0]=4 2229 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2504826586 [0,1,0,1,0,0|2,0,0]=4 2230 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-4939523441 [0,1,0,1,0,0|2,0,0]=4 2231 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-8497154031 [0,1,0,1,0,0|2,0,0]=4 2232 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-1709248067 [0,1,0,1,0,0|2,0,0]=4 2233 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4607599990 [0,1,0,1,0,0|2,0,0]=4 2234 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4947785395 [0,1,0,1,0,0|2,0,0]=4 2235 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-8502245212 [0,1,0,1,0,0|2,0,0]=4 2236 B10R1.363 CC(=O)C1(CCCCC1)Br MCULE-1087745376 [0,1,0,1,0,0|1,0,1]=4 2237 B10R1.363 CC(=O)C1(CCCCC1)C MCULE-2400194377 [0,1,0,1,0,0|1,0,1]=4 2238 B10R1.363 CC(=O)C1(CCCCC1)N MCULE-2403671270 [0,1,0,1,0,0|1,0,1]=4 2239 B10R1.363 CC(=O)C1(CCCCC1)N MCULE-8220968252 [0,1,0,1,0,0|1,0,1]=4 2240 B10R1.363 CC(=O)C1(CCCCC1)O MCULE-8708554984 [0,1,0,1,0,0|0,0,1]=3 2241 B10R1.363 CC(=O)C1(CCOCC1)O MCULE-4174424855 [0,1,0,1,0,0|1,0,1]=4 2242 B10R1.363 CC(C)C1(CCCCC1)O MCULE-6735024950 [0,1,0,1,0,0|0,0,2]=4 2243 B10R1.363 CC(N)C1(CCCCC1)O MCULE-4221086714 [0,1,0,1,0,0|0,0,2]=4 2244 B10R1.363 CC(N)C1(CCCCC1)O MCULE-8650737353 [0,1,0,1,0,0|0,0,2]=4 2245 B10R1.363 CC1(CCCCC1)C(=O)Cl MCULE-2304699201 [0,1,0,1,0,0|2,0,0]=4 2246 B10R1.363 CC1(CCCCC1)C(=O)N MCULE-2748976288 [0,1,0,1,0,0|2,0,0]=4 2247 B10R1.363 CC1(CCCCC1)C(=O)O MCULE-8617368211 [0,1,0,1,0,0|2,0,0]=4 2248 B10R1.363 N=C(N)C1(CCCCC1)O MCULE-2241799409 [0,1,0,1,0,0|1,0,0]=3 2249 B10R1.363 N=C(N)C1(CCCCC1)O MCULE-4555567865 [0,1,0,1,0,0|1,0,0]=3 2250 B10R1.363 NC(=O)C1(CCCCC1)N MCULE-9213834644 [0,1,0,1,0,0|2,0,0]=4 2251 B10R1.363 NC(=O)C1(CCCCC1)O MCULE-9953817877 [0,1,0,1,0,0|1,0,0]=3 2252 B10R1.363 NC(=O)C1(CCCNC1)O MCULE-5624973083 [0,1,0,1,0,0|2,0,0]=4 2253 B10R1.363 NC(=O)C1(CCNCC1)O MCULE-1637528026 [0,1,0,1,0,0|2,0,0]=4 2254 B10R1.363 NC(=O)C1(CCNCC1)O MCULE-9426392755 [0,1,0,1,0,0|2,0,0]=4 2255 B10R1.363 NC(=O)C1(CCOCC1)O MCULE-6043002573 [0,1,0,1,0,0|2,0,0]=4 2256 B10R1.363 NC(=O)C1(CCSCC1)O MCULE-5322321936 [0,1,0,1,0,0|2,0,0]=4 2257 B10R1.363 NC1(CCCCC1)C(=O)O MCULE-9219404299 [0,1,0,1,0,0|2,0,0]=4 2258 B10R1.363 O=C(Cl)C1(CCCCC1)Br MCULE-3943135228 [0,1,0,1,0,0|2,0,0]=4 2259 B10R1.363 O=C(Cl)C1(CCCCC1)Cl MCULE-5594029874 [0,1,0,1,0,0|2,0,0]=4 2260 B10R1.363 O=C(O)C1(CCCCC1)Br MCULE-4457572618 [0,1,0,1,0,0|2,0,0]=4 2261 B10R1.363 O=C(O)C1(CCCCC1)Cl MCULE-9172453010 [0,1,0,1,0,0|2,0,0]=4 2262 B10R1.363 O=C(O)C1(CCCCC1)F MCULE-6566089811 [0,1,0,1,0,0|2,0,0]=4 2263 B10R1.363 O=C(O)C1(CCCCC1)O MCULE-8504861268 [0,1,0,1,0,0|1,0,0]=3 2264 B10R1.363 O=C(O)C1(CCCNC1)O MCULE-4880129058 [0,1,0,1,0,0|2,0,0]=4 2265 B10R1.363 O=C(O)C1(CCCNC1)O MCULE-9960592206 [0,1,0,1,0,0|2,0,0]=4 2266 B10R1.363 O=C(O)C1(CCNCC1)O MCULE-4619147711 [0,1,0,1,0,0|2,0,0]=4 2267 B10R1.363 O=C(O)C1(CCNCC1)O MCULE-6538244346 [0,1,0,1,0,0|2,0,0]=4 2268 B10R1.363 O=C(O)C1(CCOCC1)O MCULE-4186201239 [0,1,0,1,0,0|2,0,0]=4 2269 B10R1.363 O=C(O)C1(CCSCC1)O MCULE-8230713014 [0,1,0,1,0,0|2,0,0]=4 2270 B10R1.363 [NH3+]C1(CCCCC1)C(=O)O MCULE-1248384499 [0,1,0,1,0,0|2,0,0]=4 2271 B10R1.9 COC(C=O)C1CCCC1 MCULE-2957450469 [0,1,0,1,0,0|1,0,0]=3 2272 B10R1.9 COC(C=O)C1CCOC1 MCULE-9045645266 [0,1,0,1,0,0|2,0,0]=4 2273 B10R1.9 COC(CBr)C1CCCC1 MCULE-5832580134 [0,1,0,1,0,0|1,0,1]=4 2274 B10R1.9 COC(CN)C1CCCC1 MCULE-8927349422 [0,1,0,1,0,0|1,0,1]=4 2275 B10R1.9 COC(CO)C1CCCC1 MCULE-1333315830 [0,1,0,1,0,0|1,0,1]=4 2276 B10R1.9 NOC(CO)C1CCCC1 MCULE-5965593371 [0,1,0,1,0,0|1,0,1]=4 2277 B10R1.9 NOC(CO)C1CCCC1 MCULE-6887805453 [0,1,0,1,0,0|1,0,1]=4 2278 B10R1.9 OCC(CO)C1CCCC1 MCULE-7383068892 [0,1,0,1,0,0|1,0,1]=4 2279 B10R1.122 NCC(CO)CC1CCC1 MCULE-3214783368 [0,1,0,1,0,0|1,0,1]=4 2280 B10R1.122 NCC(CO)CC1CCC1 MCULE-4807560098 [0,1,0,1,0,0|1,0,1]=4 2281 B10R1.258 C=CN1CCC(C1=O)CC MCULE-2259497811 [0,1,0,1,0,0|1,0,1]=4 2282 B10R1.487 C#CC1(CCCCC1)OC MCULE-5811239952 [0,1,0,1,0,0|0,0,2]=4 2283 B10R1.487 C=CC1(CCOCC1)OC MCULE-6818745874 [0,1,0,1,0,0|1,0,0]=3 2284 B10R1.487 CNC1(CCCCC1)CO MCULE-2878521476 [0,1,0,1,0,0|1,0,1]=4 2285 B10R1.487 CNC1(CCCCC1)CO MCULE-7291157208 [0,1,0,1,0,0|1,0,1]=4 2286 B10R1.487 COC1(CCCCC1)C#N MCULE-5623812669 [0,1,0,1,0,0|1,0,1]=4 2287 B10R1.487 COC1(CCCCC1)C=O MCULE-3270143141 [0,1,0,1,0,0|1,0,0]=3 2288 B10R1.487 COC1(CCCCC1)CN MCULE-6817153076 [0,1,0,1,0,0|1,0,1]=4 2289 B10R1.487 COC1(CCCCC1)CN MCULE-8837640864 [0,1,0,1,0,0|1,0,1]=4 2290 B10R1.487 COC1(CCCCC1)CO MCULE-5194988278 [0,1,0,1,0,0|1,0,1]=4 2291 B10R1.487 COC1(CCCCC1)OC MCULE-3730731071 [0,1,0,1,0,0|1,0,1]=4 2292 B10R1.487 COC1(CCOCC1)C=O MCULE-4311342455 [0,1,0,1,0,0|2,0,0]=4 2293 B10R1.487 N#CC1(CCCCC1)CO MCULE-3295676775 [0,1,0,1,0,0|1,0,1]=4 2294 B10R1.487 NCC1(CCCCC1)CO MCULE-2307493796 [0,1,0,1,0,0|1,0,1]=4 2295 B10R1.487 NCC1(CCCCC1)CO MCULE-6025330717 [0,1,0,1,0,0|1,0,1]=4 2296 B10R1.487 OCC1(CCCCC1)CO MCULE-3643412268 [0,1,0,1,0,0|1,0,1]=4 2297 B10R2.62 NC1CC2C=CC1CC2 MCULE-3806601124 [0,0,0,2,0,0|2,0,0]=4 2298 B10R2.62 NC1CC2C=CC1CC2 MCULE-6974918354 [0,0,0,2,0,0|2,0,0]=4 2299 B10R2.109 C=CC1CCC2OC2C1 MCULE-9878873681 [0,0,0,2,0,0|2,0,0]=4 2300 B10R2.109 O=CC1CCC2CC2C1 MCULE-6480805511 [0,0,0,2,0,0|2,0,0]=4 2301 B10R2.178 O=C1CCC2CCC1C2 MCULE-9878559019 [0,0,0,2,0,0|2,0,0]=4 2302 B10R2.178 O=C1CCC2CCC1N2 MCULE-6973216208 [0,0,0,2,0,0|2,0,0]=4 2303 B10R2.178 O=C1CCC2CCC1N2 MCULE-8820198645 [0,0,0,2,0,0|2,0,0]=4 2304 B10R2.178 O=C1CCC2CCC1O2 MCULE-3236338675 [0,0,0,2,0,0|1,0,0]=3 2305 B10R2.178 O=C1CCC2COC1O2 MCULE-8791862906 [0,0,0,2,0,0|2,0,0]=4 2306 B10R2.178 O=C1CCC2CO[C@@H]1O2 MCULE-2142238590 [0,0,0,2,0,0|2,0,0]=4 2307 B10R2.178 O=C1CC[C@H]2CO[C@@H]1O2 MCULE-9827917652 [0,0,0,2,0,0|2,0,0]=4 2308 B10R2.178 O=C1NCC2CCC1O2 MCULE-2784769464 [0,0,0,2,0,0|2,0,0]=4 2309 B10R2.178 O=C1NC[C@@H]2CC[C@H]1O2 MCULE-2850895205 [0,0,0,2,0,0|2,0,0]=4 2310 B10R2.178 OC1C=CC2COC1O2 MCULE-5084399615 [0,0,0,2,0,0|2,0,0]=4 2311 B10R2.178 OC1C=CC2OCC1O2 MCULE-6219816877 [0,0,0,2,0,0|2,0,0]=4 2312 B10R2.178 OC1CCC2CCC1N2 MCULE-1746954108 [0,0,0,2,0,0|1,0,1]=4 2313 B10R2.178 OC1CCC2CCC1N2 MCULE-5286805851 [0,0,0,2,0,0|1,0,1]=4 2314 B10R2.178 O[C@@H]1CC[C@@H]2CC[C@H]1N2 MCULE-4019321438 [0,0,0,2,0,0|1,0,1]=4 2315 B10R2.178 O[C@@H]1CC[C@@H]2CC[C@H]1N2 MCULE-6224878276 [0,0,0,2,0,0|1,0,1]=4 2316 B10R2.178 O[C@@H]1CC[C@@H]2CC[C@H]1N2 MCULE-8339657915 [0,0,0,2,0,0|1,0,1]=4 2317 B10R2.178 O[C@H]1CC[C@@H]2CC[C@H]1N2 MCULE-1282324762 [0,0,0,2,0,0|1,0,1]=4 2318 B10R2.178 O[C@H]1CC[C@@H]2CC[C@H]1N2 MCULE-9900676249 [0,0,0,2,0,0|1,0,1]=4 2319 B10R2.178 S=C1NCC2CCC1O2 MCULE-5947261418 [0,0,0,2,0,0|2,0,0]=4 2320 B10R2.178 [C@@H]12CCC(=O)[C@@H](O1)OC2 MCULE-5951038094 [0,0,0,2,0,0|2,0,0]=4 2321 B10R2.178 [C@H]12C=C[C@@H]([C@H](O1)CO2)O MCULE-6225765520 [0,0,0,2,0,0|2,0,0]=4 2322 B10R2.178 [C@H]12CC[C@@H]([C@H](N1)CC2)O MCULE-7342289158 [0,0,0,2,0,0|1,0,1]=4 2323 B10R2.335 OC1CCC2(CC1)CC2 MCULE-2781418055 [0,0,0,2,0,0|0,0,2]=4 2324 B10R2.335 OC1CCC2(CC2)OC1 MCULE-2704283668 [0,0,0,2,0,0|1,0,1]=4 2325 B10R2.442 ICC12CCC(O1)CC2 MCULE-4964571907 [0,0,0,2,0,0|1,0,1]=4 2326 B10R2.442 NCC12CCC(O1)CC2 MCULE-8810376132 [0,0,0,2,0,0|1,0,1]=4 2327 B10R2.442 O=CC12CCC(C1)CC2 MCULE-1081241272 [0,0,0,2,0,0|2,0,0]=4 2328 B10R2.582 OC12CCC(CC1)CC2 MCULE-3503102236 [0,0,0,2,0,0|0,0,2]=4 2329 B10R2.61 O=C1CC2CCCC1C2 MCULE-9902349455 [0,0,0,2,0,0|2,0,0]=4 2330 B10R2.61 OC1CC2CCCC1N2 MCULE-3954082989 [0,0,0,2,0,0|1,0,1]=4 2331 B10R2.61 OC1CC2CCCC1N2 MCULE-7079809262 [0,0,0,2,0,0|1,0,1]=4 2332 B10R2.61 O[C@@H]1C[C@H]2CCC[C@@H]1N2 MCULE-2552895453 [0,0,0,2,0,0|1,0,1]=4 2333 B10R2.61 O[C@@H]1C[C@H]2CCC[C@@H]1N2 MCULE-4250815389 [0,0,0,2,0,0|1,0,1]=4 2334 B10R2.61 O[C@H]1C[C@H]2CCC[C@@H]1N2 MCULE-2822355852 [0,0,0,2,0,0|1,0,1]=4 2335 B10R2.61 O[C@H]1C[C@H]2CCC[C@@H]1N2 MCULE-4302363856 [0,0,0,2,0,0|1,0,1]=4 2336 B10R2.61 [C@@H]12CCC[C@@H](N1)C[C@@H]2O MCULE-1866289078 [0,0,0,2,0,0|1,0,1]=4 2337 B10R2.61 [C@@H]12CCC[C@@H](N1)C[C@@H]2O MCULE-9478811687 [0,0,0,2,0,0|1,0,1]=4 2338 B10R2.61 [C@@H]12CCC[C@@H](N1)C[C@H]2O MCULE-8012690560 [0,0,0,2,0,0|1,0,1]=4 2339 B10R2.61 [C@@H]12CCC[C@@H](N1)C[C@H]2O MCULE-8087701413 [0,0,0,2,0,0|1,0,1]=4 2340 B10R2.99 BrCC1CC2C=CC1C2 MCULE-3251237810 [0,0,0,2,0,0|2,0,0]=4 2341 B10R2.99 ClCC1CC2C=CC1C2 MCULE-4939198062 [0,0,0,2,0,0|2,0,0]=4 2342 B10R2.99 NCC1CC2C=CC1C2 MCULE-2924978391 [0,0,0,2,0,0|2,0,0]=4 2343 B10R2.99 NCC1CC2C=CC1C2 MCULE-4489709878 [0,0,0,2,0,0|2,0,0]=4 2344 B10R2.99 NCC1CC2C=CC1C2 MCULE-4608432032 [0,0,0,2,0,0|2,0,0]=4 2345 B10R2.99 NC[C@H]1C[C@@H]2C=C[C@H]1C2 MCULE-2991991523 [0,0,0,2,0,0|2,0,0]=4 2346 B10R2.99 NC[C@H]1C[C@@H]2C=C[C@H]1C2 MCULE-6491729535 [0,0,0,2,0,0|2,0,0]=4 2347 B10R2.99 O=CC1CC2CCC1C2 MCULE-8928073002 [0,0,0,2,0,0|2,0,0]=4 2348 B10R2.99 OCC1CC2C=CC1C2 MCULE-7675991244 [0,0,0,2,0,0|2,0,0]=4 2349 B10R2.99 [C@@H]12C=C[C@@H](C1)C(C2)CN MCULE-3553082177 [0,0,0,2,0,0|2,0,0]=4 2350 B10R2.99 [C@@H]12C=C[C@@H](C1)C(C2)CN MCULE-8881545790 [0,0,0,2,0,0|2,0,0]=4 2351 B10R2.99 [C@@H]12C=C[C@@H](C1)CC2CO MCULE-2508256894 [0,0,0,2,0,0|2,0,0]=4 2352 B10R2.99 [C@@H]12C=C[C@@H](C1)CC2CO MCULE-2886895067 [0,0,0,2,0,0|2,0,0]=4 2353 B10R2.99 [C@@H]12C=C[C@@H](C1)[C@H](C2)CN MCULE-3300649838 [0,0,0,2,0,0|2,0,0]=4 2354 B10R2.99 [C@@H]12C=C[C@@H](C1)[C@H](C2)CN MCULE-7624056437 [0,0,0,2,0,0|2,0,0]=4 2355 B10R2.408 C1CC2CNCC(C1)O2 MCULE-6150799471 [0,0,0,2,0,0|1,0,1]=4 2356 B10R2.408 C1CC2CNCC(C1)O2 MCULE-6878487900 [0,0,0,2,0,0|1,0,1]=4 2357 B10R2.408 [C@H]12CC=C[C@H](N1)CCC2 MCULE-5351766563 [0,0,0,2,0,0|1,0,0]=3 2358 B10R2.408 [C@H]12CC=C[C@H](N1)CCC2 MCULE-7206630873 [0,0,0,2,0,0|1,0,0]=3 2359 B10R2.25 C=C1C(=O)C2CCC1C2 MCULE-6446104918 [0,0,0,2,0,0|0,0,2]=4 2360 B10R2.25 O=C1C2CCC(C2)C1Cl MCULE-5605308647 [0,0,0,2,0,0|2,0,0]=4 2361 B10R2.25 [C@H]12CC[C@H](C1)C(=C)C2=O MCULE-3111478302 [0,0,0,2,0,0|0,0,2]=4 2362 B10R2.25 [C@H]12CC[C@H](C1)C(=C)C2=O MCULE-7597877958 [0,0,0,2,0,0|0,0,2]=4 2363 B10R2.25 [C@H]12CC[C@H](C1)C(C2=O)Cl MCULE-3759432797 [0,0,0,2,0,0|2,0,0]=4 2364 B10R2.41 O=C1C2CCCC1CC2 MCULE-4192176527 [0,0,0,2,0,0|2,0,0]=4 2365 B10R2.41 O=C1C2CNCC1OC2 MCULE-2670006476 [0,0,0,2,0,0|2,0,0]=4 2366 B10R2.41 O=C1C2CNCC1OC2 MCULE-4622916570 [0,0,0,2,0,0|2,0,0]=4 2367 B10R2.65 CC12CC1CCCC2=O MCULE-7187224935 [0,0,0,2,0,0|2,0,0]=4 2368 B10R2.14 OC1CNC(C1)C2CC2 MCULE-1983417153 [0,0,0,2,0,0|1,0,1]=4 2369 B10R2.14 OC1CNC(C1)C2CC2 MCULE-6477074344 [0,0,0,2,0,0|1,0,1]=4 2370 B10R2.32 OC1CCC2C1CCC2 MCULE-5911929358 [0,0,0,2,0,0|0,0,2]=4 2371 B10R2.32 O[C@@H]1CC[C@@H]2[C@H]1NCC2 MCULE-5080250769 [0,0,0,2,0,0|1,0,1]=4 2372 B10R2.32 O[C@@H]1CC[C@@H]2[C@H]1NCC2 MCULE-7790238150 [0,0,0,2,0,0|1,0,1]=4 2373 B10R2.138 C1CC2CCC(O2)CN1 MCULE-5862819983 [0,0,0,2,0,0|1,0,1]=4 2374 B10R2.138 C1CC2CCC(O2)CN1 MCULE-9819700345 [0,0,0,2,0,0|1,0,1]=4 2375 B10R2.3 OC1CCC12CCCC2 MCULE-4815915911 [0,0,0,2,0,0|0,0,2]=4 2376 B10R2.4 N#CC1OC12CCCC2 MCULE-4351922294 [0,0,0,2,0,0|1,0,1]=4 2377 B10R2.16 OC1(CC1)C2CCCC2 MCULE-3022112216 [0,0,0,2,0,0|0,0,2]=4 2378 B10R2.18 C1CCCC2OC2CC1 MCULE-7997439189 [0,0,0,2,0,0|0,0,2]=4 2379 B10R2.69 OC1CNCC2CC2C1 MCULE-2305349861 [0,0,0,2,0,0|1,0,1]=4 2380 B10R2.513 O=CC1C2C1CCCC2 MCULE-2761036353 [0,0,0,2,0,0|2,0,0]=4