0 B7R0.3 C#CC(O)CCCC MCULE-8547184224 [0,0,0,0,0,0|1,0,1]=2 1 B7R0.3 C#CCCC(O)CC MCULE-2969540863 [0,0,0,0,0,0|1,0,2]=3 2 B7R0.3 C#CCCC(O)CN MCULE-7845137108 [0,0,0,0,0,0|1,0,2]=3 3 B7R0.3 C#CCC[C@@H](N)CO MCULE-6761945465 [0,0,0,0,0,0|1,0,2]=3 4 B7R0.3 C#CCC[C@@H](N)CO MCULE-9589288760 [0,0,0,0,0,0|1,0,2]=3 5 B7R0.3 C#CCC[C@H](N)CO MCULE-5308019604 [0,0,0,0,0,0|1,0,2]=3 6 B7R0.3 C#CCC[C@H](N)CO MCULE-7191637286 [0,0,0,0,0,0|1,0,2]=3 7 B7R0.3 C#CCOC(C)CO MCULE-5112536028 [0,0,0,0,0,0|2,0,2]=4 8 B7R0.3 C=C(C=O)CCCC MCULE-4974026399 [0,0,0,0,0,0|1,0,3]=4 9 B7R0.3 C=C(CC)CCCC MCULE-5118701402 [0,0,0,0,0,0|2,0,1]=3 10 B7R0.3 C=CC(O)CCCC MCULE-1674668011 [0,0,0,0,0,0|1,0,1]=2 11 B7R0.3 C=CCCC(Br)CBr MCULE-1642355305 [0,0,0,0,0,0|2,0,2]=4 12 B7R0.3 C=CCCC(C)CN MCULE-2246705867 [0,0,0,0,0,0|2,0,2]=4 13 B7R0.3 C=CCCC(C)CN MCULE-5238030814 [0,0,0,0,0,0|2,0,2]=4 14 B7R0.3 C=CCCC(N)CC MCULE-4520234599 [0,0,0,0,0,0|2,0,2]=4 15 B7R0.3 C=CCCC(N)CC MCULE-9493759139 [0,0,0,0,0,0|2,0,2]=4 16 B7R0.3 C=CCCC(N)CN MCULE-3448579919 [0,0,0,0,0,0|2,0,2]=4 17 B7R0.3 C=CCCC(N)CO MCULE-2658614123 [0,0,0,0,0,0|1,0,2]=3 18 B7R0.3 C=CCCC(O)CC MCULE-1265881694 [0,0,0,0,0,0|1,0,2]=3 19 B7R0.3 C=CCCC(O)CCl MCULE-2554338674 [0,0,0,0,0,0|1,0,2]=3 20 B7R0.3 C=CCCC(O)CN MCULE-4695723420 [0,0,0,0,0,0|1,0,2]=3 21 B7R0.3 C=CCC[C@@H](O)CO MCULE-6352864696 [0,0,0,0,0,0|0,0,2]=2 22 B7R0.3 C=CCO[C@@H](C)CO MCULE-6699692288 [0,0,0,0,0,0|2,0,2]=4 23 B7R0.3 CC#CCC(N)CO MCULE-1082443924 [0,0,0,0,0,0|1,0,2]=3 24 B7R0.3 CC#CCC(O)CC MCULE-3474605709 [0,0,0,0,0,0|1,0,2]=3 25 B7R0.3 CC(CBr)OCCBr MCULE-2889401501 [0,0,0,0,0,0|4,0,0]=4 26 B7R0.3 CC(CCCO)NN MCULE-8201748999 [0,0,0,0,0,0|4,0,0]=4 27 B7R0.3 CC(CN)CCCN MCULE-1249275042 [0,0,0,0,0,0|3,0,0]=3 28 B7R0.3 CC(CN)CCCO MCULE-2908684674 [0,0,0,0,0,0|3,0,0]=3 29 B7R0.3 CC(CN)CCCO MCULE-5608783947 [0,0,0,0,0,0|3,0,0]=3 30 B7R0.3 CC(CN)CCCO MCULE-9269954426 [0,0,0,0,0,0|3,0,0]=3 31 B7R0.3 CC(CO)CCCO MCULE-8589885622 [0,0,0,0,0,0|2,0,0]=2 32 B7R0.3 CC(CO)NCCO MCULE-5180763491 [0,0,0,0,0,0|3,0,0]=3 33 B7R0.3 CC/C=C/C(C)CC MCULE-2438890702 [0,0,0,0,0,0|2,0,2]=4 34 B7R0.3 CC=CCC(C)CC MCULE-4817855750 [0,0,0,0,0,0|2,0,2]=4 35 B7R0.3 CCC(=O)CCCBr MCULE-3298679210 [0,0,0,0,0,0|2,0,2]=4 36 B7R0.3 CCC(=O)CCCCl MCULE-3397599793 [0,0,0,0,0,0|2,0,2]=4 37 B7R0.3 CCC(C)CCCO MCULE-2323419626 [0,0,0,0,0,0|3,0,0]=3 38 B7R0.3 CCC(C)NCCO MCULE-1340916666 [0,0,0,0,0,0|4,0,0]=4 39 B7R0.3 CCC(Cl)CCCCl MCULE-6770226574 [0,0,0,0,0,0|3,0,0]=3 40 B7R0.3 CCC(N)CCCO MCULE-3868205501 [0,0,0,0,0,0|3,0,0]=3 41 B7R0.3 CCC(N)CCOC MCULE-8279767210 [0,0,0,0,0,0|3,0,0]=3 42 B7R0.3 CCC(O)CCCN MCULE-1491163174 [0,0,0,0,0,0|2,0,0]=2 43 B7R0.3 CCC(O)CCCN MCULE-5150508895 [0,0,0,0,0,0|2,0,0]=2 44 B7R0.3 CCC(O)CCCO MCULE-1099760826 [0,0,0,0,0,0|2,0,0]=2 45 B7R0.3 CCC(O)CCOC MCULE-1245099360 [0,0,0,0,0,0|2,0,0]=2 46 B7R0.3 CCC(O)CN=N#N MCULE-2314271585 [0,0,0,0,0,0|4,0,0]=4 47 B7R0.3 CCC=CC(C)CC MCULE-8910467842 [0,0,0,0,0,0|2,0,2]=4 48 B7R0.3 CCCC/C(=N/O)/N MCULE-2186271962 [0,0,0,0,0,0|2,0,1]=3 49 B7R0.3 CCCC=C(C)CC MCULE-4699949699 [0,0,0,0,0,0|2,0,2]=4 50 B7R0.3 CCCCC(=N)OC MCULE-3917139857 [0,0,0,0,0,0|3,0,1]=4 51 B7R0.3 CCCCC(=N)OC MCULE-8394549097 [0,0,0,0,0,0|3,0,1]=4 52 B7R0.3 CCCCC(=NO)C MCULE-8239265636 [0,0,0,0,0,0|2,0,1]=3 53 B7R0.3 CCCCC(=O)CBr MCULE-5866288227 [0,0,0,0,0,0|1,0,2]=3 54 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [0,0,0,0,0,0|1,0,2]=3 55 B7R0.3 CCCCC(=O)CCl MCULE-9673190063 [0,0,0,0,0,0|1,0,2]=3 56 B7R0.3 CCCCC(=O)NC MCULE-6810865419 [0,0,0,0,0,0|2,0,2]=4 57 B7R0.3 CCCCC(=O)NN MCULE-9535710488 [0,0,0,0,0,0|2,0,2]=4 58 B7R0.3 CCCCC(=O)OC MCULE-8635651818 [0,0,0,0,0,0|2,0,2]=4 59 B7R0.3 CCCCC(Br)CBr MCULE-9142273359 [0,0,0,0,0,0|2,0,0]=2 60 B7R0.3 CCCCC(Br)CC MCULE-3813549657 [0,0,0,0,0,0|2,0,0]=2 61 B7R0.3 CCCCC(C)CC MCULE-9471981954 [0,0,0,0,0,0|2,0,0]=2 62 B7R0.3 CCCCC(C)NC MCULE-7492621121 [0,0,0,0,0,0|3,0,0]=3 63 B7R0.3 CCCCC(Cl)C#N MCULE-3338809987 [0,0,0,0,0,0|2,0,1]=3 64 B7R0.3 CCCCC(Cl)C=O MCULE-7474969991 [0,0,0,0,0,0|1,0,2]=3 65 B7R0.3 CCCCC(Cl)CCl MCULE-6681580076 [0,0,0,0,0,0|2,0,0]=2 66 B7R0.3 CCCCC(N)CC MCULE-1353863738 [0,0,0,0,0,0|2,0,0]=2 67 B7R0.3 CCCCC(N)CC MCULE-9870475040 [0,0,0,0,0,0|2,0,0]=2 68 B7R0.3 CCCCC(N)CN MCULE-2038464943 [0,0,0,0,0,0|2,0,0]=2 69 B7R0.3 CCCCC(N)CO MCULE-1874423109 [0,0,0,0,0,0|1,0,0]=1 70 B7R0.3 CCCCC(N)CO MCULE-2041767659 [0,0,0,0,0,0|1,0,0]=1 71 B7R0.3 CCCCC(N)CO MCULE-4533575851 [0,0,0,0,0,0|1,0,0]=1 72 B7R0.3 CCCCC(N)CO MCULE-7141990411 [0,0,0,0,0,0|1,0,0]=1 73 B7R0.3 CCCCC(O)CBr MCULE-8416535559 [0,0,0,0,0,0|1,0,0]=1 74 B7R0.3 CCCCC(O)CC MCULE-3912386534 [0,0,0,0,0,0|1,0,0]=1 75 B7R0.3 CCCCC(O)CN MCULE-1383380728 [0,0,0,0,0,0|1,0,0]=1 76 B7R0.3 CCCCC(O)CO MCULE-6903923961 [0,0,0,0,0,0|0,0,0]=0 77 B7R0.3 CCCCN(C)CC MCULE-7723007145 [0,0,0,0,0,0|3,0,0]=3 78 B7R0.3 CCCC[C@@H](N)CO MCULE-1379297850 [0,0,0,0,0,0|1,0,0]=1 79 B7R0.3 CCCC[C@@H](N)CO MCULE-5016786633 [0,0,0,0,0,0|1,0,0]=1 80 B7R0.3 CCCC[C@@H](N)CO MCULE-6669873658 [0,0,0,0,0,0|1,0,0]=1 81 B7R0.3 CCCC[C@@H](N)CO MCULE-6809294141 [0,0,0,0,0,0|1,0,0]=1 82 B7R0.3 CCCC[C@H](C)C=O MCULE-7821873587 [0,0,0,0,0,0|1,0,2]=3 83 B7R0.3 CCCC[C@H](N)CO MCULE-3277509271 [0,0,0,0,0,0|1,0,0]=1 84 B7R0.3 CCCC[C@H](N)CO MCULE-5867397890 [0,0,0,0,0,0|1,0,0]=1 85 B7R0.3 CCCNC(=O)CBr MCULE-3357000060 [0,0,0,0,0,0|2,0,2]=4 86 B7R0.3 CCCNC(=O)CCl MCULE-3171078913 [0,0,0,0,0,0|2,0,2]=4 87 B7R0.3 CCCNC(=O)CN MCULE-2964958967 [0,0,0,0,0,0|2,0,2]=4 88 B7R0.3 CCCNC(=O)CN MCULE-4880764199 [0,0,0,0,0,0|2,0,2]=4 89 B7R0.3 CCCNC(C)CC MCULE-8533643430 [0,0,0,0,0,0|3,0,0]=3 90 B7R0.3 CCCNC(C)CO MCULE-6575712324 [0,0,0,0,0,0|2,0,0]=2 91 B7R0.3 CCCOC(=O)CBr MCULE-9392658897 [0,0,0,0,0,0|2,0,2]=4 92 B7R0.3 CCCOC(=O)CC MCULE-2749425161 [0,0,0,0,0,0|2,0,2]=4 93 B7R0.3 CCCOC(=O)CCl MCULE-4900509903 [0,0,0,0,0,0|2,0,2]=4 94 B7R0.3 CCCOC(=O)CN MCULE-5016724090 [0,0,0,0,0,0|2,0,2]=4 95 B7R0.3 CCCOC(=O)CN MCULE-9899563764 [0,0,0,0,0,0|2,0,2]=4 96 B7R0.3 CCCOC(=O)CS MCULE-7918412380 [0,0,0,0,0,0|1,1,2]=4 97 B7R0.3 CCCOC(C)CN MCULE-2816840734 [0,0,0,0,0,0|3,0,0]=3 98 B7R0.3 CCCOC(C)CN MCULE-6461157704 [0,0,0,0,0,0|3,0,0]=3 99 B7R0.3 CCN(C)CCCCl MCULE-3619674048 [0,0,0,0,0,0|4,0,0]=4 100 B7R0.3 CCN(C)CCCCl MCULE-3845564178 [0,0,0,0,0,0|4,0,0]=4 101 B7R0.3 CCN(C)CCCN MCULE-2231565296 [0,0,0,0,0,0|4,0,0]=4 102 B7R0.3 CCN(C)CCCO MCULE-9090885474 [0,0,0,0,0,0|4,0,0]=4 103 B7R0.3 CCN(C)CCNC MCULE-3001815120 [0,0,0,0,0,0|4,0,0]=4 104 B7R0.3 CCNCC(C)C#N MCULE-5920854475 [0,0,0,0,0,0|3,0,1]=4 105 B7R0.3 CCNCC(C)CC MCULE-8768620428 [0,0,0,0,0,0|3,0,0]=3 106 B7R0.3 CCNCC(C)CC MCULE-9491990692 [0,0,0,0,0,0|3,0,0]=3 107 B7R0.3 CCNCC(C)OC MCULE-9115511555 [0,0,0,0,0,0|4,0,0]=4 108 B7R0.3 CCNCC(N)NC MCULE-1380874674 [0,0,0,0,0,0|4,0,0]=4 109 B7R0.3 CCNCC(O)CC MCULE-9820144398 [0,0,0,0,0,0|2,0,0]=2 110 B7R0.3 CCOCC(=O)CCl MCULE-3495077500 [0,0,0,0,0,0|2,0,2]=4 111 B7R0.3 CCOCC(C)CO MCULE-6831759423 [0,0,0,0,0,0|2,0,0]=2 112 B7R0.3 CCOCC(N)CC MCULE-2793834769 [0,0,0,0,0,0|3,0,0]=3 113 B7R0.3 CCOCC(N)CC MCULE-5142543434 [0,0,0,0,0,0|3,0,0]=3 114 B7R0.3 CCOCC(N)CO MCULE-8546500751 [0,0,0,0,0,0|2,0,0]=2 115 B7R0.3 CCOCC(O)CCl MCULE-5119359541 [0,0,0,0,0,0|2,0,0]=2 116 B7R0.3 CCOCC(O)CN MCULE-2355759727 [0,0,0,0,0,0|2,0,0]=2 117 B7R0.3 CCOCC(O)CO MCULE-2728952355 [0,0,0,0,0,0|1,0,0]=1 118 B7R0.3 CCSCC(C)NC MCULE-6245105657 [0,0,0,0,0,0|4,0,0]=4 119 B7R0.3 CCSCC(C)NN MCULE-5847763411 [0,0,0,0,0,0|4,0,0]=4 120 B7R0.3 CC[C@H](C)CCCO MCULE-1760153718 [0,0,0,0,0,0|3,0,0]=3 121 B7R0.3 CC[C@H](C)CCCO MCULE-3488695651 [0,0,0,0,0,0|3,0,0]=3 122 B7R0.3 CNC(C)CCSC MCULE-2095620023 [0,0,0,0,0,0|4,0,0]=4 123 B7R0.3 CNCC/C(=N/O)/N MCULE-5663392892 [0,0,0,0,0,0|3,0,1]=4 124 B7R0.3 CNCC/C(=N/O)/N MCULE-9276854772 [0,0,0,0,0,0|3,0,1]=4 125 B7R0.3 COCC/C(=N\O)/N MCULE-3175892655 [0,0,0,0,0,0|3,0,1]=4 126 B7R0.3 COCC/C(=N\O)/N MCULE-8002911611 [0,0,0,0,0,0|3,0,1]=4 127 B7R0.3 COCCC(=O)CCl MCULE-2918704994 [0,0,0,0,0,0|2,0,2]=4 128 B7R0.3 COCCC(C)CN MCULE-7288397543 [0,0,0,0,0,0|3,0,0]=3 129 B7R0.3 COCCC(N)CO MCULE-9758817920 [0,0,0,0,0,0|2,0,0]=2 130 B7R0.3 COCOC(C)CO MCULE-5033492685 [0,0,0,0,0,0|3,0,0]=3 131 B7R0.3 COCO[C@@H](C)CO MCULE-2279257941 [0,0,0,0,0,0|3,0,0]=3 132 B7R0.3 COCO[C@H](C)CO MCULE-6639618074 [0,0,0,0,0,0|3,0,0]=3 133 B7R0.3 COCO[C@H](C)CO MCULE-9421136678 [0,0,0,0,0,0|3,0,0]=3 134 B7R0.3 CSCCC(N)CO MCULE-1688371230 [0,0,0,0,0,0|2,0,0]=2 135 B7R0.3 CSCCC(O)C#N MCULE-3484786988 [0,0,0,0,0,0|2,0,1]=3 136 B7R0.3 CSCCC(O)CN MCULE-3835830442 [0,0,0,0,0,0|2,0,0]=2 137 B7R0.3 CSCC[C@@H](N)CO MCULE-2764794918 [0,0,0,0,0,0|2,0,0]=2 138 B7R0.3 CSCC[C@@H](N)CO MCULE-7120101109 [0,0,0,0,0,0|2,0,0]=2 139 B7R0.3 CSCC[C@H](N)CN MCULE-6460179286 [0,0,0,0,0,0|3,0,0]=3 140 B7R0.3 CSCC[C@H](N)CO MCULE-6014525130 [0,0,0,0,0,0|2,0,0]=2 141 B7R0.3 CSCC[C@H](N)CO MCULE-9216326176 [0,0,0,0,0,0|2,0,0]=2 142 B7R0.3 C[C@@H](CN)CCCO MCULE-2859776250 [0,0,0,0,0,0|3,0,0]=3 143 B7R0.3 C[C@@H](CN)CCCO MCULE-3245433953 [0,0,0,0,0,0|3,0,0]=3 144 B7R0.3 C[C@@H](CN)CCCO MCULE-7698870351 [0,0,0,0,0,0|3,0,0]=3 145 B7R0.3 C[C@@H](CN)CCCO MCULE-9900676606 [0,0,0,0,0,0|3,0,0]=3 146 B7R0.3 N#N=NCC(O)CCl MCULE-3212339720 [0,0,0,0,0,0|4,0,0]=4 147 B7R0.3 N#N=NCC(O)CO MCULE-9290720433 [0,0,0,0,0,0|3,0,0]=3 148 B7R0.3 N=C(CCCBr)NO MCULE-4204101118 [0,0,0,0,0,0|3,0,1]=4 149 B7R0.3 NCC(Cl)CCCCl MCULE-1250767606 [0,0,0,0,0,0|3,0,0]=3 150 B7R0.3 NCC(Cl)CCCCl MCULE-1634382406 [0,0,0,0,0,0|3,0,0]=3 151 B7R0.3 O=C(CCl)CCCCl MCULE-2362491395 [0,0,0,0,0,0|2,0,2]=4 152 B7R0.3 O=C(CO)NCCO MCULE-8933511918 [0,0,0,0,0,0|2,0,2]=4 153 B7R0.3 OCCCC(O)CO MCULE-3529953491 [0,0,0,0,0,0|1,0,0]=1 154 B6R0.1 C#CC(N)CCC MCULE-1649795667 [1,0,0,0,0,0|2,0,1]=4 155 B6R0.1 C#CC(N)CCC MCULE-4074347601 [1,0,0,0,0,0|2,0,1]=4 156 B6R0.1 C#CC(O)CCC MCULE-6152066005 [1,0,0,0,0,0|1,0,1]=3 157 B6R0.1 C#CCC(C)CO MCULE-6139260605 [1,0,0,0,0,0|1,0,2]=4 158 B6R0.1 C#CCC(N)CO MCULE-5669035635 [1,0,0,0,0,0|1,0,2]=4 159 B6R0.1 C#CCC(O)CC MCULE-8783941008 [1,0,0,0,0,0|1,0,2]=4 160 B6R0.1 C#CC[C@@H](N)CO MCULE-2638776426 [1,0,0,0,0,0|1,0,2]=4 161 B6R0.1 C#CC[C@@H](N)CO MCULE-7710952185 [1,0,0,0,0,0|1,0,2]=4 162 B6R0.1 C#CC[C@H](N)CO MCULE-8069295628 [1,0,0,0,0,0|1,0,2]=4 163 B6R0.1 C#CC[C@H](N)CO MCULE-9440234580 [1,0,0,0,0,0|1,0,2]=4 164 B6R0.1 C=CC(C)CCC MCULE-2692803387 [1,0,0,0,0,0|2,0,1]=4 165 B6R0.1 C=CC(O)CCC MCULE-3664453040 [1,0,0,0,0,0|1,0,1]=3 166 B6R0.1 C=CC(O)CCN MCULE-9346205308 [1,0,0,0,0,0|2,0,1]=4 167 B6R0.1 C=CCC(C)CO MCULE-9174943108 [1,0,0,0,0,0|1,0,2]=4 168 B6R0.1 C=CCC(N)CO MCULE-3854217705 [1,0,0,0,0,0|1,0,2]=4 169 B6R0.1 C=CCC(N)CO MCULE-6104194102 [1,0,0,0,0,0|1,0,2]=4 170 B6R0.1 C=CCC(N)CO MCULE-6473126335 [1,0,0,0,0,0|1,0,2]=4 171 B6R0.1 C=CCC(N)CO MCULE-8430673873 [1,0,0,0,0,0|1,0,2]=4 172 B6R0.1 C=CCC(O)CC MCULE-1497539816 [1,0,0,0,0,0|1,0,2]=4 173 B6R0.1 C=CCC(O)CN MCULE-8237489732 [1,0,0,0,0,0|1,0,2]=4 174 B6R0.1 C=CC[C@@H](N)CO MCULE-1869015815 [1,0,0,0,0,0|1,0,2]=4 175 B6R0.1 C=CC[C@@H](N)CO MCULE-2792980070 [1,0,0,0,0,0|1,0,2]=4 176 B6R0.1 C=CC[C@@H](N)CO MCULE-3168704187 [1,0,0,0,0,0|1,0,2]=4 177 B6R0.1 C=CC[C@@H](N)CO MCULE-4796522209 [1,0,0,0,0,0|1,0,2]=4 178 B6R0.1 C=CC[C@@H](O)CC MCULE-3259102701 [1,0,0,0,0,0|1,0,2]=4 179 B6R0.1 C=CC[C@H](N)CO MCULE-2427943513 [1,0,0,0,0,0|1,0,2]=4 180 B6R0.1 C=CC[C@H](N)CO MCULE-4244461120 [1,0,0,0,0,0|1,0,2]=4 181 B6R0.1 C=CC[C@H](N)CO MCULE-6760610212 [1,0,0,0,0,0|1,0,2]=4 182 B6R0.1 C=CC[C@H](N)CO MCULE-7914934929 [1,0,0,0,0,0|1,0,2]=4 183 B6R0.1 C=CC[C@H](O)CC MCULE-6527977219 [1,0,0,0,0,0|1,0,2]=4 184 B6R0.1 CC#CC(O)CC MCULE-9870271888 [1,0,0,0,0,0|1,0,2]=4 185 B6R0.1 CC(CN)CCN MCULE-2719332037 [1,0,0,0,0,0|3,0,0]=4 186 B6R0.1 CC(CN)CCN MCULE-4200375624 [1,0,0,0,0,0|3,0,0]=4 187 B6R0.1 CC(CN)CCO MCULE-5515163518 [1,0,0,0,0,0|3,0,0]=4 188 B6R0.1 CC(CO)CCN MCULE-9900244005 [1,0,0,0,0,0|2,0,0]=3 189 B6R0.1 CC(CO)CCO MCULE-5240961149 [1,0,0,0,0,0|2,0,0]=3 190 B6R0.1 CC(CO)CCO MCULE-8678967805 [1,0,0,0,0,0|2,0,0]=3 191 B6R0.1 CC=C[C@@H](N)CO MCULE-4690559736 [1,0,0,0,0,0|1,0,2]=4 192 B6R0.1 CC=C[C@@H](N)CO MCULE-5852475953 [1,0,0,0,0,0|1,0,2]=4 193 B6R0.1 CC=C[C@H](N)CO MCULE-6168992245 [1,0,0,0,0,0|1,0,2]=4 194 B6R0.1 CC=C[C@H](N)CO MCULE-6971252398 [1,0,0,0,0,0|1,0,2]=4 195 B6R0.1 CCC(Br)COC MCULE-7942540965 [1,0,0,0,0,0|3,0,0]=4 196 B6R0.1 CCC(C)CCBr MCULE-6033010731 [1,0,0,0,0,0|3,0,0]=4 197 B6R0.1 CCC(C)CCCl MCULE-2069721626 [1,0,0,0,0,0|3,0,0]=4 198 B6R0.1 CCC(C)CCN MCULE-4140800594 [1,0,0,0,0,0|3,0,0]=4 199 B6R0.1 CCC(C)CCN MCULE-5509248218 [1,0,0,0,0,0|3,0,0]=4 200 B6R0.1 CCC(C)CCO MCULE-6482427735 [1,0,0,0,0,0|3,0,0]=4 201 B6R0.1 CCC(C)CNC MCULE-1998406301 [1,0,0,0,0,0|3,0,0]=4 202 B6R0.1 CCC(C)CNC MCULE-5957910094 [1,0,0,0,0,0|3,0,0]=4 203 B6R0.1 CCC(N)CCN MCULE-8956610037 [1,0,0,0,0,0|3,0,0]=4 204 B6R0.1 CCC(N)CCO MCULE-1511155206 [1,0,0,0,0,0|3,0,0]=4 205 B6R0.1 CCC(N)CCO MCULE-5525302643 [1,0,0,0,0,0|3,0,0]=4 206 B6R0.1 CCC(N)COC MCULE-2103613859 [1,0,0,0,0,0|3,0,0]=4 207 B6R0.1 CCC(N)COC MCULE-5835446359 [1,0,0,0,0,0|3,0,0]=4 208 B6R0.1 CCC(N)CSC MCULE-9145513729 [1,0,0,0,0,0|3,0,0]=4 209 B6R0.1 CCC(O)CC#N MCULE-2542710031 [1,0,0,0,0,0|2,0,1]=4 210 B6R0.1 CCC(O)CCN MCULE-5387303971 [1,0,0,0,0,0|2,0,0]=3 211 B6R0.1 CCC(O)CCO MCULE-5156075792 [1,0,0,0,0,0|2,0,0]=3 212 B6R0.1 CCC(O)CNC MCULE-2490431367 [1,0,0,0,0,0|2,0,0]=3 213 B6R0.1 CCC(O)CNN MCULE-1038166714 [1,0,0,0,0,0|3,0,0]=4 214 B6R0.1 CCC(O)CNN MCULE-6391104058 [1,0,0,0,0,0|3,0,0]=4 215 B6R0.1 CCC(O)COC MCULE-6751000060 [1,0,0,0,0,0|2,0,0]=3 216 B6R0.1 CCC(O)CSC MCULE-3582683720 [1,0,0,0,0,0|2,0,0]=3 217 B6R0.1 CCC(S)CCO MCULE-4193788852 [1,0,0,0,0,0|2,1,0]=4 218 B6R0.1 CCC/C(=N/O)/N MCULE-1101103373 [1,0,0,0,0,0|2,0,1]=4 219 B6R0.1 CCC/C(=N/O)/N MCULE-2970638438 [1,0,0,0,0,0|2,0,1]=4 220 B6R0.1 CCCC(=NO)C MCULE-6437787263 [1,0,0,0,0,0|2,0,1]=4 221 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [1,0,0,0,0,0|1,0,2]=4 222 B6R0.1 CCCC(=O)CC MCULE-7121523805 [1,0,0,0,0,0|1,0,2]=4 223 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [1,0,0,0,0,0|1,0,2]=4 224 B6R0.1 CCCC(=O)CN MCULE-4663263123 [1,0,0,0,0,0|1,0,2]=4 225 B6R0.1 CCCC(=O)CN MCULE-6326368932 [1,0,0,0,0,0|1,0,2]=4 226 B6R0.1 CCCC(=O)CO MCULE-6518249412 [1,0,0,0,0,0|0,0,2]=3 227 B6R0.1 CCCC(=O)NO MCULE-8710375368 [1,0,0,0,0,0|1,0,2]=4 228 B6R0.1 CCCC(Br)CC MCULE-9116433502 [1,0,0,0,0,0|2,0,0]=3 229 B6R0.1 CCCC(C)C#N MCULE-2492294131 [1,0,0,0,0,0|2,0,1]=4 230 B6R0.1 CCCC(C)C=O MCULE-9756444218 [1,0,0,0,0,0|1,0,2]=4 231 B6R0.1 CCCC(C)CBr MCULE-3437352091 [1,0,0,0,0,0|2,0,0]=3 232 B6R0.1 CCCC(C)CC MCULE-7082933967 [1,0,0,0,0,0|2,0,0]=3 233 B6R0.1 CCCC(C)CCl MCULE-2381010454 [1,0,0,0,0,0|2,0,0]=3 234 B6R0.1 CCCC(C)CN MCULE-9552289739 [1,0,0,0,0,0|2,0,0]=3 235 B6R0.1 CCCC(C)CO MCULE-9777250826 [1,0,0,0,0,0|1,0,0]=2 236 B6R0.1 CCCC(C)NC MCULE-1560121168 [1,0,0,0,0,0|3,0,0]=4 237 B6R0.1 CCCC(C)NC MCULE-2169396338 [1,0,0,0,0,0|3,0,0]=4 238 B6R0.1 CCCC(Cl)CC MCULE-1581617529 [1,0,0,0,0,0|2,0,0]=3 239 B6R0.1 CCCC(Cl)CCl MCULE-9464139069 [1,0,0,0,0,0|2,0,0]=3 240 B6R0.1 CCCC(N)C#N MCULE-6830545935 [1,0,0,0,0,0|2,0,1]=4 241 B6R0.1 CCCC(N)C#N MCULE-9818121096 [1,0,0,0,0,0|2,0,1]=4 242 B6R0.1 CCCC(N)CC MCULE-5349906741 [1,0,0,0,0,0|2,0,0]=3 243 B6R0.1 CCCC(N)CC MCULE-7172418373 [1,0,0,0,0,0|2,0,0]=3 244 B6R0.1 CCCC(N)CN MCULE-8606218569 [1,0,0,0,0,0|2,0,0]=3 245 B6R0.1 CCCC(N)CO MCULE-3404967504 [1,0,0,0,0,0|1,0,0]=2 246 B6R0.1 CCCC(N)CO MCULE-3802448518 [1,0,0,0,0,0|1,0,0]=2 247 B6R0.1 CCCC(N)CO MCULE-4259078445 [1,0,0,0,0,0|1,0,0]=2 248 B6R0.1 CCCC(N)CO MCULE-6425025734 [1,0,0,0,0,0|1,0,0]=2 249 B6R0.1 CCCC(O)C#N MCULE-7017059503 [1,0,0,0,0,0|1,0,1]=3 250 B6R0.1 CCCC(O)CBr MCULE-5186252424 [1,0,0,0,0,0|1,0,0]=2 251 B6R0.1 CCCC(O)CC MCULE-9504041935 [1,0,0,0,0,0|1,0,0]=2 252 B6R0.1 CCCC(O)CCl MCULE-4737360217 [1,0,0,0,0,0|1,0,0]=2 253 B6R0.1 CCCC(O)CN MCULE-9402934997 [1,0,0,0,0,0|1,0,0]=2 254 B6R0.1 CCCC(O)CO MCULE-5124107719 [1,0,0,0,0,0|0,0,0]=1 255 B6R0.1 CCCC(S)CC MCULE-1322481338 [1,0,0,0,0,0|1,1,0]=3 256 B6R0.1 CCC[C@@H](N)CF MCULE-4702552251 [1,0,0,0,0,0|2,0,0]=3 257 B6R0.1 CCC[C@@H](N)CF MCULE-8118043624 [1,0,0,0,0,0|2,0,0]=3 258 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [1,0,0,0,0,0|1,0,0]=2 259 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [1,0,0,0,0,0|1,0,0]=2 260 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [1,0,0,0,0,0|1,0,0]=2 261 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [1,0,0,0,0,0|1,0,0]=2 262 B6R0.1 CCC[C@H](N)CF MCULE-7192744944 [1,0,0,0,0,0|2,0,0]=3 263 B6R0.1 CCC[C@H](N)CF MCULE-7441387613 [1,0,0,0,0,0|2,0,0]=3 264 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [1,0,0,0,0,0|1,0,0]=2 265 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [1,0,0,0,0,0|1,0,0]=2 266 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [1,0,0,0,0,0|1,0,0]=2 267 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [1,0,0,0,0,0|1,0,0]=2 268 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [1,0,0,0,0,0|1,0,0]=2 269 B6R0.1 CCNC(=O)CO MCULE-1386307800 [1,0,0,0,0,0|1,0,2]=4 270 B6R0.1 CCNC(C)CC MCULE-1017617081 [1,0,0,0,0,0|3,0,0]=4 271 B6R0.1 CCNC(C)CC MCULE-2691229640 [1,0,0,0,0,0|3,0,0]=4 272 B6R0.1 CCNC(C)CO MCULE-4344397973 [1,0,0,0,0,0|2,0,0]=3 273 B6R0.1 CCN[C@@H](C)CO MCULE-5648721449 [1,0,0,0,0,0|2,0,0]=3 274 B6R0.1 CCN[C@H](C)CO MCULE-8047465405 [1,0,0,0,0,0|2,0,0]=3 275 B6R0.1 CCOC(=O)CO MCULE-8121340151 [1,0,0,0,0,0|1,0,2]=4 276 B6R0.1 CCOC(C)CC MCULE-5049998907 [1,0,0,0,0,0|3,0,0]=4 277 B6R0.1 CCOC(C)CN MCULE-2322112215 [1,0,0,0,0,0|3,0,0]=4 278 B6R0.1 CCOC(C)CN MCULE-7307949125 [1,0,0,0,0,0|3,0,0]=4 279 B6R0.1 CCOC(C)CO MCULE-1592146913 [1,0,0,0,0,0|2,0,0]=3 280 B6R0.1 CCOC(Cl)CCl MCULE-2309448343 [1,0,0,0,0,0|3,0,0]=4 281 B6R0.1 CC[C@@H](N)COC MCULE-2231338404 [1,0,0,0,0,0|3,0,0]=4 282 B6R0.1 CC[C@@H](N)COC MCULE-2931188781 [1,0,0,0,0,0|3,0,0]=4 283 B6R0.1 CC[C@@H](N)COC MCULE-5773677141 [1,0,0,0,0,0|3,0,0]=4 284 B6R0.1 CC[C@@H](N)COC MCULE-5939905142 [1,0,0,0,0,0|3,0,0]=4 285 B6R0.1 CC[C@@H](O)CC#N MCULE-5921416613 [1,0,0,0,0,0|2,0,1]=4 286 B6R0.1 CC[C@@H](O)CC#N MCULE-8527710778 [1,0,0,0,0,0|2,0,1]=4 287 B6R0.1 CC[C@H](C)CCO MCULE-1190203828 [1,0,0,0,0,0|3,0,0]=4 288 B6R0.1 CC[C@H](C)CCO MCULE-8460710173 [1,0,0,0,0,0|3,0,0]=4 289 B6R0.1 CC[C@H](N)COC MCULE-1115072226 [1,0,0,0,0,0|3,0,0]=4 290 B6R0.1 CC[C@H](N)COC MCULE-3917835289 [1,0,0,0,0,0|3,0,0]=4 291 B6R0.1 CC[C@H](N)COC MCULE-8706423122 [1,0,0,0,0,0|3,0,0]=4 292 B6R0.1 CC[C@H](N)COC MCULE-9406311547 [1,0,0,0,0,0|3,0,0]=4 293 B6R0.1 CNCC(C)CN MCULE-1889673811 [1,0,0,0,0,0|3,0,0]=4 294 B6R0.1 CNCC(C)CO MCULE-6329429747 [1,0,0,0,0,0|2,0,0]=3 295 B6R0.1 CNCC(O)CF MCULE-3368370486 [1,0,0,0,0,0|2,0,0]=3 296 B6R0.1 CNCC(O)CN MCULE-1077260629 [1,0,0,0,0,0|2,0,0]=3 297 B6R0.1 CNCC(O)CO MCULE-4566952448 [1,0,0,0,0,0|1,0,0]=2 298 B6R0.1 CNC[C@H](O)CO MCULE-3410453252 [1,0,0,0,0,0|1,0,0]=2 299 B6R0.1 COCC(C)CN MCULE-3223901774 [1,0,0,0,0,0|3,0,0]=4 300 B6R0.1 COCC(C)CO MCULE-7663064542 [1,0,0,0,0,0|2,0,0]=3 301 B6R0.1 COCC(F)CN MCULE-2821685967 [1,0,0,0,0,0|3,0,0]=4 302 B6R0.1 COCC(F)CN MCULE-9691951401 [1,0,0,0,0,0|3,0,0]=4 303 B6R0.1 COCC(N)CN MCULE-1244199319 [1,0,0,0,0,0|3,0,0]=4 304 B6R0.1 COCC(N)CO MCULE-2141613120 [1,0,0,0,0,0|2,0,0]=3 305 B6R0.1 COCC(N)CO MCULE-3194232042 [1,0,0,0,0,0|2,0,0]=3 306 B6R0.1 COCC(N)CO MCULE-6545937769 [1,0,0,0,0,0|2,0,0]=3 307 B6R0.1 COCC(N)CO MCULE-7989665777 [1,0,0,0,0,0|2,0,0]=3 308 B6R0.1 COCC(O)C#N MCULE-2148015888 [1,0,0,0,0,0|2,0,1]=4 309 B6R0.1 COCC(O)CBr MCULE-6900294714 [1,0,0,0,0,0|2,0,0]=3 310 B6R0.1 COCC(O)CCl MCULE-9314630227 [1,0,0,0,0,0|2,0,0]=3 311 B6R0.1 COCC(O)CF MCULE-1938415887 [1,0,0,0,0,0|2,0,0]=3 312 B6R0.1 COCC(O)CN MCULE-2044547388 [1,0,0,0,0,0|2,0,0]=3 313 B6R0.1 COCC(O)CN MCULE-2145726384 [1,0,0,0,0,0|2,0,0]=3 314 B6R0.1 COCC(O)CN MCULE-3637597204 [1,0,0,0,0,0|2,0,0]=3 315 B6R0.1 COCC(O)CO MCULE-1154104224 [1,0,0,0,0,0|1,0,0]=2 316 B6R0.1 COC[C@@H](N)CO MCULE-2792470078 [1,0,0,0,0,0|2,0,0]=3 317 B6R0.1 COC[C@@H](N)CO MCULE-3805343572 [1,0,0,0,0,0|2,0,0]=3 318 B6R0.1 COC[C@@H](N)CO MCULE-7953239910 [1,0,0,0,0,0|2,0,0]=3 319 B6R0.1 COC[C@@H](N)CO MCULE-9178553914 [1,0,0,0,0,0|2,0,0]=3 320 B6R0.1 COC[C@@H](O)CN MCULE-2116679841 [1,0,0,0,0,0|2,0,0]=3 321 B6R0.1 COC[C@@H](O)CN MCULE-4198842123 [1,0,0,0,0,0|2,0,0]=3 322 B6R0.1 COC[C@@H](O)CN MCULE-6330998296 [1,0,0,0,0,0|2,0,0]=3 323 B6R0.1 COC[C@H](C)CO MCULE-3120475252 [1,0,0,0,0,0|2,0,0]=3 324 B6R0.1 COC[C@H](F)CN MCULE-2663238018 [1,0,0,0,0,0|3,0,0]=4 325 B6R0.1 COC[C@H](N)CO MCULE-1678153673 [1,0,0,0,0,0|2,0,0]=3 326 B6R0.1 COC[C@H](N)CO MCULE-2304967280 [1,0,0,0,0,0|2,0,0]=3 327 B6R0.1 COC[C@H](N)CO MCULE-6509090198 [1,0,0,0,0,0|2,0,0]=3 328 B6R0.1 COC[C@H](N)CO MCULE-9806530206 [1,0,0,0,0,0|2,0,0]=3 329 B6R0.1 COC[C@H](O)CN MCULE-1962346446 [1,0,0,0,0,0|2,0,0]=3 330 B6R0.1 COC[C@H](O)CN MCULE-6290984425 [1,0,0,0,0,0|2,0,0]=3 331 B6R0.1 CSCC(C)CN MCULE-4493405290 [1,0,0,0,0,0|3,0,0]=4 332 B6R0.1 CSCC(C)CO MCULE-3842820579 [1,0,0,0,0,0|2,0,0]=3 333 B6R0.1 CSCC(O)CO MCULE-6573013078 [1,0,0,0,0,0|1,0,0]=2 334 B6R0.1 C[C@@H](CO)CCN MCULE-4422620011 [1,0,0,0,0,0|2,0,0]=3 335 B6R0.1 C[C@@H](CO)CCN MCULE-7560169391 [1,0,0,0,0,0|2,0,0]=3 336 B6R0.1 C[C@@H](CO)CCO MCULE-6545491289 [1,0,0,0,0,0|2,0,0]=3 337 B6R0.1 C[C@H](CO)CCO MCULE-2543010074 [1,0,0,0,0,0|2,0,0]=3 338 B6R0.1 C[C@H](CO)CCO MCULE-6036462418 [1,0,0,0,0,0|2,0,0]=3 339 B6R0.1 ClCC(Cl)CCBr MCULE-2469656567 [1,0,0,0,0,0|3,0,0]=4 340 B6R0.1 FC(CBr)CCBr MCULE-2311323533 [1,0,0,0,0,0|3,0,0]=4 341 B6R0.1 N#CCC(O)CCl MCULE-8450875181 [1,0,0,0,0,0|2,0,1]=4 342 B6R0.1 N#CCC(O)CCl MCULE-8948452380 [1,0,0,0,0,0|2,0,1]=4 343 B6R0.1 N#CC[C@@H](O)CCl MCULE-6554781206 [1,0,0,0,0,0|2,0,1]=4 344 B6R0.1 N#CC[C@@H](O)CCl MCULE-7510135915 [1,0,0,0,0,0|2,0,1]=4 345 B6R0.1 N#CC[C@H](O)CCl MCULE-4155359829 [1,0,0,0,0,0|2,0,1]=4 346 B6R0.1 N#CC[C@H](O)CCl MCULE-9172368545 [1,0,0,0,0,0|2,0,1]=4 347 B6R0.1 NC(CO)CCF MCULE-3691993352 [1,0,0,0,0,0|2,0,0]=3 348 B6R0.1 NC(CO)CCO MCULE-3703088648 [1,0,0,0,0,0|2,0,0]=3 349 B6R0.1 NC(CO)CCO MCULE-7609576462 [1,0,0,0,0,0|2,0,0]=3 350 B6R0.1 NCC(N)CCO MCULE-2965554481 [1,0,0,0,0,0|3,0,0]=4 351 B6R0.1 NCCC(F)CN MCULE-9478589176 [1,0,0,0,0,0|3,0,0]=4 352 B6R0.1 NCCC(O)CN MCULE-9177974477 [1,0,0,0,0,0|2,0,0]=3 353 B6R0.1 NCCC(O)CO MCULE-2556586168 [1,0,0,0,0,0|1,0,0]=2 354 B6R0.1 N[C@@H](CO)CCO MCULE-4583236919 [1,0,0,0,0,0|2,0,0]=3 355 B6R0.1 N[C@@H](CO)CCO MCULE-5489716742 [1,0,0,0,0,0|2,0,0]=3 356 B6R0.1 N[C@H](CO)CCO MCULE-5338659573 [1,0,0,0,0,0|2,0,0]=3 357 B6R0.1 N[C@H](CO)CCO MCULE-8998003003 [1,0,0,0,0,0|2,0,0]=3 358 B6R0.1 N[C@H](CS)CCS MCULE-5846021725 [1,0,0,0,0,0|2,1,0]=4 359 B6R0.1 N[C@H](CS)CCS MCULE-6871313350 [1,0,0,0,0,0|2,1,0]=4 360 B6R0.1 N[C@H](CS)CCS MCULE-8095554848 [1,0,0,0,0,0|2,1,0]=4 361 B6R0.1 N[C@H](CS)CCS MCULE-8177349504 [1,0,0,0,0,0|2,1,0]=4 362 B6R0.1 O=CC[C@H](O)CCl MCULE-6385696769 [1,0,0,0,0,0|2,0,1]=4 363 B6R0.1 OC(CBr)CCBr MCULE-5156583342 [1,0,0,0,0,0|2,0,0]=3 364 B6R0.1 OC(CCl)CCCl MCULE-5495327725 [1,0,0,0,0,0|2,0,0]=3 365 B6R0.1 OCCC(O)CCl MCULE-4752952606 [1,0,0,0,0,0|2,0,0]=3 366 B6R0.1 OCCC(O)CO MCULE-6470178852 [1,0,0,0,0,0|1,0,0]=2 367 B6R0.1 OCC[C@@H](Br)CO MCULE-4859199629 [1,0,0,0,0,0|2,0,0]=3 368 B6R0.1 OCC[C@@H](O)CO MCULE-2312093276 [1,0,0,0,0,0|1,0,0]=2 369 B6R0.1 OCC[C@@H](O)CO MCULE-4636748782 [1,0,0,0,0,0|1,0,0]=2 370 B6R0.1 OCC[C@H](O)CBr MCULE-1990035925 [1,0,0,0,0,0|2,0,0]=3 371 B6R0.1 OCC[C@H](O)CCl MCULE-4561806159 [1,0,0,0,0,0|2,0,0]=3 372 B6R0.1 OCC[C@H](O)CCl MCULE-8582759529 [1,0,0,0,0,0|2,0,0]=3 373 B6R0.1 OCC[C@H](O)CO MCULE-2265914374 [1,0,0,0,0,0|1,0,0]=2 374 B6R0.1 OCC[C@H](O)CO MCULE-5459838421 [1,0,0,0,0,0|1,0,0]=2 375 B6R0.1 O[C@@H](CBr)CCBr MCULE-2137750043 [1,0,0,0,0,0|2,0,0]=3 376 B6R0.1 O[C@H](CBr)CCBr MCULE-2647046297 [1,0,0,0,0,0|2,0,0]=3 377 B6R0.1 O[C@H](CBr)CCBr MCULE-5662911918 [1,0,0,0,0,0|2,0,0]=3 378 B6R0.1 [NH3+]CCC(F)C[NH3+] MCULE-8320233584 [1,0,0,0,0,0|3,0,0]=4 379 B6R0.4 C#CCCC(C)C MCULE-9613694830 [1,0,0,0,0,0|1,0,2]=4 380 B6R0.4 C#CCCC(C)O MCULE-1476308263 [1,0,0,0,0,0|0,0,2]=3 381 B6R0.4 C=C(C)CCCBr MCULE-5063918467 [1,0,0,0,0,0|2,0,1]=4 382 B6R0.4 C=C(C)CCCC MCULE-1010177756 [1,0,0,0,0,0|1,0,1]=3 383 B6R0.4 C=C(C)CCCO MCULE-4629274490 [1,0,0,0,0,0|2,0,1]=4 384 B6R0.4 C=C(C)CNCC MCULE-2237759977 [1,0,0,0,0,0|2,0,1]=4 385 B6R0.4 C=CCCB(O)O MCULE-9431650735 [1,0,0,0,0,0|1,0,2]=4 386 B6R0.4 C=CCCC(C)Br MCULE-5841356762 [1,0,0,0,0,0|1,0,2]=4 387 B6R0.4 C=CCCC(C)C MCULE-7128249655 [1,0,0,0,0,0|1,0,2]=4 388 B6R0.4 C=CCCC(C)O MCULE-3388106789 [1,0,0,0,0,0|0,0,2]=3 389 B6R0.4 C=CCC[C@@H](C)O MCULE-1272820385 [1,0,0,0,0,0|0,0,2]=3 390 B6R0.4 C=CCC[C@@H](C)O MCULE-8509867177 [1,0,0,0,0,0|0,0,2]=3 391 B6R0.4 C=CCC[C@H](C)O MCULE-4371391667 [1,0,0,0,0,0|0,0,2]=3 392 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [1,0,0,0,0,0|1,0,2]=4 393 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [1,0,0,0,0,0|1,0,2]=4 394 B6R0.4 CC(=O)CCCO MCULE-1335342150 [1,0,0,0,0,0|1,0,2]=4 395 B6R0.4 CC(Br)CCC#N MCULE-7424967519 [1,0,0,0,0,0|2,0,1]=4 396 B6R0.4 CC(Br)CCCBr MCULE-8808667049 [1,0,0,0,0,0|2,0,0]=3 397 B6R0.4 CC(C)CCC#N MCULE-5503038837 [1,0,0,0,0,0|2,0,1]=4 398 B6R0.4 CC(C)CCC=O MCULE-9664145623 [1,0,0,0,0,0|2,0,1]=4 399 B6R0.4 CC(C)CCCBr MCULE-2045625937 [1,0,0,0,0,0|2,0,0]=3 400 B6R0.4 CC(C)CCCCl MCULE-4841628592 [1,0,0,0,0,0|2,0,0]=3 401 B6R0.4 CC(C)CCCI MCULE-4035616717 [1,0,0,0,0,0|2,0,0]=3 402 B6R0.4 CC(C)CCCN MCULE-2232715676 [1,0,0,0,0,0|2,0,0]=3 403 B6R0.4 CC(C)CCCN MCULE-7121372197 [1,0,0,0,0,0|2,0,0]=3 404 B6R0.4 CC(C)CCCO MCULE-5797993948 [1,0,0,0,0,0|2,0,0]=3 405 B6R0.4 CC(C)CCCS MCULE-8417191578 [1,0,0,0,0,0|2,0,0]=3 406 B6R0.4 CC(C)CCNN MCULE-1163630283 [1,0,0,0,0,0|3,0,0]=4 407 B6R0.4 CC(C)CCNN MCULE-2023326468 [1,0,0,0,0,0|3,0,0]=4 408 B6R0.4 CC(C)CCNN MCULE-4572239737 [1,0,0,0,0,0|3,0,0]=4 409 B6R0.4 CC(C)CCON MCULE-2653553816 [1,0,0,0,0,0|3,0,0]=4 410 B6R0.4 CC(C)CCON MCULE-6468395078 [1,0,0,0,0,0|3,0,0]=4 411 B6R0.4 CC(C)COCCl MCULE-2194640169 [1,0,0,0,0,0|3,0,0]=4 412 B6R0.4 CC(C)CSCCl MCULE-5218455619 [1,0,0,0,0,0|3,0,0]=4 413 B6R0.4 CC(C)NCCCl MCULE-1521398137 [1,0,0,0,0,0|3,0,0]=4 414 B6R0.4 CC(C)NCCCl MCULE-2586914937 [1,0,0,0,0,0|3,0,0]=4 415 B6R0.4 CC(C)NCCN MCULE-1003086359 [1,0,0,0,0,0|3,0,0]=4 416 B6R0.4 CC(C)NCCN MCULE-5066931507 [1,0,0,0,0,0|3,0,0]=4 417 B6R0.4 CC(C)NCCO MCULE-1749029105 [1,0,0,0,0,0|3,0,0]=4 418 B6R0.4 CC(C)OCCBr MCULE-8869065375 [1,0,0,0,0,0|3,0,0]=4 419 B6R0.4 CC(C)OCCCl MCULE-3848763715 [1,0,0,0,0,0|3,0,0]=4 420 B6R0.4 CC(C)OCCI MCULE-8259612531 [1,0,0,0,0,0|3,0,0]=4 421 B6R0.4 CC(C)OCCN MCULE-6140628944 [1,0,0,0,0,0|3,0,0]=4 422 B6R0.4 CC(C)OCCN MCULE-7438591135 [1,0,0,0,0,0|3,0,0]=4 423 B6R0.4 CC(C)OCCN MCULE-7614115649 [1,0,0,0,0,0|3,0,0]=4 424 B6R0.4 CC(C)OCCO MCULE-8766149613 [1,0,0,0,0,0|3,0,0]=4 425 B6R0.4 CC(C)SCCCl MCULE-4991548042 [1,0,0,0,0,0|3,0,0]=4 426 B6R0.4 CC(C)SCCN MCULE-2838203545 [1,0,0,0,0,0|3,0,0]=4 427 B6R0.4 CC(C)SCCN MCULE-6551225219 [1,0,0,0,0,0|3,0,0]=4 428 B6R0.4 CC(C)SCCO MCULE-1467015400 [1,0,0,0,0,0|3,0,0]=4 429 B6R0.4 CC(Cl)CCC#N MCULE-2064174419 [1,0,0,0,0,0|2,0,1]=4 430 B6R0.4 CC(Cl)CCCCl MCULE-9382073752 [1,0,0,0,0,0|2,0,0]=3 431 B6R0.4 CC(Cl)CCCO MCULE-2554250532 [1,0,0,0,0,0|2,0,0]=3 432 B6R0.4 CC(N)CCCN MCULE-4857113826 [1,0,0,0,0,0|2,0,0]=3 433 B6R0.4 CC(N)CCCN MCULE-4899798325 [1,0,0,0,0,0|2,0,0]=3 434 B6R0.4 CC(N)CCCO MCULE-6629535696 [1,0,0,0,0,0|2,0,0]=3 435 B6R0.4 CC(O)CCC#N MCULE-6350143710 [1,0,0,0,0,0|1,0,1]=3 436 B6R0.4 CC(O)CCCBr MCULE-5477662754 [1,0,0,0,0,0|1,0,0]=2 437 B6R0.4 CC(O)CCCCl MCULE-6993728810 [1,0,0,0,0,0|1,0,0]=2 438 B6R0.4 CC(O)CCCN MCULE-3754805134 [1,0,0,0,0,0|1,0,0]=2 439 B6R0.4 CC(O)CCCO MCULE-6580326052 [1,0,0,0,0,0|1,0,0]=2 440 B6R0.4 CC(O)CN=N#N MCULE-3020215858 [1,0,0,0,0,0|3,0,0]=4 441 B6R0.4 CC=CCC(C)C MCULE-7145682250 [1,0,0,0,0,0|1,0,2]=4 442 B6R0.4 CCC#CC(C)O MCULE-6395334377 [1,0,0,0,0,0|0,0,2]=3 443 B6R0.4 CCC=CB(O)O MCULE-6166989227 [1,0,0,0,0,0|1,0,2]=4 444 B6R0.4 CCCC=C(C)C MCULE-2110588796 [1,0,0,0,0,0|1,0,2]=4 445 B6R0.4 CCCCB(O)O MCULE-9002672645 [1,0,0,0,0,0|1,0,0]=2 446 B6R0.4 CCCCC(=N)N MCULE-3271993509 [1,0,0,0,0,0|2,0,1]=4 447 B6R0.4 CCCCC(=N)N MCULE-3935017760 [1,0,0,0,0,0|2,0,1]=4 448 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [1,0,0,0,0,0|1,0,2]=4 449 B6R0.4 CCCCC(=O)C MCULE-3554390184 [1,0,0,0,0,0|0,0,2]=3 450 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [1,0,0,0,0,0|1,0,2]=4 451 B6R0.4 CCCCC(=O)N MCULE-6419483436 [1,0,0,0,0,0|1,0,2]=4 452 B6R0.4 CCCCC(=O)O MCULE-2333640078 [1,0,0,0,0,0|0,0,2]=3 453 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [1,0,0,0,0,0|0,0,3]=4 454 B6R0.4 CCCCC(=S)N MCULE-8236760762 [1,0,0,0,0,0|1,1,1]=4 455 B6R0.4 CCCCC(C)Br MCULE-3252474574 [1,0,0,0,0,0|1,0,0]=2 456 B6R0.4 CCCCC(C)C MCULE-7568461039 [1,0,0,0,0,0|1,0,0]=2 457 B6R0.4 CCCCC(C)Cl MCULE-4825682003 [1,0,0,0,0,0|1,0,0]=2 458 B6R0.4 CCCCC(C)N MCULE-5349371506 [1,0,0,0,0,0|1,0,0]=2 459 B6R0.4 CCCCC(C)N MCULE-6696490028 [1,0,0,0,0,0|1,0,0]=2 460 B6R0.4 CCCCC(C)O MCULE-6558228722 [1,0,0,0,0,0|0,0,0]=1 461 B6R0.4 CCCCC(C)S MCULE-4791681848 [1,0,0,0,0,0|0,1,0]=2 462 B6R0.4 CCCCN(=O)=O MCULE-7679767771 [1,0,0,0,0,0|1,0,2]=4 463 B6R0.4 CCCCN(C)C MCULE-7202077639 [1,0,0,0,0,0|2,0,0]=3 464 B6R0.4 CCCCN(C)N MCULE-7927159797 [1,0,0,0,0,0|2,0,0]=3 465 B6R0.4 CCCCS(=O)[O-] MCULE-4347348762 [1,0,0,0,0,0|1,0,2]=4 466 B6R0.4 CCCCS(=O)[O-] MCULE-8153578421 [1,0,0,0,0,0|1,0,2]=4 467 B6R0.4 CCCC[C@@H](C)N MCULE-2673058676 [1,0,0,0,0,0|1,0,0]=2 468 B6R0.4 CCCC[C@@H](C)N MCULE-7666196055 [1,0,0,0,0,0|1,0,0]=2 469 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [1,0,0,0,0,0|0,0,0]=1 470 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [1,0,0,0,0,0|0,0,0]=1 471 B6R0.4 CCCC[C@H](C)N MCULE-6212068145 [1,0,0,0,0,0|1,0,0]=2 472 B6R0.4 CCCC[C@H](C)N MCULE-7818513999 [1,0,0,0,0,0|1,0,0]=2 473 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [1,0,0,0,0,0|0,0,0]=1 474 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [1,0,0,0,0,0|0,0,0]=1 475 B6R0.4 CCCNC(=O)C MCULE-5899703886 [1,0,0,0,0,0|1,0,2]=4 476 B6R0.4 CCCNC(C)C MCULE-7475023734 [1,0,0,0,0,0|2,0,0]=3 477 B6R0.4 CCCOC(=O)C MCULE-7327042566 [1,0,0,0,0,0|1,0,2]=4 478 B6R0.4 CCCSC(=O)C MCULE-4329646671 [1,0,0,0,0,0|1,0,2]=4 479 B6R0.4 CCCSC(C)C MCULE-2233656285 [1,0,0,0,0,0|2,0,0]=3 480 B6R0.4 CCN=CC(C)C MCULE-7306741362 [1,0,0,0,0,0|2,0,1]=4 481 B6R0.4 CCNCC(=O)C MCULE-5799315547 [1,0,0,0,0,0|1,0,2]=4 482 B6R0.4 CCNCC(=O)C MCULE-9258294157 [1,0,0,0,0,0|1,0,2]=4 483 B6R0.4 CCNCC(=O)O MCULE-5989480216 [1,0,0,0,0,0|1,0,2]=4 484 B6R0.4 CCNCC(=O)O MCULE-8087863397 [1,0,0,0,0,0|1,0,2]=4 485 B6R0.4 CCNCC(C)C MCULE-1625905125 [1,0,0,0,0,0|2,0,0]=3 486 B6R0.4 CCNCC(C)C MCULE-3527739859 [1,0,0,0,0,0|2,0,0]=3 487 B6R0.4 CCNCC(C)O MCULE-5078068369 [1,0,0,0,0,0|1,0,0]=2 488 B6R0.4 CCNCC(F)F MCULE-3324117157 [1,0,0,0,0,0|3,0,0]=4 489 B6R0.4 CCNCC(F)F MCULE-7919972639 [1,0,0,0,0,0|3,0,0]=4 490 B6R0.4 CCNC[C@@H](C)O MCULE-4291219061 [1,0,0,0,0,0|1,0,0]=2 491 B6R0.4 CCNC[C@@H](C)O MCULE-8603386701 [1,0,0,0,0,0|1,0,0]=2 492 B6R0.4 CCNC[C@H](C)O MCULE-7173470231 [1,0,0,0,0,0|1,0,0]=2 493 B6R0.4 CCNC[C@H](C)O MCULE-9651301254 [1,0,0,0,0,0|1,0,0]=2 494 B6R0.4 CCOCC(=O)C MCULE-2825677443 [1,0,0,0,0,0|1,0,2]=4 495 B6R0.4 CCOCC(=O)O MCULE-1726530898 [1,0,0,0,0,0|1,0,2]=4 496 B6R0.4 CCOCC(C)C MCULE-7986128672 [1,0,0,0,0,0|2,0,0]=3 497 B6R0.4 CCOCC(C)N MCULE-8540668261 [1,0,0,0,0,0|2,0,0]=3 498 B6R0.4 CCOCC(C)N MCULE-8720228996 [1,0,0,0,0,0|2,0,0]=3 499 B6R0.4 CCOCC(C)O MCULE-6224339526 [1,0,0,0,0,0|1,0,0]=2 500 B6R0.4 CCOC[C@@H](C)N MCULE-7053460047 [1,0,0,0,0,0|2,0,0]=3 501 B6R0.4 CCOC[C@@H](C)N MCULE-9865800502 [1,0,0,0,0,0|2,0,0]=3 502 B6R0.4 CCOC[C@@H](C)O MCULE-9075407512 [1,0,0,0,0,0|1,0,0]=2 503 B6R0.4 CCOC[C@H](C)N MCULE-2897416804 [1,0,0,0,0,0|2,0,0]=3 504 B6R0.4 CCOC[C@H](C)N MCULE-6799267946 [1,0,0,0,0,0|2,0,0]=3 505 B6R0.4 CCONC(C)C MCULE-2412572743 [1,0,0,0,0,0|3,0,0]=4 506 B6R0.4 CCONC(C)C MCULE-9246196365 [1,0,0,0,0,0|3,0,0]=4 507 B6R0.4 CCSCC(=O)C MCULE-9872082780 [1,0,0,0,0,0|1,0,2]=4 508 B6R0.4 CCSCC(=O)O MCULE-7471335718 [1,0,0,0,0,0|1,0,2]=4 509 B6R0.4 CCSCC(C)N MCULE-3399255190 [1,0,0,0,0,0|2,0,0]=3 510 B6R0.4 CN(C)CCCBr MCULE-2862944726 [1,0,0,0,0,0|3,0,0]=4 511 B6R0.4 CN(C)CCCBr MCULE-4596026048 [1,0,0,0,0,0|3,0,0]=4 512 B6R0.4 CN(C)CCCBr MCULE-7515880350 [1,0,0,0,0,0|3,0,0]=4 513 B6R0.4 CN(C)CCCCl MCULE-1347366200 [1,0,0,0,0,0|3,0,0]=4 514 B6R0.4 CN(C)CCCCl MCULE-3767329555 [1,0,0,0,0,0|3,0,0]=4 515 B6R0.4 CN(C)CCCI MCULE-2134226049 [1,0,0,0,0,0|3,0,0]=4 516 B6R0.4 CN(C)CCCI MCULE-2999516061 [1,0,0,0,0,0|3,0,0]=4 517 B6R0.4 CN(C)CCCN MCULE-3882436382 [1,0,0,0,0,0|3,0,0]=4 518 B6R0.4 CN(C)CCCN MCULE-4415270662 [1,0,0,0,0,0|3,0,0]=4 519 B6R0.4 CN(C)CCCN MCULE-4624916051 [1,0,0,0,0,0|3,0,0]=4 520 B6R0.4 CN(C)CCCN MCULE-4749435878 [1,0,0,0,0,0|3,0,0]=4 521 B6R0.4 CN(C)CCCN MCULE-9301668058 [1,0,0,0,0,0|3,0,0]=4 522 B6R0.4 CN(C)CCCO MCULE-7408728427 [1,0,0,0,0,0|3,0,0]=4 523 B6R0.4 CN(C)CCCS MCULE-7945161812 [1,0,0,0,0,0|3,0,0]=4 524 B6R0.4 CNCCC(=O)O MCULE-3627988097 [1,0,0,0,0,0|1,0,2]=4 525 B6R0.4 CNCCC(=O)O MCULE-9858204248 [1,0,0,0,0,0|1,0,2]=4 526 B6R0.4 CNCCC(C)C MCULE-3679914556 [1,0,0,0,0,0|2,0,0]=3 527 B6R0.4 CNCCC(C)C MCULE-9679972004 [1,0,0,0,0,0|2,0,0]=3 528 B6R0.4 CNCCC(C)N MCULE-5955505029 [1,0,0,0,0,0|2,0,0]=3 529 B6R0.4 CNCCC(C)N MCULE-8933967952 [1,0,0,0,0,0|2,0,0]=3 530 B6R0.4 CNCCC(C)O MCULE-1615526002 [1,0,0,0,0,0|1,0,0]=2 531 B6R0.4 CNCCN(C)C MCULE-3324857553 [1,0,0,0,0,0|3,0,0]=4 532 B6R0.4 CNCCN(C)C MCULE-8014008412 [1,0,0,0,0,0|3,0,0]=4 533 B6R0.4 CNCCN(C)C MCULE-9954339750 [1,0,0,0,0,0|3,0,0]=4 534 B6R0.4 CNCC[C@@H](C)N MCULE-6024494304 [1,0,0,0,0,0|2,0,0]=3 535 B6R0.4 CNCC[C@H](C)N MCULE-5449372796 [1,0,0,0,0,0|2,0,0]=3 536 B6R0.4 CNCC[C@H](C)N MCULE-8157402351 [1,0,0,0,0,0|2,0,0]=3 537 B6R0.4 CNOCC(C)C MCULE-4779196887 [1,0,0,0,0,0|3,0,0]=4 538 B6R0.4 CNOCC(C)C MCULE-7320343096 [1,0,0,0,0,0|3,0,0]=4 539 B6R0.4 COCCC(=O)C MCULE-5939812376 [1,0,0,0,0,0|1,0,2]=4 540 B6R0.4 COCCC(=O)O MCULE-3436347115 [1,0,0,0,0,0|1,0,2]=4 541 B6R0.4 COCCC(C)Br MCULE-6529807745 [1,0,0,0,0,0|2,0,0]=3 542 B6R0.4 COCCC(C)C MCULE-8727768886 [1,0,0,0,0,0|2,0,0]=3 543 B6R0.4 COCCC(C)N MCULE-6183216923 [1,0,0,0,0,0|2,0,0]=3 544 B6R0.4 COCCC(C)O MCULE-6536001437 [1,0,0,0,0,0|1,0,0]=2 545 B6R0.4 COCCN(C)C MCULE-5323166567 [1,0,0,0,0,0|3,0,0]=4 546 B6R0.4 COCCN(C)N MCULE-9480733049 [1,0,0,0,0,0|3,0,0]=4 547 B6R0.4 COCC[C@H](C)N MCULE-6163336851 [1,0,0,0,0,0|2,0,0]=3 548 B6R0.4 COCC[C@H](C)N MCULE-6363449253 [1,0,0,0,0,0|2,0,0]=3 549 B6R0.4 CS(=O)CCCN MCULE-1124989526 [1,0,0,0,0,0|2,0,1]=4 550 B6R0.4 CS(=O)CCCN MCULE-8758903495 [1,0,0,0,0,0|2,0,1]=4 551 B6R0.4 CSCCC(=O)C MCULE-6178663156 [1,0,0,0,0,0|1,0,2]=4 552 B6R0.4 CSCCC(=O)O MCULE-9550032941 [1,0,0,0,0,0|1,0,2]=4 553 B6R0.4 CSCCC(C)N MCULE-3925048385 [1,0,0,0,0,0|2,0,0]=3 554 B6R0.4 CSCCC(C)O MCULE-5934844952 [1,0,0,0,0,0|1,0,0]=2 555 B6R0.4 CSCCN(C)C MCULE-2148124964 [1,0,0,0,0,0|3,0,0]=4 556 B6R0.4 CSCCN(C)C MCULE-5176242697 [1,0,0,0,0,0|3,0,0]=4 557 B6R0.4 C[C@@H](N)CCCO MCULE-8313291415 [1,0,0,0,0,0|2,0,0]=3 558 B6R0.4 C[C@@H](O)CCCO MCULE-1658231016 [1,0,0,0,0,0|1,0,0]=2 559 B6R0.4 FC(F)CCCBr MCULE-1364730558 [1,0,0,0,0,0|3,0,0]=4 560 B6R0.4 NCCCC(=O)O MCULE-3615304273 [1,0,0,0,0,0|1,0,2]=4 561 B6R0.4 NCCCC(=O)O MCULE-7613134021 [1,0,0,0,0,0|1,0,2]=4 562 B6R0.4 NCCCC(F)F MCULE-3173114913 [1,0,0,0,0,0|3,0,0]=4 563 B6R0.4 NCCCC(F)F MCULE-8441119601 [1,0,0,0,0,0|3,0,0]=4 564 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [1,0,0,0,0,0|1,0,2]=4 565 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [1,0,0,0,0,0|1,0,2]=4 566 B6R0.4 O=C(O)CCCF MCULE-2415675768 [1,0,0,0,0,0|1,0,2]=4 567 B6R0.4 O=C(O)CCCI MCULE-7794841553 [1,0,0,0,0,0|1,0,2]=4 568 B6R0.4 O=C(O)CCCS MCULE-3352840152 [1,0,0,0,0,0|1,0,2]=4 569 B6R0.4 OCCCC(F)F MCULE-2972867290 [1,0,0,0,0,0|3,0,0]=4 570 B6R0.6 BrCCCCCBr MCULE-7929769310 [1,0,0,0,0,0|2,0,0]=3 571 B6R0.6 BrCCNCCBr MCULE-8656215402 [1,0,0,0,0,0|3,0,0]=4 572 B6R0.6 BrCCOCCBr MCULE-7971589019 [1,0,0,0,0,0|3,0,0]=4 573 B6R0.6 BrCCSCCBr MCULE-9680858393 [1,0,0,0,0,0|3,0,0]=4 574 B6R0.6 BrCC[NH2+]CCBr MCULE-8263104784 [1,0,0,0,0,0|3,0,0]=4 575 B6R0.6 C#CCCCCBr MCULE-9086746106 [1,0,0,0,0,0|1,0,2]=4 576 B6R0.6 C#CCCCCC MCULE-7776756434 [1,0,0,0,0,0|1,0,1]=3 577 B6R0.6 C#CCCCCCl MCULE-3718113550 [1,0,0,0,0,0|1,0,2]=4 578 B6R0.6 C#CCCCCI MCULE-6799128140 [1,0,0,0,0,0|1,0,2]=4 579 B6R0.6 C#CCCCCN MCULE-1313888655 [1,0,0,0,0,0|1,0,2]=4 580 B6R0.6 C#CCCCCN MCULE-5521830994 [1,0,0,0,0,0|1,0,2]=4 581 B6R0.6 C#CCCCCO MCULE-2977997146 [1,0,0,0,0,0|0,0,2]=3 582 B6R0.6 C#CCCCNC MCULE-4472877921 [1,0,0,0,0,0|2,0,1]=4 583 B6R0.6 C#CCCCNC MCULE-9185657315 [1,0,0,0,0,0|2,0,1]=4 584 B6R0.6 C#CCCCOC MCULE-3174650949 [1,0,0,0,0,0|2,0,1]=4 585 B6R0.6 C#CCCSCC MCULE-1094584940 [1,0,0,0,0,0|2,0,1]=4 586 B6R0.6 C#CCNCCC MCULE-7880884278 [1,0,0,0,0,0|2,0,1]=4 587 B6R0.6 C#CCNCCC MCULE-8975069665 [1,0,0,0,0,0|2,0,1]=4 588 B6R0.6 C#CCNCCO MCULE-4984192820 [1,0,0,0,0,0|1,0,2]=4 589 B6R0.6 C#CCOCCO MCULE-4502913039 [1,0,0,0,0,0|1,0,2]=4 590 B6R0.6 C#CCSCCO MCULE-6167723961 [1,0,0,0,0,0|1,0,2]=4 591 B6R0.6 C(=C/CCC)\CO MCULE-6491762150 [1,0,0,0,0,0|0,0,2]=3 592 B6R0.6 C/C=C/CCCC MCULE-6900331316 [1,0,0,0,0,0|1,0,2]=4 593 B6R0.6 C/C=C/CCCO MCULE-9865436125 [1,0,0,0,0,0|0,0,2]=3 594 B6R0.6 C/C=C\CCCC MCULE-8426867799 [1,0,0,0,0,0|1,0,2]=4 595 B6R0.6 C/C=C\CCCO MCULE-3169839661 [1,0,0,0,0,0|0,0,2]=3 596 B6R0.6 C=CCCCCBr MCULE-4313298656 [1,0,0,0,0,0|1,0,2]=4 597 B6R0.6 C=CCCCCC MCULE-5868303078 [1,0,0,0,0,0|1,0,1]=3 598 B6R0.6 C=CCCCCCl MCULE-7600727876 [1,0,0,0,0,0|1,0,2]=4 599 B6R0.6 C=CCCCCI MCULE-5694143061 [1,0,0,0,0,0|1,0,2]=4 600 B6R0.6 C=CCCCCN MCULE-1489231988 [1,0,0,0,0,0|1,0,2]=4 601 B6R0.6 C=CCCCCN MCULE-4288584778 [1,0,0,0,0,0|1,0,2]=4 602 B6R0.6 C=CCCCCO MCULE-3631432277 [1,0,0,0,0,0|0,0,2]=3 603 B6R0.6 C=CCCCNC MCULE-6696525157 [1,0,0,0,0,0|2,0,1]=4 604 B6R0.6 C=CCCCNC MCULE-7417274044 [1,0,0,0,0,0|2,0,1]=4 605 B6R0.6 C=CCNCCC MCULE-4239068147 [1,0,0,0,0,0|2,0,1]=4 606 B6R0.6 C=CCNCCC MCULE-9778489216 [1,0,0,0,0,0|2,0,1]=4 607 B6R0.6 C=CCNCCO MCULE-5860509324 [1,0,0,0,0,0|1,0,2]=4 608 B6R0.6 C=CCOCCO MCULE-5718868633 [1,0,0,0,0,0|1,0,2]=4 609 B6R0.6 C=CCSCCC MCULE-3855352363 [1,0,0,0,0,0|2,0,1]=4 610 B6R0.6 C=COCCCC MCULE-2025922328 [1,0,0,0,0,0|2,0,1]=4 611 B6R0.6 C=COCCCO MCULE-8325617945 [1,0,0,0,0,0|1,0,2]=4 612 B6R0.6 CC#CCCCBr MCULE-8545908172 [1,0,0,0,0,0|1,0,2]=4 613 B6R0.6 CC#CCCCC MCULE-1899332515 [1,0,0,0,0,0|1,0,2]=4 614 B6R0.6 CC#CCCCO MCULE-6502564684 [1,0,0,0,0,0|0,0,2]=3 615 B6R0.6 CC/C=C/CCC MCULE-5222700461 [1,0,0,0,0,0|1,0,2]=4 616 B6R0.6 CC/C=C/CCO MCULE-9853729917 [1,0,0,0,0,0|0,0,2]=3 617 B6R0.6 CC/C=C\CCO MCULE-9206958060 [1,0,0,0,0,0|0,0,2]=3 618 B6R0.6 CC=CCCCBr MCULE-1109208969 [1,0,0,0,0,0|1,0,2]=4 619 B6R0.6 CC=CCCCC MCULE-7277981733 [1,0,0,0,0,0|1,0,2]=4 620 B6R0.6 CC=CCCCCl MCULE-7487798637 [1,0,0,0,0,0|1,0,2]=4 621 B6R0.6 CC=CCCCO MCULE-1401303632 [1,0,0,0,0,0|0,0,2]=3 622 B6R0.6 CCC#CCCBr MCULE-2188447221 [1,0,0,0,0,0|1,0,2]=4 623 B6R0.6 CCC#CCCC MCULE-9615607532 [1,0,0,0,0,0|1,0,2]=4 624 B6R0.6 CCC#CCCO MCULE-1699744538 [1,0,0,0,0,0|0,0,2]=3 625 B6R0.6 CCC=CCCBr MCULE-7873583643 [1,0,0,0,0,0|1,0,2]=4 626 B6R0.6 CCC=CCCC MCULE-3739501724 [1,0,0,0,0,0|1,0,2]=4 627 B6R0.6 CCC=CCCI MCULE-9416216252 [1,0,0,0,0,0|1,0,2]=4 628 B6R0.6 CCC=CCCO MCULE-1781375433 [1,0,0,0,0,0|0,0,2]=3 629 B6R0.6 CCCC#CCO MCULE-8352024607 [1,0,0,0,0,0|0,0,2]=3 630 B6R0.6 CCCC=CCBr MCULE-2474104566 [1,0,0,0,0,0|1,0,2]=4 631 B6R0.6 CCCC=CCO MCULE-3204738641 [1,0,0,0,0,0|0,0,2]=3 632 B6R0.6 CCCCCC#N MCULE-7596791521 [1,0,0,0,0,0|1,0,1]=3 633 B6R0.6 CCCCCC=O MCULE-6770578514 [1,0,0,0,0,0|0,0,2]=3 634 B6R0.6 CCCCCCBr MCULE-6022503394 [1,0,0,0,0,0|1,0,0]=2 635 B6R0.6 CCCCCCC MCULE-5817084747 [1,0,0,0,0,0|1,0,0]=2 636 B6R0.6 CCCCCCCl MCULE-3706149525 [1,0,0,0,0,0|1,0,0]=2 637 B6R0.6 CCCCCCF MCULE-4320903575 [1,0,0,0,0,0|1,0,0]=2 638 B6R0.6 CCCCCCI MCULE-1021236615 [1,0,0,0,0,0|1,0,0]=2 639 B6R0.6 CCCCCCN MCULE-2944455155 [1,0,0,0,0,0|1,0,0]=2 640 B6R0.6 CCCCCCN MCULE-6014217174 [1,0,0,0,0,0|1,0,0]=2 641 B6R0.6 CCCCCCN MCULE-6021451227 [1,0,0,0,0,0|1,0,0]=2 642 B6R0.6 CCCCCCO MCULE-4299150163 [1,0,0,0,0,0|0,0,0]=1 643 B6R0.6 CCCCCCS MCULE-5962964855 [1,0,0,0,0,0|0,1,0]=2 644 B6R0.6 CCCCCNC MCULE-8082703734 [1,0,0,0,0,0|2,0,0]=3 645 B6R0.6 CCCCCNN MCULE-5089668540 [1,0,0,0,0,0|2,0,0]=3 646 B6R0.6 CCCCCNN MCULE-7265120524 [1,0,0,0,0,0|2,0,0]=3 647 B6R0.6 CCCCCOC MCULE-3370181741 [1,0,0,0,0,0|2,0,0]=3 648 B6R0.6 CCCCCON MCULE-5372426564 [1,0,0,0,0,0|2,0,0]=3 649 B6R0.6 CCCCCON MCULE-8557641459 [1,0,0,0,0,0|2,0,0]=3 650 B6R0.6 CCCCCSC MCULE-6566108868 [1,0,0,0,0,0|2,0,0]=3 651 B6R0.6 CCCCN=C=O MCULE-3381327717 [1,0,0,0,0,0|1,0,2]=4 652 B6R0.6 CCCCN=C=S MCULE-3952129182 [1,0,0,0,0,0|1,1,1]=4 653 B6R0.6 CCCCN=N#N MCULE-4207638779 [1,0,0,0,0,0|3,0,0]=4 654 B6R0.6 CCCCNC=O MCULE-8821792924 [1,0,0,0,0,0|1,0,2]=4 655 B6R0.6 CCCCNCC MCULE-8816750429 [1,0,0,0,0,0|2,0,0]=3 656 B6R0.6 CCCCNOC MCULE-4265481432 [1,0,0,0,0,0|3,0,0]=4 657 B6R0.6 CCCCOC=O MCULE-4633421026 [1,0,0,0,0,0|1,0,2]=4 658 B6R0.6 CCCCOCC MCULE-5662731951 [1,0,0,0,0,0|2,0,0]=3 659 B6R0.6 CCCCOCCl MCULE-5282964693 [1,0,0,0,0,0|2,0,0]=3 660 B6R0.6 CCCCON=O MCULE-9992790020 [1,0,0,0,0,0|2,0,1]=4 661 B6R0.6 CCCCSC#N MCULE-4585387956 [1,0,0,0,0,0|2,0,1]=4 662 B6R0.6 CCCCSCC MCULE-4832924468 [1,0,0,0,0,0|2,0,0]=3 663 B6R0.6 CCCCSCCl MCULE-4907770015 [1,0,0,0,0,0|2,0,0]=3 664 B6R0.6 CCCNCC#N MCULE-3452380054 [1,0,0,0,0,0|2,0,1]=4 665 B6R0.6 CCCNCCC MCULE-1452672638 [1,0,0,0,0,0|2,0,0]=3 666 B6R0.6 CCCNCCC MCULE-6223802621 [1,0,0,0,0,0|2,0,0]=3 667 B6R0.6 CCCNCCC MCULE-6789654118 [1,0,0,0,0,0|2,0,0]=3 668 B6R0.6 CCCNCCN MCULE-2288945868 [1,0,0,0,0,0|2,0,0]=3 669 B6R0.6 CCCNCCO MCULE-4813687741 [1,0,0,0,0,0|1,0,0]=2 670 B6R0.6 CCCNOCC MCULE-1349462426 [1,0,0,0,0,0|3,0,0]=4 671 B6R0.6 CCCNOCC MCULE-7159087335 [1,0,0,0,0,0|3,0,0]=4 672 B6R0.6 CCCOCC#N MCULE-7011471802 [1,0,0,0,0,0|2,0,1]=4 673 B6R0.6 CCCOCCC MCULE-1390130917 [1,0,0,0,0,0|2,0,0]=3 674 B6R0.6 CCCOCCCl MCULE-6561613708 [1,0,0,0,0,0|2,0,0]=3 675 B6R0.6 CCCOCCI MCULE-5330098176 [1,0,0,0,0,0|2,0,0]=3 676 B6R0.6 CCCOCCN MCULE-1987261931 [1,0,0,0,0,0|2,0,0]=3 677 B6R0.6 CCCOCCN MCULE-9033871038 [1,0,0,0,0,0|2,0,0]=3 678 B6R0.6 CCCOCCO MCULE-3263526264 [1,0,0,0,0,0|1,0,0]=2 679 B6R0.6 CCCSCCC MCULE-5531652471 [1,0,0,0,0,0|2,0,0]=3 680 B6R0.6 CCCSCCN MCULE-3934428121 [1,0,0,0,0,0|2,0,0]=3 681 B6R0.6 CCCSCCN MCULE-5705755172 [1,0,0,0,0,0|2,0,0]=3 682 B6R0.6 CCCSCCO MCULE-8371796663 [1,0,0,0,0,0|1,0,0]=2 683 B6R0.6 CCCSSCC MCULE-7192921435 [1,0,0,0,0,0|3,0,0]=4 684 B6R0.6 CCNCCC#N MCULE-8589229962 [1,0,0,0,0,0|2,0,1]=4 685 B6R0.6 CCNCCCN MCULE-5811169148 [1,0,0,0,0,0|2,0,0]=3 686 B6R0.6 CCNCCCO MCULE-3251610052 [1,0,0,0,0,0|1,0,0]=2 687 B6R0.6 CCNCCNC MCULE-9372339393 [1,0,0,0,0,0|3,0,0]=4 688 B6R0.6 CCNCCOC MCULE-1476772953 [1,0,0,0,0,0|3,0,0]=4 689 B6R0.6 CCNCCOC MCULE-6652489795 [1,0,0,0,0,0|3,0,0]=4 690 B6R0.6 CCNCCSC MCULE-1736157320 [1,0,0,0,0,0|3,0,0]=4 691 B6R0.6 CCNCCSC MCULE-9369049891 [1,0,0,0,0,0|3,0,0]=4 692 B6R0.6 CCOCCC#N MCULE-4907543374 [1,0,0,0,0,0|2,0,1]=4 693 B6R0.6 CCOCCC=O MCULE-1664130148 [1,0,0,0,0,0|1,0,2]=4 694 B6R0.6 CCOCCCBr MCULE-6544747281 [1,0,0,0,0,0|2,0,0]=3 695 B6R0.6 CCOCCCCl MCULE-8523618681 [1,0,0,0,0,0|2,0,0]=3 696 B6R0.6 CCOCCCI MCULE-6640732668 [1,0,0,0,0,0|2,0,0]=3 697 B6R0.6 CCOCCCN MCULE-3491529722 [1,0,0,0,0,0|2,0,0]=3 698 B6R0.6 CCOCCCO MCULE-3077567484 [1,0,0,0,0,0|1,0,0]=2 699 B6R0.6 CCOCCNC MCULE-5244682559 [1,0,0,0,0,0|3,0,0]=4 700 B6R0.6 CCOCCNC MCULE-9344296133 [1,0,0,0,0,0|3,0,0]=4 701 B6R0.6 CCOCCNN MCULE-2995792378 [1,0,0,0,0,0|3,0,0]=4 702 B6R0.6 CCOCCNN MCULE-7756116612 [1,0,0,0,0,0|3,0,0]=4 703 B6R0.6 CCOCCOC MCULE-2753000412 [1,0,0,0,0,0|3,0,0]=4 704 B6R0.6 CCOCCON MCULE-6072859154 [1,0,0,0,0,0|3,0,0]=4 705 B6R0.6 CCOCCON MCULE-7716477934 [1,0,0,0,0,0|3,0,0]=4 706 B6R0.6 CCOCOCC MCULE-3885854108 [1,0,0,0,0,0|3,0,0]=4 707 B6R0.6 CCSCCC=O MCULE-2493452950 [1,0,0,0,0,0|1,0,2]=4 708 B6R0.6 CCSCCCBr MCULE-5143634954 [1,0,0,0,0,0|2,0,0]=3 709 B6R0.6 CCSCCCN MCULE-4566450606 [1,0,0,0,0,0|2,0,0]=3 710 B6R0.6 CCSCCCO MCULE-6719011943 [1,0,0,0,0,0|1,0,0]=2 711 B6R0.6 CCSCCNC MCULE-6159594076 [1,0,0,0,0,0|3,0,0]=4 712 B6R0.6 CCSCCNC MCULE-6696154047 [1,0,0,0,0,0|3,0,0]=4 713 B6R0.6 CCSCSCC MCULE-6005869091 [1,0,0,0,0,0|3,0,0]=4 714 B6R0.6 CNCC#CCO MCULE-4900527922 [1,0,0,0,0,0|1,0,2]=4 715 B6R0.6 CNCCCC#N MCULE-2995077554 [1,0,0,0,0,0|2,0,1]=4 716 B6R0.6 CNCCCC#N MCULE-4831210709 [1,0,0,0,0,0|2,0,1]=4 717 B6R0.6 CNCCCCBr MCULE-4148452640 [1,0,0,0,0,0|2,0,0]=3 718 B6R0.6 CNCCCCBr MCULE-8686440557 [1,0,0,0,0,0|2,0,0]=3 719 B6R0.6 CNCCCCCl MCULE-1170786568 [1,0,0,0,0,0|2,0,0]=3 720 B6R0.6 CNCCCCCl MCULE-1726466829 [1,0,0,0,0,0|2,0,0]=3 721 B6R0.6 CNCCCCN MCULE-2542685963 [1,0,0,0,0,0|2,0,0]=3 722 B6R0.6 CNCCCCN MCULE-7925344560 [1,0,0,0,0,0|2,0,0]=3 723 B6R0.6 CNCCCCO MCULE-9264393637 [1,0,0,0,0,0|1,0,0]=2 724 B6R0.6 CNCCCNC MCULE-3840224541 [1,0,0,0,0,0|3,0,0]=4 725 B6R0.6 CNCCCOC MCULE-4057126907 [1,0,0,0,0,0|3,0,0]=4 726 B6R0.6 CNCCCOC MCULE-8552551858 [1,0,0,0,0,0|3,0,0]=4 727 B6R0.6 CNCCCSC MCULE-6553998750 [1,0,0,0,0,0|3,0,0]=4 728 B6R0.6 COCCCC#N MCULE-8739581354 [1,0,0,0,0,0|2,0,1]=4 729 B6R0.6 COCCCC=O MCULE-2055914202 [1,0,0,0,0,0|1,0,2]=4 730 B6R0.6 COCCCCBr MCULE-7500019583 [1,0,0,0,0,0|2,0,0]=3 731 B6R0.6 COCCCCCl MCULE-3863170338 [1,0,0,0,0,0|2,0,0]=3 732 B6R0.6 COCCCCN MCULE-9584631056 [1,0,0,0,0,0|2,0,0]=3 733 B6R0.6 COCCCCO MCULE-2543196930 [1,0,0,0,0,0|1,0,0]=2 734 B6R0.6 COCCCCO MCULE-8659106280 [1,0,0,0,0,0|1,0,0]=2 735 B6R0.6 COCCCNN MCULE-5097653856 [1,0,0,0,0,0|3,0,0]=4 736 B6R0.6 COCCCNN MCULE-7758841774 [1,0,0,0,0,0|3,0,0]=4 737 B6R0.6 COCCCOC MCULE-5003816236 [1,0,0,0,0,0|3,0,0]=4 738 B6R0.6 COCCCON MCULE-3859091617 [1,0,0,0,0,0|3,0,0]=4 739 B6R0.6 COCCCON MCULE-4419390097 [1,0,0,0,0,0|3,0,0]=4 740 B6R0.6 COCCOCCl MCULE-6701095927 [1,0,0,0,0,0|3,0,0]=4 741 B6R0.6 COCOCCBr MCULE-8856323357 [1,0,0,0,0,0|3,0,0]=4 742 B6R0.6 COCOCCI MCULE-4444019738 [1,0,0,0,0,0|3,0,0]=4 743 B6R0.6 COCOCCN MCULE-7974740048 [1,0,0,0,0,0|3,0,0]=4 744 B6R0.6 COCOCCO MCULE-8093241209 [1,0,0,0,0,0|2,0,0]=3 745 B6R0.6 CONCCCN MCULE-4780444103 [1,0,0,0,0,0|3,0,0]=4 746 B6R0.6 CONCCCN MCULE-6095720673 [1,0,0,0,0,0|3,0,0]=4 747 B6R0.6 CONCCCN MCULE-9121351484 [1,0,0,0,0,0|3,0,0]=4 748 B6R0.6 CSCCCC=O MCULE-6353729217 [1,0,0,0,0,0|1,0,2]=4 749 B6R0.6 CSCCCCN MCULE-2391033479 [1,0,0,0,0,0|2,0,0]=3 750 B6R0.6 CSCCCCO MCULE-1045422424 [1,0,0,0,0,0|1,0,0]=2 751 B6R0.6 CSCCCON MCULE-2543326517 [1,0,0,0,0,0|3,0,0]=4 752 B6R0.6 CSCCCSC MCULE-6993538101 [1,0,0,0,0,0|3,0,0]=4 753 B6R0.6 ClCCCCCBr MCULE-6767883252 [1,0,0,0,0,0|2,0,0]=3 754 B6R0.6 ClCCCCCCl MCULE-9302388009 [1,0,0,0,0,0|2,0,0]=3 755 B6R0.6 ClCCCCCI MCULE-2173931817 [1,0,0,0,0,0|2,0,0]=3 756 B6R0.6 ClCCNCCCl MCULE-2453447059 [1,0,0,0,0,0|3,0,0]=4 757 B6R0.6 ClCCOCCCl MCULE-2189904184 [1,0,0,0,0,0|3,0,0]=4 758 B6R0.6 ClCCOCCI MCULE-8666203040 [1,0,0,0,0,0|3,0,0]=4 759 B6R0.6 FCCCCCBr MCULE-1314383985 [1,0,0,0,0,0|2,0,0]=3 760 B6R0.6 ICCCCCI MCULE-2889089700 [1,0,0,0,0,0|2,0,0]=3 761 B6R0.6 ICCOCCI MCULE-8427607007 [1,0,0,0,0,0|3,0,0]=4 762 B6R0.6 N#CCCCCBr MCULE-7152608116 [1,0,0,0,0,0|2,0,1]=4 763 B6R0.6 N#CCCCCCl MCULE-9317036806 [1,0,0,0,0,0|2,0,1]=4 764 B6R0.6 N#CCCCCF MCULE-1200512715 [1,0,0,0,0,0|2,0,1]=4 765 B6R0.6 N#CCCCCI MCULE-8000340428 [1,0,0,0,0,0|2,0,1]=4 766 B6R0.6 N#CCCCCN MCULE-4183048720 [1,0,0,0,0,0|2,0,1]=4 767 B6R0.6 N#CCCCCN MCULE-4775375165 [1,0,0,0,0,0|2,0,1]=4 768 B6R0.6 N#CCCCCO MCULE-4289736283 [1,0,0,0,0,0|1,0,1]=3 769 B6R0.6 N#CCCCCS MCULE-6284171080 [1,0,0,0,0,0|1,1,1]=4 770 B6R0.6 N#N=NCCCO MCULE-3148876760 [1,0,0,0,0,0|3,0,0]=4 771 B6R0.6 NCCCCCBr MCULE-3577483607 [1,0,0,0,0,0|2,0,0]=3 772 B6R0.6 NCCCCCBr MCULE-7572691537 [1,0,0,0,0,0|2,0,0]=3 773 B6R0.6 NCCCCCF MCULE-1057270243 [1,0,0,0,0,0|2,0,0]=3 774 B6R0.6 NCCCCCN MCULE-3785554987 [1,0,0,0,0,0|2,0,0]=3 775 B6R0.6 NCCCCCN MCULE-5173983982 [1,0,0,0,0,0|2,0,0]=3 776 B6R0.6 NCCCCCO MCULE-8877250712 [1,0,0,0,0,0|1,0,0]=2 777 B6R0.6 NCCCCCS MCULE-1813104379 [1,0,0,0,0,0|1,1,0]=3 778 B6R0.6 NCCCCCS MCULE-6081835870 [1,0,0,0,0,0|1,1,0]=3 779 B6R0.6 NCCCCNO MCULE-6478748569 [1,0,0,0,0,0|2,0,0]=3 780 B6R0.6 NCCNCCCl MCULE-8909584172 [1,0,0,0,0,0|3,0,0]=4 781 B6R0.6 NCCNCCCl MCULE-9412103836 [1,0,0,0,0,0|3,0,0]=4 782 B6R0.6 NCCNCCN MCULE-4710767146 [1,0,0,0,0,0|3,0,0]=4 783 B6R0.6 NCCNCCN MCULE-4803305991 [1,0,0,0,0,0|3,0,0]=4 784 B6R0.6 NCCNCCO MCULE-2112359407 [1,0,0,0,0,0|2,0,0]=3 785 B6R0.6 NCCOCCBr MCULE-6520580224 [1,0,0,0,0,0|3,0,0]=4 786 B6R0.6 NCCOCCCl MCULE-1975521529 [1,0,0,0,0,0|3,0,0]=4 787 B6R0.6 NCCOCCCl MCULE-9715175348 [1,0,0,0,0,0|3,0,0]=4 788 B6R0.6 NCCOCCF MCULE-4126568309 [1,0,0,0,0,0|3,0,0]=4 789 B6R0.6 NCCOCCF MCULE-4641621710 [1,0,0,0,0,0|3,0,0]=4 790 B6R0.6 NCCOCCN MCULE-1630934305 [1,0,0,0,0,0|3,0,0]=4 791 B6R0.6 NCCOCCN MCULE-3282393357 [1,0,0,0,0,0|3,0,0]=4 792 B6R0.6 NCCOCCN MCULE-3788231540 [1,0,0,0,0,0|3,0,0]=4 793 B6R0.6 NCCOCCO MCULE-1073574088 [1,0,0,0,0,0|2,0,0]=3 794 B6R0.6 NCCSCCN MCULE-4317147284 [1,0,0,0,0,0|3,0,0]=4 795 B6R0.6 NCCSCCN MCULE-5449033874 [1,0,0,0,0,0|3,0,0]=4 796 B6R0.6 NCCSCCO MCULE-1475378446 [1,0,0,0,0,0|2,0,0]=3 797 B6R0.6 NNCCCCO MCULE-3928748589 [1,0,0,0,0,0|2,0,0]=3 798 B6R0.6 O=CCCCCCl MCULE-1257670284 [1,0,0,0,0,0|1,0,2]=4 799 B6R0.6 O=CCCCCO MCULE-7959082228 [1,0,0,0,0,0|1,0,1]=3 800 B6R0.6 O=CNCCCO MCULE-7926485528 [1,0,0,0,0,0|2,0,1]=4 801 B6R0.6 O=NCNCCO MCULE-4478167391 [1,0,0,0,0,0|3,0,0]=4 802 B6R0.6 OCCCCCBr MCULE-1444733196 [1,0,0,0,0,0|1,0,0]=2 803 B6R0.6 OCCCCCCl MCULE-5666058059 [1,0,0,0,0,0|1,0,0]=2 804 B6R0.6 OCCCCCF MCULE-9253204275 [1,0,0,0,0,0|1,0,0]=2 805 B6R0.6 OCCCCCI MCULE-8707758496 [1,0,0,0,0,0|1,0,0]=2 806 B6R0.6 OCCCCCO MCULE-1044076048 [1,0,0,0,0,0|1,0,0]=2 807 B6R0.6 OCCNCCCl MCULE-7809492267 [1,0,0,0,0,0|2,0,0]=3 808 B6R0.6 OCCNCCCl MCULE-9007709158 [1,0,0,0,0,0|2,0,0]=3 809 B6R0.6 OCCNCCO MCULE-9183096746 [1,0,0,0,0,0|2,0,0]=3 810 B6R0.6 OCCNCCO MCULE-9803420258 [1,0,0,0,0,0|2,0,0]=3 811 B6R0.6 OCCOCCBr MCULE-2641000270 [1,0,0,0,0,0|2,0,0]=3 812 B6R0.6 OCCOCCCl MCULE-7320539957 [1,0,0,0,0,0|2,0,0]=3 813 B6R0.6 OCCOCCF MCULE-1780385479 [1,0,0,0,0,0|2,0,0]=3 814 B6R0.6 OCCOCCI MCULE-1083607130 [1,0,0,0,0,0|2,0,0]=3 815 B6R0.6 OCCOCCO MCULE-1531783732 [1,0,0,0,0,0|2,0,0]=3 816 B6R0.6 OCCSCCO MCULE-5502656030 [1,0,0,0,0,0|2,0,0]=3 817 B6R0.6 OCCSCCS MCULE-4418561990 [1,0,0,0,0,0|2,0,0]=3 818 B6R0.6 SCCCCCS MCULE-4899719552 [1,0,0,0,0,0|1,1,0]=3 819 B6R0.6 SCCOCCS MCULE-6659110232 [1,0,0,0,0,0|2,1,0]=4 820 B6R0.6 SCCSCCS MCULE-1219600644 [1,0,0,0,0,0|2,1,0]=4 821 B6R0.6 [NH2+](CCCl)CCCl MCULE-9020671822 [1,0,0,0,0,0|3,0,0]=4 822 B8R0.1 C#CCC(N)CCOC MCULE-2275340352 [0,1,0,0,0,0|3,0,0]=4 823 B8R0.1 C#CCCC(O)CCN MCULE-1222620525 [0,1,0,0,0,0|1,0,2]=4 824 B8R0.1 C#CCCC(O)CCN MCULE-1377722654 [0,1,0,0,0,0|1,0,2]=4 825 B8R0.1 C=CCC(=O)CCCC MCULE-4100882049 [0,1,0,0,0,0|1,0,2]=4 826 B8R0.1 C=CCC(O)CCCC MCULE-4055894447 [0,1,0,0,0,0|1,0,0]=2 827 B8R0.1 C=CCCC(O)CCC MCULE-4495559867 [0,1,0,0,0,0|1,0,2]=4 828 B8R0.1 CCCC(C)CCCBr MCULE-3368342552 [0,1,0,0,0,0|3,0,0]=4 829 B8R0.1 CCCC(C)CCCO MCULE-9229761768 [0,1,0,0,0,0|3,0,0]=4 830 B8R0.1 CCCC(O)CCCO MCULE-4169738114 [0,1,0,0,0,0|2,0,0]=3 831 B8R0.1 CCCC(O)CCCS MCULE-9595771348 [0,1,0,0,0,0|2,0,0]=3 832 B8R0.1 CCCCC(=N)OCC MCULE-3866961773 [0,1,0,0,0,0|2,0,1]=4 833 B8R0.1 CCCCC(=N)OCC MCULE-6116145724 [0,1,0,0,0,0|2,0,1]=4 834 B8R0.1 CCCCC(=O)CCC MCULE-5459540473 [0,1,0,0,0,0|1,0,2]=4 835 B8R0.1 CCCCC(=O)COC MCULE-7059597173 [0,1,0,0,0,0|0,0,2]=3 836 B8R0.1 CCCCC(=O)OCC MCULE-1219537918 [0,1,0,0,0,0|1,0,2]=4 837 B8R0.1 CCCCC(=O)OCCl MCULE-1974449433 [0,1,0,0,0,0|1,0,2]=4 838 B8R0.1 CCCCC(Br)CCC MCULE-1998636531 [0,1,0,0,0,0|2,0,0]=3 839 B8R0.1 CCCCC(C)CCO MCULE-7796394440 [0,1,0,0,0,0|1,0,0]=2 840 B8R0.1 CCCCC(N)CCC MCULE-5245074866 [0,1,0,0,0,0|2,0,0]=3 841 B8R0.1 CCCCC(N)CCO MCULE-1718868981 [0,1,0,0,0,0|1,0,0]=2 842 B8R0.1 CCCCC(N)CCO MCULE-6967408250 [0,1,0,0,0,0|1,0,0]=2 843 B8R0.1 CCCCC(N)CCO MCULE-7169926590 [0,1,0,0,0,0|1,0,0]=2 844 B8R0.1 CCCCC(N)CCO MCULE-7195068070 [0,1,0,0,0,0|1,0,0]=2 845 B8R0.1 CCCCC(N)COC MCULE-6869672438 [0,1,0,0,0,0|1,0,0]=2 846 B8R0.1 CCCCC(O)CCC MCULE-6030672439 [0,1,0,0,0,0|1,0,0]=2 847 B8R0.1 CCCCC(O)CCO MCULE-1527111701 [0,1,0,0,0,0|0,0,0]=1 848 B8R0.1 CCCCN(C)CCCl MCULE-1630310554 [0,1,0,0,0,0|3,0,0]=4 849 B8R0.1 CCCCN(C)CCCl MCULE-9938629831 [0,1,0,0,0,0|3,0,0]=4 850 B8R0.1 CCCCN(C)CCN MCULE-9574296650 [0,1,0,0,0,0|3,0,0]=4 851 B8R0.1 CCCCN(C)CCO MCULE-9224761648 [0,1,0,0,0,0|2,0,0]=3 852 B8R0.1 CCCCS(=O)CCO MCULE-9422446521 [0,1,0,0,0,0|1,0,1]=3 853 B8R0.1 CCCC[C@H](N)CCO MCULE-1556286414 [0,1,0,0,0,0|1,0,0]=2 854 B8R0.1 CCCC[C@H](N)CCO MCULE-5421326968 [0,1,0,0,0,0|1,0,0]=2 855 B8R0.1 CCCC[C@H](N)CCO MCULE-8706513986 [0,1,0,0,0,0|1,0,0]=2 856 B8R0.1 CCCOC(=O)CCO MCULE-7390309329 [0,1,0,0,0,0|1,0,2]=4 857 B8R0.1 CCOCC(C)OCC MCULE-9619057787 [0,1,0,0,0,0|3,0,0]=4 858 B8R0.1 CN(CCO)CCCN MCULE-8815292888 [0,1,0,0,0,0|3,0,0]=4 859 B8R0.1 CNCCN(C)CCO MCULE-5336182797 [0,1,0,0,0,0|3,0,0]=4 860 B8R0.1 CNCCN(C)CCO MCULE-6704675781 [0,1,0,0,0,0|3,0,0]=4 861 B8R0.1 COCCC(=O)COC MCULE-3111860636 [0,1,0,0,0,0|1,0,2]=4 862 B8R0.1 COCCC(N)COC MCULE-7022239439 [0,1,0,0,0,0|2,0,0]=3 863 B8R0.1 COCCN(C)CCO MCULE-1370396401 [0,1,0,0,0,0|3,0,0]=4 864 B8R0.1 COC[C@@H](O)CN=[N+]=[N-] MCULE-2390473403 [0,1,0,0,0,0|3,0,0]=4 865 B8R0.1 COC[C@H](O)CN=[N+]=[N-] MCULE-1934525371 [0,1,0,0,0,0|3,0,0]=4 866 B8R0.3 C#CC(O)C(C)CCC MCULE-8667738033 [0,1,0,0,0,0|1,0,1]=3 867 B8R0.3 CCCC(=O)C(Br)CC MCULE-6260182699 [0,1,0,0,0,0|2,0,1]=4 868 B8R0.3 CCCC(=O)C(C)CC MCULE-7559638932 [0,1,0,0,0,0|2,0,1]=4 869 B8R0.3 CCCC(=O)C(N)CO MCULE-4196745965 [0,1,0,0,0,0|1,0,1]=3 870 B8R0.3 CCCC(=O)C(N)CO MCULE-9001126199 [0,1,0,0,0,0|1,0,1]=3 871 B8R0.3 CCCC(C)C(=O)CC MCULE-9990200653 [0,1,0,0,0,0|1,0,2]=4 872 B8R0.3 CCCC(C)C(C)CC MCULE-1049161950 [0,1,0,0,0,0|2,0,0]=3 873 B8R0.3 CCCC(C)C(N)CO MCULE-7204075039 [0,1,0,0,0,0|1,0,0]=2 874 B8R0.3 CCCC(C)C(N)CO MCULE-9206965368 [0,1,0,0,0,0|1,0,0]=2 875 B8R0.3 CCCC(C)C(O)CC MCULE-5128705007 [0,1,0,0,0,0|1,0,0]=2 876 B8R0.3 CCCC(N)C(=O)NO MCULE-2069838283 [0,1,0,0,0,0|1,0,2]=4 877 B8R0.3 CCCC(O)C(C)CC MCULE-5746279508 [0,1,0,0,0,0|2,0,0]=3 878 B8R0.3 CCCC(O)C(N)CO MCULE-6983866986 [0,1,0,0,0,0|1,0,0]=2 879 B8R0.3 CCOC(=O)C(C)CO MCULE-7936560025 [0,1,0,0,0,0|2,0,1]=4 880 B8R0.3 CCOC(=O)C(N)CO MCULE-1666659750 [0,1,0,0,0,0|2,0,1]=4 881 B8R0.3 CCOC(=O)C(N)CO MCULE-1998512614 [0,1,0,0,0,0|2,0,1]=4 882 B8R0.3 CCOC(=O)C(N)CO MCULE-2382743439 [0,1,0,0,0,0|2,0,1]=4 883 B8R0.3 CCOC(=O)C(N)CO MCULE-8735565522 [0,1,0,0,0,0|2,0,1]=4 884 B8R0.3 CCOC(=O)C(O)CC MCULE-7418568069 [0,1,0,0,0,0|2,0,1]=4 885 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-3922789205 [0,1,0,0,0,0|2,0,1]=4 886 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-4123182744 [0,1,0,0,0,0|2,0,1]=4 887 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-9348155020 [0,1,0,0,0,0|2,0,1]=4 888 B8R0.3 CCOC(=O)[C@@H](O)CC MCULE-5702747043 [0,1,0,0,0,0|2,0,1]=4 889 B8R0.3 CCOC(=O)[C@@H](O)CC MCULE-6151562245 [0,1,0,0,0,0|2,0,1]=4 890 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-5633972344 [0,1,0,0,0,0|2,0,1]=4 891 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-6411527516 [0,1,0,0,0,0|2,0,1]=4 892 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-9780267969 [0,1,0,0,0,0|2,0,1]=4 893 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-9929488925 [0,1,0,0,0,0|2,0,1]=4 894 B8R0.3 CCOC(=O)[C@H](O)CC MCULE-8200594440 [0,1,0,0,0,0|2,0,1]=4 895 B8R0.3 O=CCC(O)C(O)CO MCULE-3895407431 [0,1,0,0,0,0|1,0,1]=3 896 B8R0.3 O=CC[C@@H](O)[C@@H](O)CO MCULE-1639637147 [0,1,0,0,0,0|1,0,1]=3 897 B8R0.3 O=CC[C@@H](O)[C@@H](O)CO MCULE-4968821647 [0,1,0,0,0,0|1,0,1]=3 898 B8R0.3 O=CC[C@@H](O)[C@H](O)CO MCULE-5691852027 [0,1,0,0,0,0|1,0,1]=3 899 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-4741377107 [0,1,0,0,0,0|1,0,1]=3 900 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-6728124442 [0,1,0,0,0,0|1,0,1]=3 901 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-7223741689 [0,1,0,0,0,0|1,0,1]=3 902 B8R0.3 [C@H](N)(CO)C(=O)OCC MCULE-8379845791 [0,1,0,0,0,0|2,0,1]=4 903 B8R0.6 C#CC(O)CCCCC MCULE-3860216745 [0,1,0,0,0,0|1,0,1]=3 904 B8R0.6 C#CC(O)CCCCC MCULE-6741270715 [0,1,0,0,0,0|1,0,1]=3 905 B8R0.6 C#CCCC[C@@H](N)CO MCULE-2559437973 [0,1,0,0,0,0|1,0,1]=3 906 B8R0.6 C#CCCC[C@@H](N)CO MCULE-9800548833 [0,1,0,0,0,0|1,0,1]=3 907 B8R0.6 C#CCCC[C@H](N)CO MCULE-1789980212 [0,1,0,0,0,0|1,0,1]=3 908 B8R0.6 C#CCCC[C@H](N)CO MCULE-7070205347 [0,1,0,0,0,0|1,0,1]=3 909 B8R0.6 C#C[C@@H](O)CCCCC MCULE-2098834943 [0,1,0,0,0,0|1,0,1]=3 910 B8R0.6 C#C[C@@H](O)CCCCC MCULE-4627033805 [0,1,0,0,0,0|1,0,1]=3 911 B8R0.6 C#C[C@H](O)CCCCC MCULE-6006340759 [0,1,0,0,0,0|1,0,1]=3 912 B8R0.6 C#C[C@H](O)CCCCC MCULE-8399407443 [0,1,0,0,0,0|1,0,1]=3 913 B8R0.6 C=CC(O)CCCCC MCULE-3974016765 [0,1,0,0,0,0|1,0,1]=3 914 B8R0.6 C=CCOCC(O)CN MCULE-8007017645 [0,1,0,0,0,0|1,0,2]=4 915 B8R0.6 C=CCOCC(O)CO MCULE-2581090167 [0,1,0,0,0,0|0,0,2]=3 916 B8R0.6 C=CCOC[C@H](O)CO MCULE-2586134581 [0,1,0,0,0,0|0,0,2]=3 917 B8R0.6 C=CCOC[C@H](O)CO MCULE-2761205966 [0,1,0,0,0,0|0,0,2]=3 918 B8R0.6 CCC#CCC(O)CC MCULE-9738694630 [0,1,0,0,0,0|1,0,1]=3 919 B8R0.6 CCC(C)CCCCO MCULE-9107164434 [0,1,0,0,0,0|2,0,0]=3 920 B8R0.6 CCC(C)NCCCN MCULE-5686538506 [0,1,0,0,0,0|3,0,0]=4 921 B8R0.6 CCCCCC(=N)NO MCULE-4721600537 [0,1,0,0,0,0|2,0,1]=4 922 B8R0.6 CCCCCC(=O)CBr MCULE-6642335283 [0,1,0,0,0,0|1,0,2]=4 923 B8R0.6 CCCCCC(=O)CC MCULE-2012071553 [0,1,0,0,0,0|1,0,2]=4 924 B8R0.6 CCCCCC(=O)NO MCULE-8432990947 [0,1,0,0,0,0|1,0,2]=4 925 B8R0.6 CCCCCC(Br)CBr MCULE-6200544642 [0,1,0,0,0,0|2,0,0]=3 926 B8R0.6 CCCCCC(C)CC MCULE-8343490845 [0,1,0,0,0,0|2,0,0]=3 927 B8R0.6 CCCCCC(C)CO MCULE-4884757032 [0,1,0,0,0,0|1,0,0]=2 928 B8R0.6 CCCCCC(O)CC MCULE-6682377557 [0,1,0,0,0,0|1,0,0]=2 929 B8R0.6 CCCCCC(O)CCl MCULE-5610334497 [0,1,0,0,0,0|1,0,0]=2 930 B8R0.6 CCCCCC(O)CN MCULE-6091710122 [0,1,0,0,0,0|1,0,0]=2 931 B8R0.6 CCCCCC(O)CO MCULE-4124719814 [0,1,0,0,0,0|0,0,0]=1 932 B8R0.6 CCCCNC(=O)CBr MCULE-4128795630 [0,1,0,0,0,0|1,0,2]=4 933 B8R0.6 CCCCNC(=O)CC MCULE-3176114265 [0,1,0,0,0,0|1,0,2]=4 934 B8R0.6 CCCCNC(=O)CCl MCULE-6162581938 [0,1,0,0,0,0|1,0,2]=4 935 B8R0.6 CCCCNC(=O)CN MCULE-2730890796 [0,1,0,0,0,0|1,0,2]=4 936 B8R0.6 CCCCNC(=O)CN MCULE-8794795131 [0,1,0,0,0,0|1,0,2]=4 937 B8R0.6 CCCCNC(C)CC MCULE-9849866712 [0,1,0,0,0,0|2,0,0]=3 938 B8R0.6 CCCCOC(=O)CBr MCULE-8883996630 [0,1,0,0,0,0|1,0,2]=4 939 B8R0.6 CCCCOC(=O)CC MCULE-4622389592 [0,1,0,0,0,0|1,0,2]=4 940 B8R0.6 CCCCOC(=O)CCl MCULE-1608118057 [0,1,0,0,0,0|1,0,2]=4 941 B8R0.6 CCCCOC(=O)CF MCULE-1355274212 [0,1,0,0,0,0|1,0,2]=4 942 B8R0.6 CCCCOC(=O)CN MCULE-9168260466 [0,1,0,0,0,0|1,0,2]=4 943 B8R0.6 CCCCOC(=O)CN MCULE-9585888268 [0,1,0,0,0,0|1,0,2]=4 944 B8R0.6 CCCCOC(=O)CO MCULE-4016266350 [0,1,0,0,0,0|0,0,2]=3 945 B8R0.6 CCCCOC(=O)CS MCULE-4331308025 [0,1,0,0,0,0|0,1,2]=4 946 B8R0.6 CCCNCC(O)CO MCULE-1611893086 [0,1,0,0,0,0|0,0,0]=1 947 B8R0.6 CCCOCC(C)CO MCULE-8326797774 [0,1,0,0,0,0|1,0,0]=2 948 B8R0.6 CCCOCC(O)CO MCULE-8815613620 [0,1,0,0,0,0|0,0,0]=1 949 B8R0.6 CCCOC[C@H](O)CO MCULE-7750792134 [0,1,0,0,0,0|0,0,0]=1 950 B8R0.6 CCNCCN(C)CC MCULE-4012963043 [0,1,0,0,0,0|3,0,0]=4 951 B8R0.6 CCSCCC(C)NC MCULE-8576737073 [0,1,0,0,0,0|3,0,0]=4 952 B8R0.6 CC[C@H](C)CCCCO MCULE-2674922341 [0,1,0,0,0,0|2,0,0]=3 953 B8R0.6 CC[C@H](C)CCCCO MCULE-7482991055 [0,1,0,0,0,0|2,0,0]=3 954 B8R0.6 N#CC(O)CCCCO MCULE-3554580179 [0,1,0,0,0,0|1,0,1]=3 955 B8R0.6 NCCCCC(N)CO MCULE-5938273372 [0,1,0,0,0,0|1,0,0]=2 956 B8R0.6 NCCCCC(N)CO MCULE-9464237285 [0,1,0,0,0,0|1,0,0]=2 957 B8R0.6 NCCCCC(N)CS MCULE-1078097453 [0,1,0,0,0,0|1,1,0]=3 958 B8R0.6 NCCCC[C@H](N)CO MCULE-4735749396 [0,1,0,0,0,0|1,0,0]=2 959 B8R0.6 NCCCC[C@H](N)CO MCULE-6997150748 [0,1,0,0,0,0|1,0,0]=2 960 B8R0.6 NCCCC[C@H](N)CO MCULE-7936699760 [0,1,0,0,0,0|1,0,0]=2 961 B8R0.6 NCCCC[C@H](N)CO MCULE-9135547877 [0,1,0,0,0,0|1,0,0]=2 962 B8R0.6 NCCNCC(O)CO MCULE-4818647623 [0,1,0,0,0,0|1,0,0]=2 963 B8R0.6 OC(CCl)COCCCl MCULE-4547951832 [0,1,0,0,0,0|2,0,0]=3 964 B8R0.6 OCCCCC(O)CO MCULE-5891501842 [0,1,0,0,0,0|0,0,0]=1 965 B8R0.6 OCCNCC(O)CO MCULE-1632492020 [0,1,0,0,0,0|1,0,0]=2 966 B8R0.6 OCCOCC(O)CCl MCULE-1530998868 [0,1,0,0,0,0|2,0,0]=3 967 B8R0.6 OCCOCC(O)CO MCULE-4768071463 [0,1,0,0,0,0|1,0,0]=2 968 B8R0.6 [C@H](O)(CC)CCCCC MCULE-7121730436 [0,1,0,0,0,0|1,0,0]=2 969 B8R0.6 [NH3+]CCCCC([NH3+])CBr MCULE-2049014685 [0,1,0,0,0,0|2,0,0]=3 970 B8R0.6 [NH3+]CCCCC([NH3+])CBr MCULE-6467063594 [0,1,0,0,0,0|2,0,0]=3 971 B8R0.8 C#CCCC(O)C(=O)O MCULE-1983462487 [0,1,0,0,0,0|0,0,3]=4 972 B8R0.8 C(N)(CCCC)C(=O)N MCULE-1406613793 [0,1,0,0,0,0|1,0,2]=4 973 B8R0.8 C(N)(CCCC)C(=O)N MCULE-4692008742 [0,1,0,0,0,0|1,0,2]=4 974 B8R0.8 CC(CCCCl)C(=O)O MCULE-6504631587 [0,1,0,0,0,0|2,0,1]=4 975 B8R0.8 CCCCC(=O)C(=O)O MCULE-7796922508 [0,1,0,0,0,0|0,0,3]=4 976 B8R0.8 CCCCC(=O)C(C)C MCULE-1905176805 [0,1,0,0,0,0|1,0,2]=4 977 B8R0.8 CCCCC(=O)C(C)N MCULE-1316684028 [0,1,0,0,0,0|1,0,2]=4 978 B8R0.8 CCCCC(=O)C(C)N MCULE-1846818051 [0,1,0,0,0,0|1,0,2]=4 979 B8R0.8 CCCCC(=O)C(C)N MCULE-6223994385 [0,1,0,0,0,0|1,0,2]=4 980 B8R0.8 CCCCC(=O)C(C)N MCULE-8594054065 [0,1,0,0,0,0|1,0,2]=4 981 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-4202397833 [0,1,0,0,0,0|1,0,2]=4 982 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-8156418445 [0,1,0,0,0,0|1,0,2]=4 983 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-8186118680 [0,1,0,0,0,0|1,0,2]=4 984 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-9214507863 [0,1,0,0,0,0|1,0,2]=4 985 B8R0.8 CCCCC(Br)C(=O)N MCULE-9831415558 [0,1,0,0,0,0|1,0,2]=4 986 B8R0.8 CCCCC(Br)C(=O)O MCULE-5428502537 [0,1,0,0,0,0|1,0,1]=3 987 B8R0.8 CCCCC(C)C(=O)C MCULE-2303839464 [0,1,0,0,0,0|1,0,2]=4 988 B8R0.8 CCCCC(C)C(=O)Cl MCULE-1718383314 [0,1,0,0,0,0|1,0,2]=4 989 B8R0.8 CCCCC(C)C(=O)N MCULE-6062124512 [0,1,0,0,0,0|1,0,2]=4 990 B8R0.8 CCCCC(C)C(=O)O MCULE-7933263354 [0,1,0,0,0,0|1,0,1]=3 991 B8R0.8 CCCCC(C)C(C)C MCULE-8506374473 [0,1,0,0,0,0|2,0,0]=3 992 B8R0.8 CCCCC(C)C(C)O MCULE-2881990446 [0,1,0,0,0,0|1,0,0]=2 993 B8R0.8 CCCCC(F)C(=O)O MCULE-2276381656 [0,1,0,0,0,0|1,0,1]=3 994 B8R0.8 CCCCC(N)C(=O)C MCULE-2471947344 [0,1,0,0,0,0|1,0,2]=4 995 B8R0.8 CCCCC(N)C(=O)C MCULE-4947552776 [0,1,0,0,0,0|1,0,2]=4 996 B8R0.8 CCCCC(N)C(=O)O MCULE-4930484202 [0,1,0,0,0,0|1,0,1]=3 997 B8R0.8 CCCCC(N)C(C)O MCULE-3645367149 [0,1,0,0,0,0|1,0,0]=2 998 B8R0.8 CCCCC(N)C(C)O MCULE-4512291097 [0,1,0,0,0,0|1,0,0]=2 999 B8R0.8 CCCCC(O)C(=O)N MCULE-1063256537 [0,1,0,0,0,0|0,0,2]=3 1000 B8R0.8 CCCCC(O)C(=O)O MCULE-2557585903 [0,1,0,0,0,0|0,0,1]=2 1001 B8R0.8 CCCCC(O)C(C)C MCULE-3997068945 [0,1,0,0,0,0|1,0,0]=2 1002 B8R0.8 CCCC[C@@H](C)C(=O)O MCULE-3454696473 [0,1,0,0,0,0|1,0,1]=3 1003 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-3687527484 [0,1,0,0,0,0|1,0,1]=3 1004 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-9410581572 [0,1,0,0,0,0|1,0,1]=3 1005 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9016844851 [0,1,0,0,0,0|1,0,1]=3 1006 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9437190196 [0,1,0,0,0,0|1,0,1]=3 1007 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-1555661156 [0,1,0,0,0,0|1,0,2]=4 1008 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9202467107 [0,1,0,0,0,0|1,0,2]=4 1009 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9573872199 [0,1,0,0,0,0|1,0,2]=4 1010 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9773159994 [0,1,0,0,0,0|1,0,2]=4 1011 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-3656145338 [0,1,0,0,0,0|1,0,1]=3 1012 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-7427914532 [0,1,0,0,0,0|1,0,1]=3 1013 B8R0.8 CCCNC(C)C(C)C MCULE-1587552934 [0,1,0,0,0,0|3,0,0]=4 1014 B8R0.8 CCCNC(C)C(C)C MCULE-5854390376 [0,1,0,0,0,0|3,0,0]=4 1015 B8R0.8 CCCOC(=O)C(C)O MCULE-8240669472 [0,1,0,0,0,0|1,0,2]=4 1016 B8R0.8 CCCOC(=O)[C@H](C)O MCULE-4150275631 [0,1,0,0,0,0|1,0,2]=4 1017 B8R0.8 CCCOC(C)C(=O)O MCULE-4477829415 [0,1,0,0,0,0|2,0,1]=4 1018 B8R0.8 CCNCC(C)C(=O)O MCULE-3863191122 [0,1,0,0,0,0|2,0,1]=4 1019 B8R0.8 CCNCC(C)C(=O)O MCULE-4164323563 [0,1,0,0,0,0|2,0,1]=4 1020 B8R0.8 CCOCC(C)C(=O)O MCULE-5346959026 [0,1,0,0,0,0|2,0,1]=4 1021 B8R0.8 CCOCC(N)C(C)C MCULE-6644223666 [0,1,0,0,0,0|3,0,0]=4 1022 B8R0.8 CCOCC(N)C(C)C MCULE-7204690887 [0,1,0,0,0,0|3,0,0]=4 1023 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9199053225 [0,1,0,0,0,0|2,0,1]=4 1024 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9684903914 [0,1,0,0,0,0|2,0,1]=4 1025 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-6351196285 [0,1,0,0,0,0|2,0,1]=4 1026 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-7653589662 [0,1,0,0,0,0|2,0,1]=4 1027 B8R0.8 CCSCC(N)C(=O)O MCULE-9449250733 [0,1,0,0,0,0|2,0,1]=4 1028 B8R0.8 COCCC(C)C(=O)O MCULE-5066180613 [0,1,0,0,0,0|2,0,1]=4 1029 B8R0.8 COCCC(N)C(=O)O MCULE-3018605108 [0,1,0,0,0,0|2,0,1]=4 1030 B8R0.8 COCCC(O)C(C)C MCULE-8987535377 [0,1,0,0,0,0|2,0,0]=3 1031 B8R0.8 COCC[C@H](N)C(=O)O MCULE-6748608543 [0,1,0,0,0,0|2,0,1]=4 1032 B8R0.8 COCC[C@H](N)C(=O)O MCULE-8586358852 [0,1,0,0,0,0|2,0,1]=4 1033 B8R0.8 CSCCC(N)C(=O)O MCULE-5626142345 [0,1,0,0,0,0|2,0,1]=4 1034 B8R0.8 CSCCC(O)C(=O)N MCULE-9019971815 [0,1,0,0,0,0|1,0,2]=4 1035 B8R0.8 CSCCC(O)C(=O)O MCULE-3684026487 [0,1,0,0,0,0|1,0,1]=3 1036 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-2209985195 [0,1,0,0,0,0|2,0,1]=4 1037 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-9944164883 [0,1,0,0,0,0|2,0,1]=4 1038 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-3383932641 [0,1,0,0,0,0|2,0,1]=4 1039 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-4603455639 [0,1,0,0,0,0|2,0,1]=4 1040 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-7228063662 [0,1,0,0,0,0|2,0,1]=4 1041 B8R0.8 C[Se]CCC(N)C(=O)O MCULE-9212969564 [0,1,0,0,0,0|2,0,1]=4 1042 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5333020269 [0,1,0,0,0,0|2,0,1]=4 1043 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5980340572 [0,1,0,0,0,0|2,0,1]=4 1044 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [0,1,0,0,0,0|2,0,1]=4 1045 B8R0.8 NCCCC(N)C(=O)O MCULE-1970642620 [0,1,0,0,0,0|2,0,1]=4 1046 B8R0.8 NCCCC(N)C(=O)O MCULE-4486209373 [0,1,0,0,0,0|2,0,1]=4 1047 B8R0.8 NCCCC(N)C(=O)O MCULE-8193724048 [0,1,0,0,0,0|2,0,1]=4 1048 B8R0.8 NCCCC(N)C(=O)O MCULE-9223414094 [0,1,0,0,0,0|2,0,1]=4 1049 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-1634156072 [0,1,0,0,0,0|2,0,1]=4 1050 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2602820298 [0,1,0,0,0,0|2,0,1]=4 1051 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2719848774 [0,1,0,0,0,0|2,0,1]=4 1052 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-8413545449 [0,1,0,0,0,0|2,0,1]=4 1053 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2588005079 [0,1,0,0,0,0|2,0,1]=4 1054 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2852667696 [0,1,0,0,0,0|2,0,1]=4 1055 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-3029872280 [0,1,0,0,0,0|2,0,1]=4 1056 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-4242810787 [0,1,0,0,0,0|2,0,1]=4 1057 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-6924538097 [0,1,0,0,0,0|2,0,1]=4 1058 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-8642266626 [0,1,0,0,0,0|2,0,1]=4 1059 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9352931710 [0,1,0,0,0,0|2,0,1]=4 1060 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9532999202 [0,1,0,0,0,0|2,0,1]=4 1061 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [0,1,0,0,0,0|2,0,1]=4 1062 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [0,1,0,0,0,0|2,0,1]=4 1063 B8R0.8 O=C(O)C(O)CCCO MCULE-9386031706 [0,1,0,0,0,0|1,0,1]=3 1064 B8R0.8 O=C([O-])C(O)CCCO MCULE-5137868319 [0,1,0,0,0,0|1,0,2]=4 1065 B8R0.9 C/C(=N\O)/CCC(C)C MCULE-6160318624 [0,1,0,0,0,0|2,0,1]=4 1066 B8R0.9 CC(=NO)CCC(C)C MCULE-1275882348 [0,1,0,0,0,0|2,0,1]=4 1067 B8R0.9 CC(=O)NCC(O)CCl MCULE-4912177314 [0,1,0,0,0,0|2,0,1]=4 1068 B8R0.9 CC(=O)NC[C@H](O)CCl MCULE-5027407972 [0,1,0,0,0,0|2,0,1]=4 1069 B8R0.9 CC(=O)OCC(N)CO MCULE-3133254167 [0,1,0,0,0,0|2,0,1]=4 1070 B8R0.9 CC(=O)OCC(N)CO MCULE-4867842020 [0,1,0,0,0,0|2,0,1]=4 1071 B8R0.9 CC(=O)OCC(O)CCl MCULE-3591995437 [0,1,0,0,0,0|2,0,1]=4 1072 B8R0.9 CC(=O)OCC(O)CO MCULE-7518673015 [0,1,0,0,0,0|1,0,1]=3 1073 B8R0.9 CC(=O)OC[C@H](C)CO MCULE-2650760220 [0,1,0,0,0,0|2,0,1]=4 1074 B8R0.9 CC(=O)OC[C@H](C)CO MCULE-7616916740 [0,1,0,0,0,0|2,0,1]=4 1075 B8R0.9 CC(C)CC/C(=N/O)/N MCULE-5971141379 [0,1,0,0,0,0|2,0,1]=4 1076 B8R0.9 CC(C)CCC(=O)CCl MCULE-7122163926 [0,1,0,0,0,0|1,0,2]=4 1077 B8R0.9 CC(C)CCC(=O)CN MCULE-2601333978 [0,1,0,0,0,0|1,0,2]=4 1078 B8R0.9 CC(C)CCC(=O)CN MCULE-9600279855 [0,1,0,0,0,0|1,0,2]=4 1079 B8R0.9 CC(C)CCC(C)CO MCULE-8698383870 [0,1,0,0,0,0|1,0,0]=2 1080 B8R0.9 CC(C)CCC(N)CO MCULE-1841093348 [0,1,0,0,0,0|1,0,0]=2 1081 B8R0.9 CC(C)CCC(N)CO MCULE-6322500554 [0,1,0,0,0,0|1,0,0]=2 1082 B8R0.9 CC(C)COC(C)CO MCULE-5746553586 [0,1,0,0,0,0|2,0,0]=3 1083 B8R0.9 CC(C)NCC(O)CO MCULE-6111772035 [0,1,0,0,0,0|1,0,0]=2 1084 B8R0.9 CC(C)NC[C@@H](O)CO MCULE-2239468159 [0,1,0,0,0,0|1,0,0]=2 1085 B8R0.9 CC(C)NC[C@@H](O)CO MCULE-7993975282 [0,1,0,0,0,0|1,0,0]=2 1086 B8R0.9 CC(C)NC[C@H](O)CO MCULE-3918662429 [0,1,0,0,0,0|1,0,0]=2 1087 B8R0.9 CC(C)NC[C@H](O)CO MCULE-5916462695 [0,1,0,0,0,0|1,0,0]=2 1088 B8R0.9 CC(C)OCC(O)CCl MCULE-4441637540 [0,1,0,0,0,0|2,0,0]=3 1089 B8R0.9 CC(C)OCC(O)CI MCULE-7852993488 [0,1,0,0,0,0|2,0,0]=3 1090 B8R0.9 CC(C)OCC(O)CN MCULE-4268894257 [0,1,0,0,0,0|2,0,0]=3 1091 B8R0.9 CC(O)CNC(C)CO MCULE-6157391749 [0,1,0,0,0,0|2,0,0]=3 1092 B8R0.9 CC(O)COC(C)CO MCULE-7544702364 [0,1,0,0,0,0|2,0,0]=3 1093 B8R0.9 CCC(=O)CCC(C)C MCULE-3065298823 [0,1,0,0,0,0|1,0,2]=4 1094 B8R0.9 CCC(C)CCC(=O)C MCULE-6498666006 [0,1,0,0,0,0|2,0,1]=4 1095 B8R0.9 CCC(C)CCC(C)O MCULE-4781356880 [0,1,0,0,0,0|2,0,0]=3 1096 B8R0.9 CCC(O)CCC(=O)O MCULE-1512608136 [0,1,0,0,0,0|2,0,1]=4 1097 B8R0.9 CCC(O)CCC(=O)[O-] MCULE-6831827135 [0,1,0,0,0,0|2,0,1]=4 1098 B8R0.9 CCC(O)CCC(C)C MCULE-6499043854 [0,1,0,0,0,0|1,0,0]=2 1099 B8R0.9 C[C@@H](CO)CC[N+](=O)[O-] MCULE-1706050650 [0,1,0,0,0,0|3,0,0]=4 1100 B8R0.9 C[C@@H](CO)CC[N+](=O)[O-] MCULE-8419848254 [0,1,0,0,0,0|3,0,0]=4 1101 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-1233079264 [0,1,0,0,0,0|2,0,1]=4 1102 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-8091475267 [0,1,0,0,0,0|2,0,1]=4 1103 B8R0.11 CCCC=C(CC)CO MCULE-5047095723 [0,1,0,0,0,0|1,0,2]=4 1104 B8R0.11 CCCCC(C#N)CC MCULE-2736907421 [0,1,0,0,0,0|2,0,0]=3 1105 B8R0.11 CCCCC(C=O)CC MCULE-1141216024 [0,1,0,0,0,0|1,0,1]=3 1106 B8R0.11 CCCCC(CC)CBr MCULE-5038833858 [0,1,0,0,0,0|2,0,0]=3 1107 B8R0.11 CCCCC(CC)CCl MCULE-1634307816 [0,1,0,0,0,0|2,0,0]=3 1108 B8R0.11 CCCCC(CC)CI MCULE-8161503442 [0,1,0,0,0,0|2,0,0]=3 1109 B8R0.11 CCCCC(CC)CN MCULE-1662642024 [0,1,0,0,0,0|2,0,0]=3 1110 B8R0.11 CCCCC(CC)CN MCULE-4352983814 [0,1,0,0,0,0|2,0,0]=3 1111 B8R0.11 CCCCC(CC)CN MCULE-8640566132 [0,1,0,0,0,0|2,0,0]=3 1112 B8R0.11 CCCCC(CC)CO MCULE-1768780358 [0,1,0,0,0,0|1,0,0]=2 1113 B8R0.11 CCCCC(CC)CS MCULE-6473515213 [0,1,0,0,0,0|1,1,0]=3 1114 B8R0.11 CCCCC(CN)NC MCULE-7555946294 [0,1,0,0,0,0|2,0,0]=3 1115 B8R0.11 CCCCC(CO)CO MCULE-4148067977 [0,1,0,0,0,0|0,0,0]=1 1116 B8R0.11 CCCCC(CO)NC MCULE-5217517371 [0,1,0,0,0,0|1,0,0]=2 1117 B8R0.11 CCCCN(CC)CC MCULE-6838692277 [0,1,0,0,0,0|3,0,0]=4 1118 B8R0.11 CCCC[C@@H](CC)CBr MCULE-7851829874 [0,1,0,0,0,0|2,0,0]=3 1119 B8R0.11 CCCNC(CC)CC MCULE-3635515629 [0,1,0,0,0,0|3,0,0]=4 1120 B8R0.11 CCCNC(CC)CC MCULE-6579619354 [0,1,0,0,0,0|3,0,0]=4 1121 B8R0.11 CCCOC(CC)CN MCULE-9936594334 [0,1,0,0,0,0|3,0,0]=4 1122 B8R0.11 CCNCC(CC)CC MCULE-6491999096 [0,1,0,0,0,0|3,0,0]=4 1123 B8R0.11 CCNCC(OC)OC MCULE-2121819997 [0,1,0,0,0,0|3,0,0]=4 1124 B8R0.11 COC(C#N)CCSC MCULE-9976329021 [0,1,0,0,0,0|2,0,1]=4 1125 B8R0.11 COC(CCCBr)OC MCULE-3693606561 [0,1,0,0,0,0|3,0,0]=4 1126 B8R0.11 COC(CCCCl)OC MCULE-4360901428 [0,1,0,0,0,0|3,0,0]=4 1127 B8R0.11 COC(CCCN)OC MCULE-5648092637 [0,1,0,0,0,0|3,0,0]=4 1128 B8R0.11 COC(CCSC)OC MCULE-3069805433 [0,1,0,0,0,0|3,0,0]=4 1129 B8R0.11 COC(CN)CCSC MCULE-1834354805 [0,1,0,0,0,0|2,0,0]=3 1130 B8R0.11 COC(CO)CN=N#N MCULE-7317118821 [0,1,0,0,0,0|3,0,0]=4 1131 B8R0.11 COCCC(OC)OC MCULE-2411343546 [0,1,0,0,0,0|3,0,0]=4 1132 B8R0.19 C(O)(CC)CC(=O)OC MCULE-6615199457 [0,1,0,0,0,0|2,0,1]=4 1133 B8R0.19 CC(CO)CC(C)CO MCULE-5101558507 [0,1,0,0,0,0|2,0,0]=3 1134 B8R0.19 CC(CO)NC(C)CO MCULE-9592229965 [0,1,0,0,0,0|3,0,0]=4 1135 B8R0.19 CC(CO)N[C@H](C)CO MCULE-4785692482 [0,1,0,0,0,0|3,0,0]=4 1136 B8R0.19 CC(CO)OC(C)CO MCULE-3894293331 [0,1,0,0,0,0|3,0,0]=4 1137 B8R0.19 CC(CO)OC(C)CO MCULE-7387498325 [0,1,0,0,0,0|3,0,0]=4 1138 B8R0.19 CCC(=O)CC(C)CC MCULE-8568086135 [0,1,0,0,0,0|1,0,2]=4 1139 B8R0.19 CCC(C)CC(C)CBr MCULE-5879530879 [0,1,0,0,0,0|2,0,0]=3 1140 B8R0.19 CCC(C)CC(C)CC MCULE-3505575425 [0,1,0,0,0,0|2,0,0]=3 1141 B8R0.19 CCC(C)CC(C)CO MCULE-5737704972 [0,1,0,0,0,0|1,0,0]=2 1142 B8R0.19 CCC(C)CC(N)CO MCULE-5344165944 [0,1,0,0,0,0|1,0,0]=2 1143 B8R0.19 CCC(C)CC(N)CO MCULE-6408946943 [0,1,0,0,0,0|1,0,0]=2 1144 B8R0.19 CCC(C)CC(O)CC MCULE-9706306627 [0,1,0,0,0,0|1,0,0]=2 1145 B8R0.19 CCC(C)NC(C)CC MCULE-8710688298 [0,1,0,0,0,0|3,0,0]=4 1146 B8R0.19 CCC(C)OC(C)CC MCULE-7742835008 [0,1,0,0,0,0|3,0,0]=4 1147 B8R0.19 CCC(C)SC(C)CC MCULE-4171706949 [0,1,0,0,0,0|3,0,0]=4 1148 B8R0.19 CCC(N)CC(C)CO MCULE-9757770228 [0,1,0,0,0,0|1,0,0]=2 1149 B8R0.19 CCC(O)OC(O)CC MCULE-9298226682 [0,1,0,0,0,0|2,0,0]=3 1150 B8R0.19 CCN(C)CC(C)CN MCULE-9502113012 [0,1,0,0,0,0|3,0,0]=4 1151 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-7264527834 [0,1,0,0,0,0|2,0,1]=4 1152 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-8077794874 [0,1,0,0,0,0|2,0,1]=4 1153 B8R0.19 CC[C@@H](O)C[C@H](O)CC MCULE-8992338479 [0,1,0,0,0,0|1,0,0]=2 1154 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-3861554927 [0,1,0,0,0,0|2,0,1]=4 1155 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-6307000918 [0,1,0,0,0,0|2,0,1]=4 1156 B8R0.19 CC[C@H](O)C[C@@H](O)CC MCULE-4286526192 [0,1,0,0,0,0|1,0,0]=2 1157 B8R0.19 COC(=O)CC(N)CO MCULE-4803123890 [0,1,0,0,0,0|2,0,1]=4 1158 B8R0.19 COC(=O)CC(N)CO MCULE-5372024399 [0,1,0,0,0,0|2,0,1]=4 1159 B8R0.19 COC(=O)CC(O)CCl MCULE-3924993874 [0,1,0,0,0,0|2,0,1]=4 1160 B8R0.19 COC(=O)CC(O)CN MCULE-6633164904 [0,1,0,0,0,0|2,0,1]=4 1161 B8R0.19 COC(=O)CC(O)CN MCULE-6973205945 [0,1,0,0,0,0|2,0,1]=4 1162 B8R0.19 COC(=O)CC(O)CO MCULE-1721395490 [0,1,0,0,0,0|1,0,1]=3 1163 B8R0.19 COC(=O)CC(O)CO MCULE-7578547932 [0,1,0,0,0,0|1,0,1]=3 1164 B8R0.19 COC(=O)C[C@@H](O)CCl MCULE-2437500598 [0,1,0,0,0,0|2,0,1]=4 1165 B8R0.19 COC(=O)C[C@@H](O)CCl MCULE-2535323310 [0,1,0,0,0,0|2,0,1]=4 1166 B8R0.19 COC(=O)C[C@H](O)CCl MCULE-2232290900 [0,1,0,0,0,0|2,0,1]=4 1167 B8R0.19 COC(=O)C[C@H](O)CCl MCULE-2298624118 [0,1,0,0,0,0|2,0,1]=4 1168 B8R0.19 COC(=O)C[C@H](O)CO MCULE-3243102477 [0,1,0,0,0,0|1,0,1]=3 1169 B8R0.19 COC(=O)C[C@H](O)CO MCULE-7538479392 [0,1,0,0,0,0|1,0,1]=3 1170 B8R0.19 O=C(CO)CC(O)CO MCULE-2853556664 [0,1,0,0,0,0|1,0,1]=3 1171 B8R0.25 C#CC(C)(O)CCCC MCULE-9896867315 [0,1,0,0,0,0|1,0,1]=3 1172 B8R0.25 C#CCCC(C)(C)CO MCULE-5747063211 [0,1,0,0,0,0|1,0,2]=4 1173 B8R0.25 C=CCCC(C)(C)CO MCULE-6808455232 [0,1,0,0,0,0|1,0,2]=4 1174 B8R0.25 CC(C)(CN)CCCO MCULE-4095443287 [0,1,0,0,0,0|3,0,0]=4 1175 B8R0.25 CC(C)(CO)CCC#N MCULE-7382521539 [0,1,0,0,0,0|2,0,1]=4 1176 B8R0.25 CC(C)(CO)CCCN MCULE-9175774804 [0,1,0,0,0,0|2,0,0]=3 1177 B8R0.25 CC(C)(CO)NCCO MCULE-7371042252 [0,1,0,0,0,0|3,0,0]=4 1178 B8R0.25 CC(O)(CN)CCCO MCULE-1441500967 [0,1,0,0,0,0|2,0,0]=3 1179 B8R0.25 CCC#CC(C)(O)CC MCULE-7494593445 [0,1,0,0,0,0|1,0,2]=4 1180 B8R0.25 CCCCC(C)(C)C#N MCULE-5229781865 [0,1,0,0,0,0|2,0,1]=4 1181 B8R0.25 CCCCC(C)(C)C=O MCULE-2890084431 [0,1,0,0,0,0|1,0,2]=4 1182 B8R0.25 CCCCC(C)(C)CC MCULE-3565047013 [0,1,0,0,0,0|2,0,0]=3 1183 B8R0.25 CCCCC(C)(C)CO MCULE-4899561324 [0,1,0,0,0,0|1,0,0]=2 1184 B8R0.25 CCCCC(C)(N)CO MCULE-2447993651 [0,1,0,0,0,0|1,0,0]=2 1185 B8R0.25 CCCCC(C)(N)CO MCULE-2703890876 [0,1,0,0,0,0|1,0,0]=2 1186 B8R0.25 CCCCC(C)(O)CC MCULE-4324011914 [0,1,0,0,0,0|1,0,0]=2 1187 B8R0.25 CCCCS(=O)(=O)CCl MCULE-8736210504 [0,1,0,0,0,0|2,0,1]=4 1188 B8R0.25 CCCC[Si](C)(C)CCl MCULE-5885306378 [0,1,0,0,0,0|2,1,0]=4 1189 B8R0.25 CCOCC(C)(C)CN MCULE-2617485733 [0,1,0,0,0,0|3,0,0]=4 1190 B8R0.25 CCP(=O)(O)CCCN MCULE-1115053809 [0,1,0,0,0,0|3,0,0]=4 1191 B8R0.25 CCP(=O)(O)CCCN MCULE-4786639632 [0,1,0,0,0,0|3,0,0]=4 1192 B8R0.25 COCCC(C)(C)CBr MCULE-9289158517 [0,1,0,0,0,0|3,0,0]=4 1193 B8R0.25 COCCC(C)(C)CN MCULE-9030041454 [0,1,0,0,0,0|3,0,0]=4 1194 B8R0.25 COCCC(C)(C)CO MCULE-9804375786 [0,1,0,0,0,0|2,0,0]=3 1195 B8R0.25 COCCC(C)(N)CO MCULE-9079600767 [0,1,0,0,0,0|2,0,0]=3 1196 B8R0.25 COCCC(C)(O)CN MCULE-9408020201 [0,1,0,0,0,0|2,0,0]=3 1197 B8R0.25 CSCCC(C)(O)CN MCULE-4478297926 [0,1,0,0,0,0|2,0,0]=3 1198 B8R0.25 NCCCP(=O)(O)CO MCULE-2944312169 [0,1,0,0,0,0|2,0,0]=3 1199 B8R1.1 C1(CCC(=O)N1)CO MCULE-8513534447 [0,0,0,1,0,0|2,0,1]=4 1200 B8R1.1 C1(CCN(C1)C)CN MCULE-1228423029 [0,0,0,1,0,0|3,0,0]=4 1201 B8R1.1 C1(CCN(C1)C)CO MCULE-8028593286 [0,0,0,1,0,0|2,0,0]=3 1202 B8R1.1 C1(CCN(C1)CC)N MCULE-1660628363 [0,0,0,1,0,0|3,0,0]=4 1203 B8R1.1 C1(CCN(C1)CC)N MCULE-4362704213 [0,0,0,1,0,0|3,0,0]=4 1204 B8R1.1 C1(CNC(=O)O1)CO MCULE-2451079587 [0,0,0,1,0,0|2,0,1]=4 1205 B8R1.1 CC1CC(CN1)CO MCULE-3385267892 [0,0,0,1,0,0|2,0,0]=3 1206 B8R1.1 CC1CC(CN1)CO MCULE-5508438719 [0,0,0,1,0,0|2,0,0]=3 1207 B8R1.1 CC1CCC(C1)C#N MCULE-2178859708 [0,0,0,1,0,0|2,0,1]=4 1208 B8R1.1 CC1CCC(C1)C=O MCULE-9381232427 [0,0,0,1,0,0|1,0,2]=4 1209 B8R1.1 CC1CCC(C1)CN MCULE-9731521461 [0,0,0,1,0,0|2,0,0]=3 1210 B8R1.1 CC1CCC(C1)CO MCULE-3130047677 [0,0,0,1,0,0|1,0,0]=2 1211 B8R1.1 CC1CCC(N1)CO MCULE-7935473441 [0,0,0,1,0,0|1,0,0]=2 1212 B8R1.1 CC1CCC(N1)CO MCULE-8743496847 [0,0,0,1,0,0|1,0,0]=2 1213 B8R1.1 CC1CCC(O1)CI MCULE-2805289539 [0,0,0,1,0,0|1,0,0]=2 1214 B8R1.1 CC1CCC(O1)CN MCULE-4161233821 [0,0,0,1,0,0|1,0,0]=2 1215 B8R1.1 CC1CCC(O1)CO MCULE-1587985152 [0,0,0,1,0,0|0,0,0]=1 1216 B8R1.1 CC1CNC(C1)CF MCULE-6699916370 [0,0,0,1,0,0|3,0,0]=4 1217 B8R1.1 CC1CNC(C1)CF MCULE-9019063440 [0,0,0,1,0,0|3,0,0]=4 1218 B8R1.1 CC1CNC(C1)CO MCULE-2461186712 [0,0,0,1,0,0|2,0,0]=3 1219 B8R1.1 CC1CNC(C1)CO MCULE-5209280647 [0,0,0,1,0,0|2,0,0]=3 1220 B8R1.1 CC1COC(C1)CO MCULE-4511313299 [0,0,0,1,0,0|2,0,0]=3 1221 B8R1.1 CC1OCC(O1)CO MCULE-1328866429 [0,0,0,1,0,0|1,0,0]=2 1222 B8R1.1 CCC1CC(=O)CO1 MCULE-7105024194 [0,0,0,1,0,0|0,0,2]=3 1223 B8R1.1 CCC1CC(CN1)C MCULE-1050977557 [0,0,0,1,0,0|2,0,0]=3 1224 B8R1.1 CCC1CCC(=O)C1 MCULE-8455504217 [0,0,0,1,0,0|1,0,2]=4 1225 B8R1.1 CCC1CCC(=O)O1 MCULE-5161861312 [0,0,0,1,0,0|2,0,1]=4 1226 B8R1.1 CCC1OCC(O1)C MCULE-6723875164 [0,0,0,1,0,0|2,0,0]=3 1227 B8R1.1 CCN1CCC(C1)Cl MCULE-3754861466 [0,0,0,1,0,0|3,0,0]=4 1228 B8R1.1 CCN1CCC(C1)N MCULE-4061638126 [0,0,0,1,0,0|3,0,0]=4 1229 B8R1.1 CCN1CCC(C1)N MCULE-6209041020 [0,0,0,1,0,0|3,0,0]=4 1230 B8R1.1 CCN1CCC(C1)O MCULE-5692205926 [0,0,0,1,0,0|2,0,0]=3 1231 B8R1.1 CCN1CC[C@@H](C1)N MCULE-1272657040 [0,0,0,1,0,0|3,0,0]=4 1232 B8R1.1 CCN1CC[C@@H](C1)N MCULE-2076213751 [0,0,0,1,0,0|3,0,0]=4 1233 B8R1.1 CCN1CC[C@@H](C1)N MCULE-3909985708 [0,0,0,1,0,0|3,0,0]=4 1234 B8R1.1 CCN1CC[C@@H](C1)N MCULE-3962927462 [0,0,0,1,0,0|3,0,0]=4 1235 B8R1.1 CCN1CC[C@H](C1)N MCULE-2016194886 [0,0,0,1,0,0|3,0,0]=4 1236 B8R1.1 CCN1CC[C@H](C1)N MCULE-2026494181 [0,0,0,1,0,0|3,0,0]=4 1237 B8R1.1 CCN1CC[C@H](C1)N MCULE-7234991861 [0,0,0,1,0,0|3,0,0]=4 1238 B8R1.1 CCN1CC[C@H](C1)N MCULE-7446688547 [0,0,0,1,0,0|3,0,0]=4 1239 B8R1.1 CC[C@@H]1CCC(=O)C1 MCULE-7687801028 [0,0,0,1,0,0|1,0,2]=4 1240 B8R1.1 CC[C@@H]1CCC(=O)O1 MCULE-9831904901 [0,0,0,1,0,0|2,0,1]=4 1241 B8R1.1 CC[C@H]1CCC(=O)C1 MCULE-6479003670 [0,0,0,1,0,0|1,0,2]=4 1242 B8R1.1 CN1CCC(C1)CBr MCULE-3254744278 [0,0,0,1,0,0|3,0,0]=4 1243 B8R1.1 CN1CCC(C1)CBr MCULE-7875661007 [0,0,0,1,0,0|3,0,0]=4 1244 B8R1.1 CN1CCC(C1)CCl MCULE-1838271760 [0,0,0,1,0,0|3,0,0]=4 1245 B8R1.1 CN1CCC(C1)CCl MCULE-7017741490 [0,0,0,1,0,0|3,0,0]=4 1246 B8R1.1 CN1CCC(C1)CI MCULE-5901809049 [0,0,0,1,0,0|3,0,0]=4 1247 B8R1.1 CN1CCC(C1)CN MCULE-1055157717 [0,0,0,1,0,0|3,0,0]=4 1248 B8R1.1 CN1CCC(C1)CN MCULE-4961802986 [0,0,0,1,0,0|3,0,0]=4 1249 B8R1.1 CN1CCC(C1)CN MCULE-7134331201 [0,0,0,1,0,0|3,0,0]=4 1250 B8R1.1 CN1CCC(C1)CO MCULE-8101582241 [0,0,0,1,0,0|2,0,0]=3 1251 B8R1.1 CN1CC[C@@H](C1)CN MCULE-4682250431 [0,0,0,1,0,0|3,0,0]=4 1252 B8R1.1 CN1CC[C@@H](C1)CN MCULE-7978590046 [0,0,0,1,0,0|3,0,0]=4 1253 B8R1.1 CN1CC[C@@H](C1)CN MCULE-9059685471 [0,0,0,1,0,0|3,0,0]=4 1254 B8R1.1 CN1CC[C@@H](C1)CO MCULE-3904654758 [0,0,0,1,0,0|2,0,0]=3 1255 B8R1.1 CN1CC[C@@H](C1)CO MCULE-5091184467 [0,0,0,1,0,0|2,0,0]=3 1256 B8R1.1 CN1CC[C@H](C1)CN MCULE-1864968995 [0,0,0,1,0,0|3,0,0]=4 1257 B8R1.1 CN1CC[C@H](C1)CN MCULE-3495270300 [0,0,0,1,0,0|3,0,0]=4 1258 B8R1.1 CN1CC[C@H](C1)CN MCULE-6029010150 [0,0,0,1,0,0|3,0,0]=4 1259 B8R1.1 CN1CC[C@H](C1)CN MCULE-7061479346 [0,0,0,1,0,0|3,0,0]=4 1260 B8R1.1 CN1CC[C@H](C1)CO MCULE-7548866217 [0,0,0,1,0,0|2,0,0]=3 1261 B8R1.1 CN1CC[C@H](C1)CO MCULE-9206143876 [0,0,0,1,0,0|2,0,0]=3 1262 B8R1.1 CNC1CCC(C1)C MCULE-2606421374 [0,0,0,1,0,0|3,0,0]=4 1263 B8R1.1 CNC1CCC(C1)O MCULE-1177292585 [0,0,0,1,0,0|2,0,0]=3 1264 B8R1.1 CNC1CCC(C1)O MCULE-5259471149 [0,0,0,1,0,0|2,0,0]=3 1265 B8R1.1 CN[C@@H]1CC[C@@H](C1)O MCULE-3921744037 [0,0,0,1,0,0|2,0,0]=3 1266 B8R1.1 COC1CCC(C1)Br MCULE-2042021360 [0,0,0,1,0,0|3,0,0]=4 1267 B8R1.1 COC1CCC(C1)N MCULE-4717179971 [0,0,0,1,0,0|3,0,0]=4 1268 B8R1.1 COC1CCC(C1)N MCULE-6288105544 [0,0,0,1,0,0|3,0,0]=4 1269 B8R1.1 COC1CCC(C1)O MCULE-3531007988 [0,0,0,1,0,0|2,0,0]=3 1270 B8R1.1 CO[C@@H]1CC[C@@H](C1)N MCULE-2875608408 [0,0,0,1,0,0|3,0,0]=4 1271 B8R1.1 CO[C@@H]1CC[C@@H](C1)N MCULE-8416754512 [0,0,0,1,0,0|3,0,0]=4 1272 B8R1.1 CO[C@@H]1CC[C@@H](C1)O MCULE-5232016028 [0,0,0,1,0,0|2,0,0]=3 1273 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-1888407079 [0,0,0,1,0,0|3,0,0]=4 1274 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-2445501949 [0,0,0,1,0,0|3,0,0]=4 1275 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-6019984409 [0,0,0,1,0,0|3,0,0]=4 1276 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-6778321044 [0,0,0,1,0,0|3,0,0]=4 1277 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-1126971030 [0,0,0,1,0,0|3,0,0]=4 1278 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-2897044722 [0,0,0,1,0,0|3,0,0]=4 1279 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-5627949204 [0,0,0,1,0,0|3,0,0]=4 1280 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-8060845967 [0,0,0,1,0,0|3,0,0]=4 1281 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-1601734575 [0,0,0,1,0,0|3,0,0]=4 1282 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-1920912186 [0,0,0,1,0,0|3,0,0]=4 1283 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-3006479304 [0,0,0,1,0,0|3,0,0]=4 1284 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-4560375617 [0,0,0,1,0,0|3,0,0]=4 1285 B8R1.1 CSC1CCC(C1)N MCULE-5954197639 [0,0,0,1,0,0|3,0,0]=4 1286 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-5635555767 [0,0,0,1,0,0|1,0,0]=2 1287 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-7103292821 [0,0,0,1,0,0|1,0,0]=2 1288 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-8577607094 [0,0,0,1,0,0|1,0,0]=2 1289 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-8853557592 [0,0,0,1,0,0|1,0,0]=2 1290 B8R1.1 C[C@@H]1CC[C@@H](O1)CO MCULE-1981408927 [0,0,0,1,0,0|0,0,0]=1 1291 B8R1.1 C[C@@H]1CC[C@@H](O1)CO MCULE-2750103072 [0,0,0,1,0,0|0,0,0]=1 1292 B8R1.1 C[C@@H]1CN[C@@H](C1)CF MCULE-2959715955 [0,0,0,1,0,0|3,0,0]=4 1293 B8R1.1 C[C@@H]1CN[C@@H](C1)CF MCULE-8576921377 [0,0,0,1,0,0|3,0,0]=4 1294 B8R1.1 C[C@@H]1CN[C@@H](C1)CO MCULE-1057201942 [0,0,0,1,0,0|2,0,0]=3 1295 B8R1.1 C[C@@H]1CN[C@@H](C1)CO MCULE-5251520971 [0,0,0,1,0,0|2,0,0]=3 1296 B8R1.1 C[C@H]1CC[C@H](N1)CO MCULE-5943356667 [0,0,0,1,0,0|1,0,0]=2 1297 B8R1.1 C[C@H]1CC[C@H](N1)CO MCULE-6303404144 [0,0,0,1,0,0|1,0,0]=2 1298 B8R1.1 C[C@H]1CC[C@H](O1)CO MCULE-2585928492 [0,0,0,1,0,0|0,0,0]=1 1299 B8R1.1 C[C@H]1CC[C@H](O1)CO MCULE-3715649264 [0,0,0,1,0,0|0,0,0]=1 1300 B8R1.1 C[C@H]1CN[C@@H](C1)CO MCULE-3784655204 [0,0,0,1,0,0|2,0,0]=3 1301 B8R1.1 C[C@H]1CN[C@@H](C1)CO MCULE-3927798393 [0,0,0,1,0,0|2,0,0]=3 1302 B8R1.1 C[C@H]1C[C@@H](CN1)CO MCULE-4062182666 [0,0,0,1,0,0|2,0,0]=3 1303 B8R1.1 C[C@H]1C[C@@H](CN1)CO MCULE-6218632921 [0,0,0,1,0,0|2,0,0]=3 1304 B8R1.1 FCC1CC(CN1)F MCULE-2675667218 [0,0,0,1,0,0|3,0,0]=4 1305 B8R1.1 FCC1CC(CN1)F MCULE-9263946341 [0,0,0,1,0,0|3,0,0]=4 1306 B8R1.1 FC[C@@H]1C[C@@H](CN1)F MCULE-6952912871 [0,0,0,1,0,0|3,0,0]=4 1307 B8R1.1 FC[C@@H]1C[C@@H](CN1)F MCULE-9220587585 [0,0,0,1,0,0|3,0,0]=4 1308 B8R1.1 FC[C@H]1C[C@H](CN1)F MCULE-1208494188 [0,0,0,1,0,0|3,0,0]=4 1309 B8R1.1 FC[C@H]1C[C@H](CN1)F MCULE-2034962585 [0,0,0,1,0,0|3,0,0]=4 1310 B8R1.1 N#CC1CCC(C1)O MCULE-5905406850 [0,0,0,1,0,0|2,0,1]=4 1311 B8R1.1 N#C[C@@H]1CC[C@@H](C1)O MCULE-8121411873 [0,0,0,1,0,0|2,0,1]=4 1312 B8R1.1 N#C[C@@H]1CC[C@H](C1)O MCULE-3581437653 [0,0,0,1,0,0|2,0,1]=4 1313 B8R1.1 N#C[C@@H]1CC[C@H](C1)O MCULE-5514135227 [0,0,0,1,0,0|2,0,1]=4 1314 B8R1.1 N#C[C@H]1CC[C@H](C1)O MCULE-5018154932 [0,0,0,1,0,0|2,0,1]=4 1315 B8R1.1 N#C[C@H]1CC[C@H](C1)O MCULE-9804475995 [0,0,0,1,0,0|2,0,1]=4 1316 B8R1.1 NCC1CCC(=O)O1 MCULE-5413792723 [0,0,0,1,0,0|2,0,1]=4 1317 B8R1.1 NCC1CCC(=O)O1 MCULE-8312895206 [0,0,0,1,0,0|2,0,1]=4 1318 B8R1.1 NCC1CCC(C1)F MCULE-2506364284 [0,0,0,1,0,0|3,0,0]=4 1319 B8R1.1 NCC1CCC(C1)F MCULE-9762668275 [0,0,0,1,0,0|3,0,0]=4 1320 B8R1.1 NCC1CCC(C1)O MCULE-1780130995 [0,0,0,1,0,0|2,0,0]=3 1321 B8R1.1 NCC1CCC(C1)O MCULE-5002398342 [0,0,0,1,0,0|2,0,0]=3 1322 B8R1.1 NCC1C[C@H](CN1)O MCULE-1428185082 [0,0,0,1,0,0|2,0,0]=3 1323 B8R1.1 NC[C@@H]1CC[C@@H](C1)O MCULE-2662561877 [0,0,0,1,0,0|2,0,0]=3 1324 B8R1.1 NC[C@@H]1CC[C@H](C1)F MCULE-1669600965 [0,0,0,1,0,0|3,0,0]=4 1325 B8R1.1 NC[C@@H]1CC[C@H](C1)F MCULE-5430633197 [0,0,0,1,0,0|3,0,0]=4 1326 B8R1.1 NC[C@@H]1CC[C@H](C1)O MCULE-9258933196 [0,0,0,1,0,0|2,0,0]=3 1327 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-1995293557 [0,0,0,1,0,0|2,0,0]=3 1328 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-9517253792 [0,0,0,1,0,0|2,0,0]=3 1329 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-5659749587 [0,0,0,1,0,0|2,0,0]=3 1330 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-9056303043 [0,0,0,1,0,0|2,0,0]=3 1331 B8R1.1 N[C@@H]1CN[C@H](C1)CO MCULE-7916347231 [0,0,0,1,0,0|3,0,0]=4 1332 B8R1.1 N[C@@H]1CN[C@H](C1)CO MCULE-8825406157 [0,0,0,1,0,0|3,0,0]=4 1333 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-3649010281 [0,0,0,1,0,0|3,0,0]=4 1334 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-5102365319 [0,0,0,1,0,0|3,0,0]=4 1335 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-8268517033 [0,0,0,1,0,0|3,0,0]=4 1336 B8R1.1 O=C1CCC(C1)CO MCULE-7524267942 [0,0,0,1,0,0|2,0,1]=4 1337 B8R1.1 O=C1CCC(N1)CO MCULE-1498000761 [0,0,0,1,0,0|2,0,1]=4 1338 B8R1.1 O=C1CCC(O1)CBr MCULE-9370722806 [0,0,0,1,0,0|2,0,1]=4 1339 B8R1.1 O=C1CCC(O1)CCl MCULE-3199749385 [0,0,0,1,0,0|2,0,1]=4 1340 B8R1.1 O=C1CCC(O1)CI MCULE-4432096360 [0,0,0,1,0,0|2,0,1]=4 1341 B8R1.1 O=C1CCC(O1)CO MCULE-3178999726 [0,0,0,1,0,0|1,0,1]=3 1342 B8R1.1 O=C1CCC(O1)CO MCULE-4390773734 [0,0,0,1,0,0|1,0,1]=3 1343 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-2590805877 [0,0,0,1,0,0|2,0,1]=4 1344 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-7134607780 [0,0,0,1,0,0|2,0,1]=4 1345 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3021506643 [0,0,0,1,0,0|2,0,1]=4 1346 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3659077476 [0,0,0,1,0,0|2,0,1]=4 1347 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-1532290348 [0,0,0,1,0,0|1,0,1]=3 1348 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-3600746831 [0,0,0,1,0,0|1,0,1]=3 1349 B8R1.1 O=C1CC[C@H](N1)CO MCULE-4532009930 [0,0,0,1,0,0|2,0,1]=4 1350 B8R1.1 O=C1CC[C@H](N1)CO MCULE-6466848372 [0,0,0,1,0,0|2,0,1]=4 1351 B8R1.1 O=C1CC[C@H](O1)CO MCULE-1675076625 [0,0,0,1,0,0|1,0,1]=3 1352 B8R1.1 O=C1CC[C@H](O1)CO MCULE-6265569115 [0,0,0,1,0,0|1,0,1]=3 1353 B8R1.1 O=C1NCC(O1)CO MCULE-8225938772 [0,0,0,1,0,0|2,0,1]=4 1354 B8R1.1 O=C1NC[C@@H](O1)CO MCULE-4749906822 [0,0,0,1,0,0|2,0,1]=4 1355 B8R1.1 O=C1NC[C@@H](O1)CO MCULE-7879354917 [0,0,0,1,0,0|2,0,1]=4 1356 B8R1.1 O=C1NC[C@H](O1)CO MCULE-2698871687 [0,0,0,1,0,0|2,0,1]=4 1357 B8R1.1 O=C1NC[C@H](O1)CO MCULE-5771560221 [0,0,0,1,0,0|2,0,1]=4 1358 B8R1.1 O=C1OCC(O1)CO MCULE-1831262013 [0,0,0,1,0,0|2,0,1]=4 1359 B8R1.1 OC1COC(C1)CI MCULE-9241971646 [0,0,0,1,0,0|1,0,0]=2 1360 B8R1.1 OCC1CC(CN1)F MCULE-6111724005 [0,0,0,1,0,0|3,0,0]=4 1361 B8R1.1 OCC1CC(CN1)F MCULE-9466287708 [0,0,0,1,0,0|3,0,0]=4 1362 B8R1.1 OCC1CC(CN1)O MCULE-1017614151 [0,0,0,1,0,0|2,0,0]=3 1363 B8R1.1 OCC1CC(CN1)O MCULE-5049675085 [0,0,0,1,0,0|2,0,0]=3 1364 B8R1.1 OCC1CC(CO1)O MCULE-4648895678 [0,0,0,1,0,0|1,0,0]=2 1365 B8R1.1 OCC1CCC(C1)F MCULE-4786923020 [0,0,0,1,0,0|2,0,0]=3 1366 B8R1.1 OCC1CCC(C1)O MCULE-5225292788 [0,0,0,1,0,0|2,0,0]=3 1367 B8R1.1 OC[C@@H]1CC[C@@H](C1)O MCULE-7117159358 [0,0,0,1,0,0|2,0,0]=3 1368 B8R1.1 OC[C@@H]1CC[C@H](C1)F MCULE-4252726732 [0,0,0,1,0,0|2,0,0]=3 1369 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-2619594606 [0,0,0,1,0,0|3,0,0]=4 1370 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-3940168858 [0,0,0,1,0,0|3,0,0]=4 1371 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-6567372757 [0,0,0,1,0,0|3,0,0]=4 1372 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-2521610955 [0,0,0,1,0,0|2,0,0]=3 1373 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-3659134136 [0,0,0,1,0,0|2,0,0]=3 1374 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-8149895498 [0,0,0,1,0,0|2,0,0]=3 1375 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-9582350102 [0,0,0,1,0,0|2,0,0]=3 1376 B8R1.1 OC[C@@H]1C[C@@H](CO1)O MCULE-7875239623 [0,0,0,1,0,0|1,0,0]=2 1377 B8R1.1 OC[C@@H]1C[C@H](CN1)F MCULE-4754863670 [0,0,0,1,0,0|3,0,0]=4 1378 B8R1.1 OC[C@@H]1C[C@H](CN1)F MCULE-4823692987 [0,0,0,1,0,0|3,0,0]=4 1379 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-4908761192 [0,0,0,1,0,0|2,0,0]=3 1380 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-5510339033 [0,0,0,1,0,0|2,0,0]=3 1381 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-7612890329 [0,0,0,1,0,0|2,0,0]=3 1382 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-8424913442 [0,0,0,1,0,0|2,0,0]=3 1383 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-7760122854 [0,0,0,1,0,0|2,0,0]=3 1384 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-9132554470 [0,0,0,1,0,0|2,0,0]=3 1385 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-2106727383 [0,0,0,1,0,0|3,0,0]=4 1386 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-3167425320 [0,0,0,1,0,0|3,0,0]=4 1387 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-5656834651 [0,0,0,1,0,0|3,0,0]=4 1388 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-9413584553 [0,0,0,1,0,0|3,0,0]=4 1389 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-2855908983 [0,0,0,1,0,0|2,0,0]=3 1390 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-5564885819 [0,0,0,1,0,0|2,0,0]=3 1391 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-9276468823 [0,0,0,1,0,0|2,0,0]=3 1392 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-9585503921 [0,0,0,1,0,0|2,0,0]=3 1393 B8R1.1 OC[C@H]1C[C@@H](CO1)O MCULE-5801561749 [0,0,0,1,0,0|1,0,0]=2 1394 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3583754715 [0,0,0,1,0,0|3,0,0]=4 1395 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3654392017 [0,0,0,1,0,0|3,0,0]=4 1396 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3959005096 [0,0,0,1,0,0|3,0,0]=4 1397 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-9542838904 [0,0,0,1,0,0|3,0,0]=4 1398 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-2099905531 [0,0,0,1,0,0|2,0,0]=3 1399 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-5693059049 [0,0,0,1,0,0|2,0,0]=3 1400 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-6004929736 [0,0,0,1,0,0|2,0,0]=3 1401 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-8607282785 [0,0,0,1,0,0|2,0,0]=3 1402 B8R1.1 OC[C@H]1C[C@H](CO1)O MCULE-4197376814 [0,0,0,1,0,0|1,0,0]=2 1403 B8R1.1 OC[C@H]1C[C@H](CO1)O MCULE-4573543387 [0,0,0,1,0,0|1,0,0]=2 1404 B8R1.1 [C@H]1(CC[C@H](C1)CN)F MCULE-4146565646 [0,0,0,1,0,0|3,0,0]=4 1405 B8R1.1 [C@H]1(CC[C@H](C1)CN)F MCULE-5300714166 [0,0,0,1,0,0|3,0,0]=4 1406 B8R1.1 [C@H]1(CN[C@@H](C1)CF)F MCULE-2056395387 [0,0,0,1,0,0|3,0,0]=4 1407 B8R1.1 [C@H]1(CN[C@@H](C1)CF)F MCULE-9578613289 [0,0,0,1,0,0|3,0,0]=4 1408 B8R1.1 [C@H]1(CN[C@@H](C1)CO)C MCULE-1910074067 [0,0,0,1,0,0|2,0,0]=3 1409 B8R1.1 [C@H]1(CN[C@@H](C1)CO)C MCULE-9340203932 [0,0,0,1,0,0|2,0,0]=3 1410 B8R1.1 [C@H]1(CN[C@@H](C1)CO)F MCULE-7089143816 [0,0,0,1,0,0|3,0,0]=4 1411 B8R1.1 [C@H]1(C[C@H](CN1)F)CO MCULE-2231031404 [0,0,0,1,0,0|3,0,0]=4 1412 B8R1.1 [C@H]1(C[C@H](CN1)F)CO MCULE-6096542902 [0,0,0,1,0,0|3,0,0]=4 1413 B8R1.1 [C@H]1(C[C@H](CN1)N)CO MCULE-6496782896 [0,0,0,1,0,0|3,0,0]=4 1414 B8R1.1 [C@H]1(C[C@H](CN1)O)CO MCULE-4041584401 [0,0,0,1,0,0|2,0,0]=3 1415 B8R1.1 [C@H]1(C[C@H](CN1)O)CO MCULE-9607072956 [0,0,0,1,0,0|2,0,0]=3 1416 B8R1.2 BrCC1=CCCCC1 MCULE-4196033923 [0,0,0,1,0,0|2,0,1]=4 1417 B8R1.2 BrCC1C=CCCC1 MCULE-3497010416 [0,0,0,1,0,0|2,0,1]=4 1418 B8R1.2 BrCC1CCCCC1 MCULE-1732610761 [0,0,0,1,0,0|2,0,0]=3 1419 B8R1.2 BrCC1CCCCN1 MCULE-2625695671 [0,0,0,1,0,0|2,0,0]=3 1420 B8R1.2 BrCC1CCCCN1 MCULE-9807498006 [0,0,0,1,0,0|2,0,0]=3 1421 B8R1.2 BrCC1CCCCO1 MCULE-7555024882 [0,0,0,1,0,0|1,0,0]=2 1422 B8R1.2 BrCC1CCCNC1 MCULE-1688987947 [0,0,0,1,0,0|3,0,0]=4 1423 B8R1.2 BrCC1CCCNC1 MCULE-4639020810 [0,0,0,1,0,0|3,0,0]=4 1424 B8R1.2 BrCC1CCCNC1 MCULE-8872043199 [0,0,0,1,0,0|3,0,0]=4 1425 B8R1.2 BrCC1CCCOC1 MCULE-8233955986 [0,0,0,1,0,0|3,0,0]=4 1426 B8R1.2 BrCC1CCNCC1 MCULE-1902670324 [0,0,0,1,0,0|3,0,0]=4 1427 B8R1.2 BrCC1CCNCC1 MCULE-8151707836 [0,0,0,1,0,0|3,0,0]=4 1428 B8R1.2 BrCC1CCNCC1 MCULE-9263446096 [0,0,0,1,0,0|3,0,0]=4 1429 B8R1.2 BrCC1CCOCC1 MCULE-9730123228 [0,0,0,1,0,0|3,0,0]=4 1430 B8R1.2 BrCC1CCOCO1 MCULE-1621211624 [0,0,0,1,0,0|2,0,0]=3 1431 B8R1.2 BrCC1CCSCC1 MCULE-8599747764 [0,0,0,1,0,0|3,0,0]=4 1432 B8R1.2 BrCC1CNCCO1 MCULE-4182788522 [0,0,0,1,0,0|2,0,0]=3 1433 B8R1.2 BrCC1CNCCO1 MCULE-4827459875 [0,0,0,1,0,0|2,0,0]=3 1434 B8R1.2 BrCC1COCCO1 MCULE-5294427682 [0,0,0,1,0,0|2,0,0]=3 1435 B8R1.2 BrC[C@@H]1COCCO1 MCULE-4849633409 [0,0,0,1,0,0|2,0,0]=3 1436 B8R1.2 BrC[C@H]1CCCOC1 MCULE-4617251201 [0,0,0,1,0,0|3,0,0]=4 1437 B8R1.2 C#CC1CCCCC1 MCULE-1010712187 [0,0,0,1,0,0|2,0,1]=4 1438 B8R1.2 C#CC1CCCCN1 MCULE-4194715110 [0,0,0,1,0,0|2,0,1]=4 1439 B8R1.2 C#CC1CCCCN1 MCULE-7315074830 [0,0,0,1,0,0|2,0,1]=4 1440 B8R1.2 C#CC1CCCCO1 MCULE-3115070208 [0,0,0,1,0,0|1,0,1]=3 1441 B8R1.2 C#CC1CNCCO1 MCULE-5920372974 [0,0,0,1,0,0|2,0,1]=4 1442 B8R1.2 C1(CCCCN1)CO MCULE-7414417382 [0,0,0,1,0,0|1,0,0]=2 1443 B8R1.2 C1(CCCCO1)CC MCULE-5189391029 [0,0,0,1,0,0|1,0,0]=2 1444 B8R1.2 C1(CCCOC1)CN MCULE-9009856435 [0,0,0,1,0,0|3,0,0]=4 1445 B8R1.2 C1(CNCCN1)CC MCULE-2886979448 [0,0,0,1,0,0|3,0,0]=4 1446 B8R1.2 C1(COCCO1)CN MCULE-3098204775 [0,0,0,1,0,0|2,0,0]=3 1447 B8R1.2 C1(COCCO1)CN MCULE-7024108523 [0,0,0,1,0,0|2,0,0]=3 1448 B8R1.2 C=CC1CCCCC1 MCULE-5657998956 [0,0,0,1,0,0|2,0,1]=4 1449 B8R1.2 C=CC1CCCCN1 MCULE-1327502475 [0,0,0,1,0,0|2,0,1]=4 1450 B8R1.2 C=CC1CCCCN1 MCULE-7059257921 [0,0,0,1,0,0|2,0,1]=4 1451 B8R1.2 CCC1=NCCCC1 MCULE-5828184755 [0,0,0,1,0,0|2,0,1]=4 1452 B8R1.2 CCC1CCCCC1 MCULE-9302115958 [0,0,0,1,0,0|2,0,0]=3 1453 B8R1.2 CCC1CCCCN1 MCULE-1463828922 [0,0,0,1,0,0|2,0,0]=3 1454 B8R1.2 CCC1CCCCN1 MCULE-4345537199 [0,0,0,1,0,0|2,0,0]=3 1455 B8R1.2 CCC1CCCCN1 MCULE-4598810496 [0,0,0,1,0,0|2,0,0]=3 1456 B8R1.2 CCC1CCCCN1 MCULE-6373382965 [0,0,0,1,0,0|2,0,0]=3 1457 B8R1.2 CCC1CCCNC1 MCULE-1867940470 [0,0,0,1,0,0|3,0,0]=4 1458 B8R1.2 CCC1CCCNC1 MCULE-4023638399 [0,0,0,1,0,0|3,0,0]=4 1459 B8R1.2 CCC1CCNCC1 MCULE-3584183153 [0,0,0,1,0,0|3,0,0]=4 1460 B8R1.2 CCC1CCNCC1 MCULE-6344088971 [0,0,0,1,0,0|3,0,0]=4 1461 B8R1.2 CCC1CNCCN1 MCULE-1309315605 [0,0,0,1,0,0|3,0,0]=4 1462 B8R1.2 CCC1CNCCN1 MCULE-3991328634 [0,0,0,1,0,0|3,0,0]=4 1463 B8R1.2 CCC1CNCCN1 MCULE-5654677429 [0,0,0,1,0,0|3,0,0]=4 1464 B8R1.2 CCC1CNCCN1 MCULE-7054869584 [0,0,0,1,0,0|3,0,0]=4 1465 B8R1.2 CCC1CNCCO1 MCULE-1491754999 [0,0,0,1,0,0|2,0,0]=3 1466 B8R1.2 CCC1CNCCO1 MCULE-2804411387 [0,0,0,1,0,0|2,0,0]=3 1467 B8R1.2 CCC1CNCCS1 MCULE-4342438029 [0,0,0,1,0,0|2,1,0]=4 1468 B8R1.2 CCC1COCCN1 MCULE-1485236181 [0,0,0,1,0,0|3,0,0]=4 1469 B8R1.2 CCC1COCCN1 MCULE-4870702180 [0,0,0,1,0,0|3,0,0]=4 1470 B8R1.2 CCC1COCCN1 MCULE-5742976431 [0,0,0,1,0,0|3,0,0]=4 1471 B8R1.2 CCC1COCCN1 MCULE-5859529267 [0,0,0,1,0,0|3,0,0]=4 1472 B8R1.2 CCC1COCCN1 MCULE-6635542159 [0,0,0,1,0,0|3,0,0]=4 1473 B8R1.2 CCC1COCCN1 MCULE-7278745800 [0,0,0,1,0,0|3,0,0]=4 1474 B8R1.2 CCN1CCCCC1 MCULE-4079252361 [0,0,0,1,0,0|3,0,0]=4 1475 B8R1.2 CC[C@@H]1CCCCN1 MCULE-1012550179 [0,0,0,1,0,0|2,0,0]=3 1476 B8R1.2 CC[C@@H]1CCCCN1 MCULE-6669069574 [0,0,0,1,0,0|2,0,0]=3 1477 B8R1.2 CC[C@@H]1CCCCN1 MCULE-7355467130 [0,0,0,1,0,0|2,0,0]=3 1478 B8R1.2 CC[C@@H]1CCCCN1 MCULE-7542229673 [0,0,0,1,0,0|2,0,0]=3 1479 B8R1.2 CC[C@@H]1CNCCN1 MCULE-5846905567 [0,0,0,1,0,0|3,0,0]=4 1480 B8R1.2 CC[C@@H]1CNCCN1 MCULE-7624605206 [0,0,0,1,0,0|3,0,0]=4 1481 B8R1.2 CC[C@@H]1CNCCN1 MCULE-9661707516 [0,0,0,1,0,0|3,0,0]=4 1482 B8R1.2 CC[C@@H]1CNCCN1 MCULE-9767062288 [0,0,0,1,0,0|3,0,0]=4 1483 B8R1.2 CC[C@@H]1CNCCO1 MCULE-5576287129 [0,0,0,1,0,0|2,0,0]=3 1484 B8R1.2 CC[C@@H]1CNCCO1 MCULE-7329824991 [0,0,0,1,0,0|2,0,0]=3 1485 B8R1.2 CC[C@@H]1COCCN1 MCULE-1811299877 [0,0,0,1,0,0|3,0,0]=4 1486 B8R1.2 CC[C@@H]1COCCN1 MCULE-3459096398 [0,0,0,1,0,0|3,0,0]=4 1487 B8R1.2 CC[C@@H]1COCCN1 MCULE-7028956931 [0,0,0,1,0,0|3,0,0]=4 1488 B8R1.2 CC[C@@H]1COCCN1 MCULE-9503018858 [0,0,0,1,0,0|3,0,0]=4 1489 B8R1.2 CC[C@H]1CCCCN1 MCULE-2554275022 [0,0,0,1,0,0|2,0,0]=3 1490 B8R1.2 CC[C@H]1CCCCN1 MCULE-3433938348 [0,0,0,1,0,0|2,0,0]=3 1491 B8R1.2 CC[C@H]1CCCCN1 MCULE-5134937129 [0,0,0,1,0,0|2,0,0]=3 1492 B8R1.2 CC[C@H]1CCCCN1 MCULE-9567977241 [0,0,0,1,0,0|2,0,0]=3 1493 B8R1.2 CC[C@H]1CNCCN1 MCULE-1904360840 [0,0,0,1,0,0|3,0,0]=4 1494 B8R1.2 CC[C@H]1CNCCN1 MCULE-3445783000 [0,0,0,1,0,0|3,0,0]=4 1495 B8R1.2 CC[C@H]1CNCCN1 MCULE-3843396321 [0,0,0,1,0,0|3,0,0]=4 1496 B8R1.2 CC[C@H]1CNCCN1 MCULE-8055405480 [0,0,0,1,0,0|3,0,0]=4 1497 B8R1.2 CC[C@H]1CNCCO1 MCULE-1213088635 [0,0,0,1,0,0|2,0,0]=3 1498 B8R1.2 CC[C@H]1CNCCO1 MCULE-1732774154 [0,0,0,1,0,0|2,0,0]=3 1499 B8R1.2 CC[C@H]1CNCCO1 MCULE-2604595853 [0,0,0,1,0,0|2,0,0]=3 1500 B8R1.2 CC[C@H]1CNCCO1 MCULE-6508226283 [0,0,0,1,0,0|2,0,0]=3 1501 B8R1.2 CC[C@H]1COCCN1 MCULE-2034781343 [0,0,0,1,0,0|3,0,0]=4 1502 B8R1.2 CC[C@H]1COCCN1 MCULE-3202863048 [0,0,0,1,0,0|3,0,0]=4 1503 B8R1.2 CC[C@H]1COCCN1 MCULE-5482717232 [0,0,0,1,0,0|3,0,0]=4 1504 B8R1.2 CC[C@H]1COCCN1 MCULE-6933747469 [0,0,0,1,0,0|3,0,0]=4 1505 B8R1.2 CNC1CCCCC1 MCULE-8593678924 [0,0,0,1,0,0|3,0,0]=4 1506 B8R1.2 COC1CCCCC1 MCULE-2340244681 [0,0,0,1,0,0|3,0,0]=4 1507 B8R1.2 COC1CCCCO1 MCULE-5586923898 [0,0,0,1,0,0|2,0,0]=3 1508 B8R1.2 COC1CNCCO1 MCULE-4273991787 [0,0,0,1,0,0|3,0,0]=4 1509 B8R1.2 CSC1CCCCC1 MCULE-5570458252 [0,0,0,1,0,0|3,0,0]=4 1510 B8R1.2 ClCC1CCCCC1 MCULE-2364408988 [0,0,0,1,0,0|2,0,0]=3 1511 B8R1.2 ClCC1CCCCN1 MCULE-3215583581 [0,0,0,1,0,0|2,0,0]=3 1512 B8R1.2 ClCC1CCCCN1 MCULE-8949714419 [0,0,0,1,0,0|2,0,0]=3 1513 B8R1.2 ClCC1CCCCO1 MCULE-7493119643 [0,0,0,1,0,0|1,0,0]=2 1514 B8R1.2 ClCC1CCCNC1 MCULE-5655173642 [0,0,0,1,0,0|3,0,0]=4 1515 B8R1.2 ClCC1CCCNC1 MCULE-6782147187 [0,0,0,1,0,0|3,0,0]=4 1516 B8R1.2 ClCC1CCCOC1 MCULE-8502008950 [0,0,0,1,0,0|3,0,0]=4 1517 B8R1.2 ClCC1CCNCC1 MCULE-3291175881 [0,0,0,1,0,0|3,0,0]=4 1518 B8R1.2 ClCC1CCNCC1 MCULE-7012497581 [0,0,0,1,0,0|3,0,0]=4 1519 B8R1.2 ClCC1CCOCC1 MCULE-1211854956 [0,0,0,1,0,0|3,0,0]=4 1520 B8R1.2 ClCC1CCOCO1 MCULE-9757657411 [0,0,0,1,0,0|2,0,0]=3 1521 B8R1.2 ClCC1CNCCO1 MCULE-6977459966 [0,0,0,1,0,0|2,0,0]=3 1522 B8R1.2 ClCC1CNCCO1 MCULE-7633503523 [0,0,0,1,0,0|2,0,0]=3 1523 B8R1.2 ClCC1COCCO1 MCULE-5491048081 [0,0,0,1,0,0|2,0,0]=3 1524 B8R1.2 ClCC1OCCCO1 MCULE-7396357867 [0,0,0,1,0,0|2,0,0]=3 1525 B8R1.2 ClCN1CCCCC1 MCULE-8272974338 [0,0,0,1,0,0|3,0,0]=4 1526 B8R1.2 ClC[C@@H]1CNCCO1 MCULE-8134652552 [0,0,0,1,0,0|2,0,0]=3 1527 B8R1.2 ClC[C@H]1CNCCO1 MCULE-4491372571 [0,0,0,1,0,0|2,0,0]=3 1528 B8R1.2 FCC1CCCCN1 MCULE-4091234595 [0,0,0,1,0,0|2,0,0]=3 1529 B8R1.2 FCC1CCCCN1 MCULE-7748360337 [0,0,0,1,0,0|2,0,0]=3 1530 B8R1.2 FCC1CCCNC1 MCULE-4910890691 [0,0,0,1,0,0|3,0,0]=4 1531 B8R1.2 FCC1CCCNC1 MCULE-9227191637 [0,0,0,1,0,0|3,0,0]=4 1532 B8R1.2 FCC1CCNCC1 MCULE-4678768007 [0,0,0,1,0,0|3,0,0]=4 1533 B8R1.2 FCC1CCNCC1 MCULE-6719565621 [0,0,0,1,0,0|3,0,0]=4 1534 B8R1.2 FCC1CNCCN1 MCULE-3651726090 [0,0,0,1,0,0|3,0,0]=4 1535 B8R1.2 FCC1CNCCN1 MCULE-9330203611 [0,0,0,1,0,0|3,0,0]=4 1536 B8R1.2 FCC1CNCCO1 MCULE-1442465580 [0,0,0,1,0,0|2,0,0]=3 1537 B8R1.2 FCC1CNCCO1 MCULE-9755393279 [0,0,0,1,0,0|2,0,0]=3 1538 B8R1.2 FC[C@@H]1CCCCN1 MCULE-2249718416 [0,0,0,1,0,0|2,0,0]=3 1539 B8R1.2 FC[C@@H]1CCCCN1 MCULE-2335185919 [0,0,0,1,0,0|2,0,0]=3 1540 B8R1.2 FC[C@@H]1CCCCN1 MCULE-7515953101 [0,0,0,1,0,0|2,0,0]=3 1541 B8R1.2 FC[C@@H]1CCCCN1 MCULE-8096430166 [0,0,0,1,0,0|2,0,0]=3 1542 B8R1.2 FC[C@H]1CNCCN1 MCULE-7261068132 [0,0,0,1,0,0|3,0,0]=4 1543 B8R1.2 FC[C@H]1CNCCN1 MCULE-9335969220 [0,0,0,1,0,0|3,0,0]=4 1544 B8R1.2 ICC1CCCCC1 MCULE-7820192716 [0,0,0,1,0,0|2,0,0]=3 1545 B8R1.2 ICC1CCCCN1 MCULE-5434926156 [0,0,0,1,0,0|2,0,0]=3 1546 B8R1.2 ICC1CCCCN1 MCULE-5785133159 [0,0,0,1,0,0|2,0,0]=3 1547 B8R1.2 ICC1CCCCO1 MCULE-4630701067 [0,0,0,1,0,0|1,0,0]=2 1548 B8R1.2 ICC1CCCNC1 MCULE-6140804596 [0,0,0,1,0,0|3,0,0]=4 1549 B8R1.2 ICC1CCCNC1 MCULE-7111371001 [0,0,0,1,0,0|3,0,0]=4 1550 B8R1.2 ICC1CCCOC1 MCULE-7706519514 [0,0,0,1,0,0|3,0,0]=4 1551 B8R1.2 ICC1CCNCC1 MCULE-1905252341 [0,0,0,1,0,0|3,0,0]=4 1552 B8R1.2 ICC1CCNCC1 MCULE-9474318973 [0,0,0,1,0,0|3,0,0]=4 1553 B8R1.2 ICC1CCOCC1 MCULE-1501983761 [0,0,0,1,0,0|3,0,0]=4 1554 B8R1.2 ICC1COCCO1 MCULE-1992463610 [0,0,0,1,0,0|2,0,0]=3 1555 B8R1.2 N#CC1CCCCC1 MCULE-2156159345 [0,0,0,1,0,0|2,0,1]=4 1556 B8R1.2 N#CC1CCCCN1 MCULE-1697826413 [0,0,0,1,0,0|2,0,1]=4 1557 B8R1.2 N#CC1CCCCN1 MCULE-3334055664 [0,0,0,1,0,0|2,0,1]=4 1558 B8R1.2 N#CC1CCCCN1 MCULE-4086101013 [0,0,0,1,0,0|2,0,1]=4 1559 B8R1.2 N#CC1CCCCN1 MCULE-6025106560 [0,0,0,1,0,0|2,0,1]=4 1560 B8R1.2 N#CC1CCCCO1 MCULE-3506953632 [0,0,0,1,0,0|1,0,1]=3 1561 B8R1.2 N#CC1CCCCS1 MCULE-3643161044 [0,0,0,1,0,0|1,1,1]=4 1562 B8R1.2 N#CC1CNCCO1 MCULE-4550543456 [0,0,0,1,0,0|2,0,1]=4 1563 B8R1.2 N#CC1CNCCO1 MCULE-6560196862 [0,0,0,1,0,0|2,0,1]=4 1564 B8R1.2 N#CC1COCCO1 MCULE-2295478591 [0,0,0,1,0,0|2,0,1]=4 1565 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-4428095484 [0,0,0,1,0,0|2,0,1]=4 1566 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-4927353010 [0,0,0,1,0,0|2,0,1]=4 1567 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-5087232665 [0,0,0,1,0,0|2,0,1]=4 1568 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-5509246319 [0,0,0,1,0,0|2,0,1]=4 1569 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-6114021285 [0,0,0,1,0,0|2,0,1]=4 1570 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-7595225760 [0,0,0,1,0,0|2,0,1]=4 1571 B8R1.2 N#C[C@@H]1CNCCO1 MCULE-1210885105 [0,0,0,1,0,0|2,0,1]=4 1572 B8R1.2 N#C[C@@H]1CNCCO1 MCULE-1702118123 [0,0,0,1,0,0|2,0,1]=4 1573 B8R1.2 N#C[C@H]1CCCCN1 MCULE-3583532381 [0,0,0,1,0,0|2,0,1]=4 1574 B8R1.2 N#C[C@H]1CCCCN1 MCULE-4527493190 [0,0,0,1,0,0|2,0,1]=4 1575 B8R1.2 N#C[C@H]1CCCCN1 MCULE-7988967151 [0,0,0,1,0,0|2,0,1]=4 1576 B8R1.2 N#C[C@H]1CCCCN1 MCULE-9951441572 [0,0,0,1,0,0|2,0,1]=4 1577 B8R1.2 N#C[C@H]1CNCCO1 MCULE-7284312056 [0,0,0,1,0,0|2,0,1]=4 1578 B8R1.2 N#C[C@H]1CNCCO1 MCULE-7835414987 [0,0,0,1,0,0|2,0,1]=4 1579 B8R1.2 N#C[C@H]1CNCCO1 MCULE-8434238785 [0,0,0,1,0,0|2,0,1]=4 1580 B8R1.2 N#C[C@H]1CNCCO1 MCULE-9489364726 [0,0,0,1,0,0|2,0,1]=4 1581 B8R1.2 NCC1=CCCCC1 MCULE-3951635533 [0,0,0,1,0,0|2,0,1]=4 1582 B8R1.2 NCC1=CCCCC1 MCULE-4923330324 [0,0,0,1,0,0|2,0,1]=4 1583 B8R1.2 NCC1CCC=CO1 MCULE-9848121283 [0,0,0,1,0,0|1,0,2]=4 1584 B8R1.2 NCC1CCCCC1 MCULE-3156148976 [0,0,0,1,0,0|2,0,0]=3 1585 B8R1.2 NCC1CCCCC1 MCULE-7375566253 [0,0,0,1,0,0|2,0,0]=3 1586 B8R1.2 NCC1CCCCC1 MCULE-8029432210 [0,0,0,1,0,0|2,0,0]=3 1587 B8R1.2 NCC1CCCCN1 MCULE-5628582900 [0,0,0,1,0,0|2,0,0]=3 1588 B8R1.2 NCC1CCCCN1 MCULE-7762336274 [0,0,0,1,0,0|2,0,0]=3 1589 B8R1.2 NCC1CCCCO1 MCULE-2644735894 [0,0,0,1,0,0|1,0,0]=2 1590 B8R1.2 NCC1CCCCO1 MCULE-5042678896 [0,0,0,1,0,0|1,0,0]=2 1591 B8R1.2 NCC1CCCCS1 MCULE-1705875111 [0,0,0,1,0,0|1,1,0]=3 1592 B8R1.2 NCC1CCCNC1 MCULE-3758525803 [0,0,0,1,0,0|3,0,0]=4 1593 B8R1.2 NCC1CCCNC1 MCULE-4215149964 [0,0,0,1,0,0|3,0,0]=4 1594 B8R1.2 NCC1CCCOC1 MCULE-2859652493 [0,0,0,1,0,0|3,0,0]=4 1595 B8R1.2 NCC1CCCOC1 MCULE-5411442728 [0,0,0,1,0,0|3,0,0]=4 1596 B8R1.2 NCC1CCCOC1 MCULE-6616131288 [0,0,0,1,0,0|3,0,0]=4 1597 B8R1.2 NCC1CCCOC1 MCULE-9893994601 [0,0,0,1,0,0|3,0,0]=4 1598 B8R1.2 NCC1CCCSC1 MCULE-1894328803 [0,0,0,1,0,0|3,0,0]=4 1599 B8R1.2 NCC1CCNCC1 MCULE-3105491297 [0,0,0,1,0,0|3,0,0]=4 1600 B8R1.2 NCC1CCOCC1 MCULE-6047019505 [0,0,0,1,0,0|3,0,0]=4 1601 B8R1.2 NCC1CCOCC1 MCULE-6910667705 [0,0,0,1,0,0|3,0,0]=4 1602 B8R1.2 NCC1CCSCC1 MCULE-1936385423 [0,0,0,1,0,0|3,0,0]=4 1603 B8R1.2 NCC1CCSCC1 MCULE-5910874273 [0,0,0,1,0,0|3,0,0]=4 1604 B8R1.2 NCC1CNCCO1 MCULE-4362254656 [0,0,0,1,0,0|2,0,0]=3 1605 B8R1.2 NCC1CNCCO1 MCULE-9062864656 [0,0,0,1,0,0|2,0,0]=3 1606 B8R1.2 NCC1COCCN1 MCULE-2617141258 [0,0,0,1,0,0|3,0,0]=4 1607 B8R1.2 NCC1COCCN1 MCULE-5931201215 [0,0,0,1,0,0|3,0,0]=4 1608 B8R1.2 NCC1COCCO1 MCULE-1612004893 [0,0,0,1,0,0|2,0,0]=3 1609 B8R1.2 NCC1COCCO1 MCULE-9278150730 [0,0,0,1,0,0|2,0,0]=3 1610 B8R1.2 NCC1CSCCN1 MCULE-2206802895 [0,0,0,1,0,0|3,0,0]=4 1611 B8R1.2 NCC1CSCCS1 MCULE-8020891732 [0,0,0,1,0,0|2,1,0]=4 1612 B8R1.2 NCC1OCCCO1 MCULE-8138335107 [0,0,0,1,0,0|2,0,0]=3 1613 B8R1.2 NC[C@@H]1CCCCN1 MCULE-2094976900 [0,0,0,1,0,0|2,0,0]=3 1614 B8R1.2 NC[C@@H]1CCCCN1 MCULE-3736890217 [0,0,0,1,0,0|2,0,0]=3 1615 B8R1.2 NC[C@@H]1CCCCO1 MCULE-1435985280 [0,0,0,1,0,0|1,0,0]=2 1616 B8R1.2 NC[C@@H]1CCCCO1 MCULE-4778440271 [0,0,0,1,0,0|1,0,0]=2 1617 B8R1.2 NC[C@@H]1CCCCO1 MCULE-6014338525 [0,0,0,1,0,0|1,0,0]=2 1618 B8R1.2 NC[C@@H]1CCCCO1 MCULE-9488694680 [0,0,0,1,0,0|1,0,0]=2 1619 B8R1.2 NC[C@@H]1CCCNC1 MCULE-4700132151 [0,0,0,1,0,0|3,0,0]=4 1620 B8R1.2 NC[C@@H]1CCCNC1 MCULE-4826798446 [0,0,0,1,0,0|3,0,0]=4 1621 B8R1.2 NC[C@@H]1CCCNC1 MCULE-5621058783 [0,0,0,1,0,0|3,0,0]=4 1622 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5314997557 [0,0,0,1,0,0|3,0,0]=4 1623 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5553412637 [0,0,0,1,0,0|3,0,0]=4 1624 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6349833867 [0,0,0,1,0,0|3,0,0]=4 1625 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6463109886 [0,0,0,1,0,0|3,0,0]=4 1626 B8R1.2 NC[C@@H]1COCCO1 MCULE-2337005422 [0,0,0,1,0,0|2,0,0]=3 1627 B8R1.2 NC[C@@H]1COCCO1 MCULE-5052227155 [0,0,0,1,0,0|2,0,0]=3 1628 B8R1.2 NC[C@@H]1COCCO1 MCULE-5182478394 [0,0,0,1,0,0|2,0,0]=3 1629 B8R1.2 NC[C@@H]1COCCO1 MCULE-9731790782 [0,0,0,1,0,0|2,0,0]=3 1630 B8R1.2 NC[C@H]1CCCCN1 MCULE-2124027272 [0,0,0,1,0,0|2,0,0]=3 1631 B8R1.2 NC[C@H]1CCCCN1 MCULE-5815797207 [0,0,0,1,0,0|2,0,0]=3 1632 B8R1.2 NC[C@H]1CCCCO1 MCULE-2835389541 [0,0,0,1,0,0|1,0,0]=2 1633 B8R1.2 NC[C@H]1CCCCO1 MCULE-4500797236 [0,0,0,1,0,0|1,0,0]=2 1634 B8R1.2 NC[C@H]1CCCCO1 MCULE-5990717573 [0,0,0,1,0,0|1,0,0]=2 1635 B8R1.2 NC[C@H]1CCCCO1 MCULE-7362278601 [0,0,0,1,0,0|1,0,0]=2 1636 B8R1.2 NC[C@H]1CCCNC1 MCULE-1544884485 [0,0,0,1,0,0|3,0,0]=4 1637 B8R1.2 NC[C@H]1CCCNC1 MCULE-1869159747 [0,0,0,1,0,0|3,0,0]=4 1638 B8R1.2 NC[C@H]1CCCNC1 MCULE-5445972707 [0,0,0,1,0,0|3,0,0]=4 1639 B8R1.2 NC[C@H]1CCCNC1 MCULE-5734934526 [0,0,0,1,0,0|3,0,0]=4 1640 B8R1.2 NC[C@H]1CCCNC1 MCULE-9259563350 [0,0,0,1,0,0|3,0,0]=4 1641 B8R1.2 NC[C@H]1CCCOC1 MCULE-1996808023 [0,0,0,1,0,0|3,0,0]=4 1642 B8R1.2 NC[C@H]1CCCOC1 MCULE-8044635428 [0,0,0,1,0,0|3,0,0]=4 1643 B8R1.2 NC[C@H]1CCCOC1 MCULE-8246511133 [0,0,0,1,0,0|3,0,0]=4 1644 B8R1.2 NC[C@H]1CCCOC1 MCULE-8378816563 [0,0,0,1,0,0|3,0,0]=4 1645 B8R1.2 NC[C@H]1COCCO1 MCULE-1148680339 [0,0,0,1,0,0|2,0,0]=3 1646 B8R1.2 NC[C@H]1COCCO1 MCULE-6244775356 [0,0,0,1,0,0|2,0,0]=3 1647 B8R1.2 NC[C@H]1COCCO1 MCULE-6383517047 [0,0,0,1,0,0|2,0,0]=3 1648 B8R1.2 NC[C@H]1COCCO1 MCULE-9768281737 [0,0,0,1,0,0|2,0,0]=3 1649 B8R1.2 NNC1CCCCC1 MCULE-1043288751 [0,0,0,1,0,0|3,0,0]=4 1650 B8R1.2 NNC1CCCCC1 MCULE-2654277681 [0,0,0,1,0,0|3,0,0]=4 1651 B8R1.2 NNC1CCCCC1 MCULE-3543475794 [0,0,0,1,0,0|3,0,0]=4 1652 B8R1.2 NOC1CCCCC1 MCULE-1475995970 [0,0,0,1,0,0|3,0,0]=4 1653 B8R1.2 NOC1CCCCC1 MCULE-3638462708 [0,0,0,1,0,0|3,0,0]=4 1654 B8R1.2 NOC1CCCCO1 MCULE-2818785498 [0,0,0,1,0,0|2,0,0]=3 1655 B8R1.2 O=CC1CCCCC1 MCULE-7345097178 [0,0,0,1,0,0|1,0,2]=4 1656 B8R1.2 O=CC1CCCCN1 MCULE-7681438476 [0,0,0,1,0,0|1,0,2]=4 1657 B8R1.2 O=CC1CCCCN1 MCULE-9370686295 [0,0,0,1,0,0|1,0,2]=4 1658 B8R1.2 O=CC1CCCCO1 MCULE-6497412510 [0,0,0,1,0,0|0,0,2]=3 1659 B8R1.2 O=CC1COCCO1 MCULE-3817488986 [0,0,0,1,0,0|1,0,2]=4 1660 B8R1.2 OCC1=CCCCC1 MCULE-2422738199 [0,0,0,1,0,0|1,0,1]=3 1661 B8R1.2 OCC1=CCCCO1 MCULE-1995059172 [0,0,0,1,0,0|0,0,2]=3 1662 B8R1.2 OCC1=CCCOC1 MCULE-5407184933 [0,0,0,1,0,0|2,0,1]=4 1663 B8R1.2 OCC1=CCOCC1 MCULE-6666473990 [0,0,0,1,0,0|2,0,1]=4 1664 B8R1.2 OCC1=NOCCC1 MCULE-7754725295 [0,0,0,1,0,0|2,0,1]=4 1665 B8R1.2 OCC1C=CCCC1 MCULE-3264381346 [0,0,0,1,0,0|1,0,1]=3 1666 B8R1.2 OCC1C=CCCN1 MCULE-1476642397 [0,0,0,1,0,0|1,0,2]=4 1667 B8R1.2 OCC1CC=CCC1 MCULE-7843809650 [0,0,0,1,0,0|1,0,2]=4 1668 B8R1.2 OCC1CC=CCO1 MCULE-1009946564 [0,0,0,1,0,0|0,0,2]=3 1669 B8R1.2 OCC1CCC=CO1 MCULE-7646685626 [0,0,0,1,0,0|0,0,2]=3 1670 B8R1.2 OCC1CCCCC1 MCULE-6571547092 [0,0,0,1,0,0|1,0,0]=2 1671 B8R1.2 OCC1CCCCN1 MCULE-1839660028 [0,0,0,1,0,0|1,0,0]=2 1672 B8R1.2 OCC1CCCCN1 MCULE-5190999833 [0,0,0,1,0,0|1,0,0]=2 1673 B8R1.2 OCC1CCCCO1 MCULE-2390789074 [0,0,0,1,0,0|0,0,0]=1 1674 B8R1.2 OCC1CCCCO1 MCULE-7483291767 [0,0,0,1,0,0|0,0,0]=1 1675 B8R1.2 OCC1CCCCS1 MCULE-8533707311 [0,0,0,1,0,0|0,1,0]=2 1676 B8R1.2 OCC1CCCNC1 MCULE-1126180349 [0,0,0,1,0,0|2,0,0]=3 1677 B8R1.2 OCC1CCCNC1 MCULE-1796388857 [0,0,0,1,0,0|2,0,0]=3 1678 B8R1.2 OCC1CCCNC1 MCULE-3885962581 [0,0,0,1,0,0|2,0,0]=3 1679 B8R1.2 OCC1CCCNC1 MCULE-9246039906 [0,0,0,1,0,0|2,0,0]=3 1680 B8R1.2 OCC1CCCOC1 MCULE-6464024960 [0,0,0,1,0,0|2,0,0]=3 1681 B8R1.2 OCC1CCCOC1 MCULE-9624599290 [0,0,0,1,0,0|2,0,0]=3 1682 B8R1.2 OCC1CCCSC1 MCULE-1730158244 [0,0,0,1,0,0|2,0,0]=3 1683 B8R1.2 OCC1CCNCC1 MCULE-3303736479 [0,0,0,1,0,0|2,0,0]=3 1684 B8R1.2 OCC1CCNCC1 MCULE-5679503328 [0,0,0,1,0,0|2,0,0]=3 1685 B8R1.2 OCC1CCNCO1 MCULE-2495139428 [0,0,0,1,0,0|1,0,0]=2 1686 B8R1.2 OCC1CCNCO1 MCULE-8567556837 [0,0,0,1,0,0|1,0,0]=2 1687 B8R1.2 OCC1CCOCC1 MCULE-8259124266 [0,0,0,1,0,0|2,0,0]=3 1688 B8R1.2 OCC1CCOCO1 MCULE-2733488185 [0,0,0,1,0,0|1,0,0]=2 1689 B8R1.2 OCC1CCSCC1 MCULE-5223983457 [0,0,0,1,0,0|2,0,0]=3 1690 B8R1.2 OCC1CNCCN1 MCULE-1401587868 [0,0,0,1,0,0|2,0,0]=3 1691 B8R1.2 OCC1CNCCN1 MCULE-7423856879 [0,0,0,1,0,0|2,0,0]=3 1692 B8R1.2 OCC1CNCCN1 MCULE-8309538868 [0,0,0,1,0,0|2,0,0]=3 1693 B8R1.2 OCC1CNCCN1 MCULE-9359285661 [0,0,0,1,0,0|2,0,0]=3 1694 B8R1.2 OCC1CNCCO1 MCULE-1938288280 [0,0,0,1,0,0|1,0,0]=2 1695 B8R1.2 OCC1CNCCO1 MCULE-7041892647 [0,0,0,1,0,0|1,0,0]=2 1696 B8R1.2 OCC1CNCCO1 MCULE-8873542150 [0,0,0,1,0,0|1,0,0]=2 1697 B8R1.2 OCC1CNCCO1 MCULE-9279337391 [0,0,0,1,0,0|1,0,0]=2 1698 B8R1.2 OCC1COCCN1 MCULE-1141875416 [0,0,0,1,0,0|2,0,0]=3 1699 B8R1.2 OCC1COCCN1 MCULE-2383049328 [0,0,0,1,0,0|2,0,0]=3 1700 B8R1.2 OCC1COCCN1 MCULE-3747324792 [0,0,0,1,0,0|2,0,0]=3 1701 B8R1.2 OCC1COCCN1 MCULE-8656197859 [0,0,0,1,0,0|2,0,0]=3 1702 B8R1.2 OCC1COCCO1 MCULE-3788845525 [0,0,0,1,0,0|1,0,0]=2 1703 B8R1.2 OCC1COCCO1 MCULE-5558091087 [0,0,0,1,0,0|1,0,0]=2 1704 B8R1.2 OCC1CSCCN1 MCULE-9615907863 [0,0,0,1,0,0|2,0,0]=3 1705 B8R1.2 OCC1OCCCO1 MCULE-6150110813 [0,0,0,1,0,0|1,0,0]=2 1706 B8R1.2 OC[C@@H]1CCCCN1 MCULE-6170192975 [0,0,0,1,0,0|1,0,0]=2 1707 B8R1.2 OC[C@@H]1CCCCN1 MCULE-7805438267 [0,0,0,1,0,0|1,0,0]=2 1708 B8R1.2 OC[C@@H]1CCCCN1 MCULE-8160671578 [0,0,0,1,0,0|1,0,0]=2 1709 B8R1.2 OC[C@@H]1CCCCO1 MCULE-5978396739 [0,0,0,1,0,0|0,0,0]=1 1710 B8R1.2 OC[C@@H]1CCCCO1 MCULE-8715909099 [0,0,0,1,0,0|0,0,0]=1 1711 B8R1.2 OC[C@@H]1CCCNC1 MCULE-1362591489 [0,0,0,1,0,0|2,0,0]=3 1712 B8R1.2 OC[C@@H]1CCCNC1 MCULE-2943211570 [0,0,0,1,0,0|2,0,0]=3 1713 B8R1.2 OC[C@@H]1CCCNC1 MCULE-8452110091 [0,0,0,1,0,0|2,0,0]=3 1714 B8R1.2 OC[C@@H]1CCCNC1 MCULE-9511978382 [0,0,0,1,0,0|2,0,0]=3 1715 B8R1.2 OC[C@@H]1CCCOC1 MCULE-5580637299 [0,0,0,1,0,0|2,0,0]=3 1716 B8R1.2 OC[C@@H]1CCCOC1 MCULE-9673827278 [0,0,0,1,0,0|2,0,0]=3 1717 B8R1.2 OC[C@@H]1CNCCN1 MCULE-3656110325 [0,0,0,1,0,0|2,0,0]=3 1718 B8R1.2 OC[C@@H]1CNCCN1 MCULE-7030471384 [0,0,0,1,0,0|2,0,0]=3 1719 B8R1.2 OC[C@@H]1CNCCN1 MCULE-7465480170 [0,0,0,1,0,0|2,0,0]=3 1720 B8R1.2 OC[C@@H]1CNCCN1 MCULE-9542102138 [0,0,0,1,0,0|2,0,0]=3 1721 B8R1.2 OC[C@@H]1CNCCO1 MCULE-5428209505 [0,0,0,1,0,0|1,0,0]=2 1722 B8R1.2 OC[C@@H]1CNCCO1 MCULE-6006812099 [0,0,0,1,0,0|1,0,0]=2 1723 B8R1.2 OC[C@@H]1CNCCO1 MCULE-6118730357 [0,0,0,1,0,0|1,0,0]=2 1724 B8R1.2 OC[C@@H]1CNCCO1 MCULE-9753568594 [0,0,0,1,0,0|1,0,0]=2 1725 B8R1.2 OC[C@@H]1COCCN1 MCULE-2260461335 [0,0,0,1,0,0|2,0,0]=3 1726 B8R1.2 OC[C@@H]1COCCN1 MCULE-7365178843 [0,0,0,1,0,0|2,0,0]=3 1727 B8R1.2 OC[C@@H]1COCCN1 MCULE-8155625467 [0,0,0,1,0,0|2,0,0]=3 1728 B8R1.2 OC[C@@H]1COCCN1 MCULE-9822056975 [0,0,0,1,0,0|2,0,0]=3 1729 B8R1.2 OC[C@@H]1COCCO1 MCULE-5847134890 [0,0,0,1,0,0|1,0,0]=2 1730 B8R1.2 OC[C@@H]1COCCO1 MCULE-6096501847 [0,0,0,1,0,0|1,0,0]=2 1731 B8R1.2 OC[C@H]1CCC=CO1 MCULE-3753346509 [0,0,0,1,0,0|0,0,2]=3 1732 B8R1.2 OC[C@H]1CCCCN1 MCULE-1585224164 [0,0,0,1,0,0|1,0,0]=2 1733 B8R1.2 OC[C@H]1CCCCN1 MCULE-2860177964 [0,0,0,1,0,0|1,0,0]=2 1734 B8R1.2 OC[C@H]1CCCCO1 MCULE-4700719427 [0,0,0,1,0,0|0,0,0]=1 1735 B8R1.2 OC[C@H]1CCCCO1 MCULE-7990169259 [0,0,0,1,0,0|0,0,0]=1 1736 B8R1.2 OC[C@H]1CCCNC1 MCULE-3504380705 [0,0,0,1,0,0|2,0,0]=3 1737 B8R1.2 OC[C@H]1CCCNC1 MCULE-6518143765 [0,0,0,1,0,0|2,0,0]=3 1738 B8R1.2 OC[C@H]1CCCNC1 MCULE-6752674060 [0,0,0,1,0,0|2,0,0]=3 1739 B8R1.2 OC[C@H]1CCCNC1 MCULE-9392193352 [0,0,0,1,0,0|2,0,0]=3 1740 B8R1.2 OC[C@H]1CCCOC1 MCULE-8066618329 [0,0,0,1,0,0|2,0,0]=3 1741 B8R1.2 OC[C@H]1CCCOC1 MCULE-8831105119 [0,0,0,1,0,0|2,0,0]=3 1742 B8R1.2 OC[C@H]1CNCCN1 MCULE-2062612556 [0,0,0,1,0,0|2,0,0]=3 1743 B8R1.2 OC[C@H]1CNCCN1 MCULE-3003505442 [0,0,0,1,0,0|2,0,0]=3 1744 B8R1.2 OC[C@H]1CNCCN1 MCULE-3400481255 [0,0,0,1,0,0|2,0,0]=3 1745 B8R1.2 OC[C@H]1CNCCN1 MCULE-5683382374 [0,0,0,1,0,0|2,0,0]=3 1746 B8R1.2 OC[C@H]1CNCCN1 MCULE-8795905011 [0,0,0,1,0,0|2,0,0]=3 1747 B8R1.2 OC[C@H]1CNCCO1 MCULE-2083087681 [0,0,0,1,0,0|1,0,0]=2 1748 B8R1.2 OC[C@H]1CNCCO1 MCULE-2399844881 [0,0,0,1,0,0|1,0,0]=2 1749 B8R1.2 OC[C@H]1CNCCO1 MCULE-5372536833 [0,0,0,1,0,0|1,0,0]=2 1750 B8R1.2 OC[C@H]1CNCCO1 MCULE-9994722027 [0,0,0,1,0,0|1,0,0]=2 1751 B8R1.2 OC[C@H]1COCCN1 MCULE-2570187475 [0,0,0,1,0,0|2,0,0]=3 1752 B8R1.2 OC[C@H]1COCCN1 MCULE-5479794518 [0,0,0,1,0,0|2,0,0]=3 1753 B8R1.2 OC[C@H]1COCCN1 MCULE-5550353523 [0,0,0,1,0,0|2,0,0]=3 1754 B8R1.2 OC[C@H]1COCCN1 MCULE-6091772249 [0,0,0,1,0,0|2,0,0]=3 1755 B8R1.2 OC[C@H]1COCCO1 MCULE-1373070349 [0,0,0,1,0,0|1,0,0]=2 1756 B8R1.2 OC[C@H]1COCCO1 MCULE-9271539014 [0,0,0,1,0,0|1,0,0]=2 1757 B8R1.2 ON=C1CCCCC1 MCULE-4628080057 [0,0,0,1,0,0|2,0,1]=4 1758 B8R1.2 ONC1CCCCC1 MCULE-7854482550 [0,0,0,1,0,0|2,0,0]=3 1759 B8R1.2 O[NH2+]C1CCCCC1 MCULE-5578731568 [0,0,0,1,0,0|2,0,0]=3 1760 B8R1.2 SCC1CCCCC1 MCULE-4073711524 [0,0,0,1,0,0|1,1,0]=3 1761 B8R1.2 SCC1CCCOC1 MCULE-1197721149 [0,0,0,1,0,0|2,1,0]=4 1762 B8R1.2 SCC1CCNCC1 MCULE-3947635428 [0,0,0,1,0,0|2,1,0]=4 1763 B8R1.2 SCC1CCNCC1 MCULE-4731929818 [0,0,0,1,0,0|2,1,0]=4 1764 B8R1.2 SCC1CCOCC1 MCULE-1191986847 [0,0,0,1,0,0|2,1,0]=4 1765 B8R1.3 BrC1CCC(NC1)Br MCULE-6328648168 [0,0,0,1,0,0|3,0,0]=4 1766 B8R1.3 C=C1CCC(CC1)C MCULE-8335929583 [0,0,0,1,0,0|2,0,1]=4 1767 B8R1.3 CC1=CCC(CC1)N MCULE-2698586518 [0,0,0,1,0,0|2,0,1]=4 1768 B8R1.3 CC1CCC(=O)CC1 MCULE-5534475096 [0,0,0,1,0,0|1,0,2]=4 1769 B8R1.3 CC1CCC(=O)CC1 MCULE-9038467737 [0,0,0,1,0,0|1,0,2]=4 1770 B8R1.3 CC1CCC(=O)CN1 MCULE-1285022466 [0,0,0,1,0,0|1,0,2]=4 1771 B8R1.3 CC1CCC(=O)CN1 MCULE-9314433387 [0,0,0,1,0,0|1,0,2]=4 1772 B8R1.3 CC1CCC(=O)CO1 MCULE-8334906567 [0,0,0,1,0,0|0,0,2]=3 1773 B8R1.3 CC1CCC(=O)CS1 MCULE-9188619559 [0,0,0,1,0,0|0,1,2]=4 1774 B8R1.3 CC1CCC(CC1)Br MCULE-9651780583 [0,0,0,1,0,0|2,0,0]=3 1775 B8R1.3 CC1CCC(CC1)C MCULE-8970080763 [0,0,0,1,0,0|2,0,0]=3 1776 B8R1.3 CC1CCC(CC1)N MCULE-1405299661 [0,0,0,1,0,0|2,0,0]=3 1777 B8R1.3 CC1CCC(CC1)N MCULE-2075843541 [0,0,0,1,0,0|2,0,0]=3 1778 B8R1.3 CC1CCC(CC1)O MCULE-7501628471 [0,0,0,1,0,0|1,0,0]=2 1779 B8R1.3 CC1CCC(CC1)S MCULE-6252839554 [0,0,0,1,0,0|1,1,0]=3 1780 B8R1.3 CC1CCC(CN1)O MCULE-1965969511 [0,0,0,1,0,0|1,0,0]=2 1781 B8R1.3 CC1CCC(CN1)O MCULE-8922826910 [0,0,0,1,0,0|1,0,0]=2 1782 B8R1.3 CC1CCC(CO1)O MCULE-8416383333 [0,0,0,1,0,0|0,0,0]=1 1783 B8R1.3 CC1CCC(NC1)C MCULE-5442214938 [0,0,0,1,0,0|2,0,0]=3 1784 B8R1.3 CC1CCN(CC1)C MCULE-6129657861 [0,0,0,1,0,0|3,0,0]=4 1785 B8R1.3 CC1CCN(CC1)N MCULE-3896858235 [0,0,0,1,0,0|3,0,0]=4 1786 B8R1.3 CC1CCN(CC1)N MCULE-5103609084 [0,0,0,1,0,0|3,0,0]=4 1787 B8R1.3 CC1CCN(CC1)N MCULE-5894508004 [0,0,0,1,0,0|3,0,0]=4 1788 B8R1.3 CC1CNC(=O)CO1 MCULE-6817757578 [0,0,0,1,0,0|1,0,2]=4 1789 B8R1.3 CC1CNC(CN1)C MCULE-7639138594 [0,0,0,1,0,0|3,0,0]=4 1790 B8R1.3 CC1CNC(CN1)C MCULE-9213153746 [0,0,0,1,0,0|3,0,0]=4 1791 B8R1.3 CC1COC(CN1)C MCULE-4975068364 [0,0,0,1,0,0|2,0,0]=3 1792 B8R1.3 CC1COC(CN1)C MCULE-6443209935 [0,0,0,1,0,0|2,0,0]=3 1793 B8R1.3 CN1CCC(CC1)Br MCULE-1146098660 [0,0,0,1,0,0|3,0,0]=4 1794 B8R1.3 CN1CCC(CC1)Br MCULE-1307546960 [0,0,0,1,0,0|3,0,0]=4 1795 B8R1.3 CN1CCC(CC1)Cl MCULE-6976794676 [0,0,0,1,0,0|3,0,0]=4 1796 B8R1.3 CN1CCC(CC1)F MCULE-6071710395 [0,0,0,1,0,0|3,0,0]=4 1797 B8R1.3 CN1CCC(CC1)I MCULE-8070069081 [0,0,0,1,0,0|3,0,0]=4 1798 B8R1.3 CN1CCC(CC1)N MCULE-2266692247 [0,0,0,1,0,0|3,0,0]=4 1799 B8R1.3 CN1CCC(CC1)N MCULE-2525636247 [0,0,0,1,0,0|3,0,0]=4 1800 B8R1.3 CN1CCC(CC1)N MCULE-3769368829 [0,0,0,1,0,0|3,0,0]=4 1801 B8R1.3 CN1CCC(CC1)O MCULE-1769465111 [0,0,0,1,0,0|2,0,0]=3 1802 B8R1.3 CN1CCC(CC1)O MCULE-8742465276 [0,0,0,1,0,0|2,0,0]=3 1803 B8R1.3 CN1CCC(CC1)S MCULE-2316487466 [0,0,0,1,0,0|2,1,0]=4 1804 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-4693797730 [0,0,0,1,0,0|1,0,2]=4 1805 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-5991774380 [0,0,0,1,0,0|1,0,2]=4 1806 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-6484213897 [0,0,0,1,0,0|1,0,2]=4 1807 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-7346191190 [0,0,0,1,0,0|1,0,2]=4 1808 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-1181513126 [0,0,0,1,0,0|1,0,0]=2 1809 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-1902739569 [0,0,0,1,0,0|1,0,0]=2 1810 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-4923873245 [0,0,0,1,0,0|1,0,0]=2 1811 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-5091971479 [0,0,0,1,0,0|1,0,0]=2 1812 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-7440788820 [0,0,0,1,0,0|1,0,0]=2 1813 B8R1.3 C[C@@H]1CC[C@@H](CN1)O MCULE-8869692501 [0,0,0,1,0,0|1,0,0]=2 1814 B8R1.3 C[C@@H]1CC[C@H](CN1)O MCULE-8099689887 [0,0,0,1,0,0|1,0,0]=2 1815 B8R1.3 C[C@@H]1CC[C@H](CN1)O MCULE-8746216012 [0,0,0,1,0,0|1,0,0]=2 1816 B8R1.3 C[C@@H]1CC[C@H](CN1)O MCULE-9870191339 [0,0,0,1,0,0|1,0,0]=2 1817 B8R1.3 C[C@@H]1CNC(=O)CO1 MCULE-7192421297 [0,0,0,1,0,0|1,0,2]=4 1818 B8R1.3 C[C@@H]1CNC(=O)CO1 MCULE-7394512903 [0,0,0,1,0,0|1,0,2]=4 1819 B8R1.3 C[C@@H]1CN[C@@H](CN1)C MCULE-8787520292 [0,0,0,1,0,0|3,0,0]=4 1820 B8R1.3 C[C@@H]1CN[C@@H](CN1)C MCULE-9140502018 [0,0,0,1,0,0|3,0,0]=4 1821 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-1103945502 [0,0,0,1,0,0|2,0,0]=3 1822 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-1391537108 [0,0,0,1,0,0|2,0,0]=3 1823 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-1946095385 [0,0,0,1,0,0|2,0,0]=3 1824 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-4549349129 [0,0,0,1,0,0|2,0,0]=3 1825 B8R1.3 C[C@H]1CCC(=O)CN1 MCULE-6334939841 [0,0,0,1,0,0|1,0,2]=4 1826 B8R1.3 C[C@H]1CCC(=O)CN1 MCULE-8476307649 [0,0,0,1,0,0|1,0,2]=4 1827 B8R1.3 C[C@H]1CC[C@@H](CC1)N MCULE-4582129313 [0,0,0,1,0,0|2,0,0]=3 1828 B8R1.3 C[C@H]1CC[C@@H](CC1)N MCULE-8719793702 [0,0,0,1,0,0|2,0,0]=3 1829 B8R1.3 C[C@H]1CC[C@@H](CC1)O MCULE-9131864343 [0,0,0,1,0,0|1,0,0]=2 1830 B8R1.3 C[C@H]1CC[C@@H](CN1)O MCULE-4342382470 [0,0,0,1,0,0|1,0,0]=2 1831 B8R1.3 C[C@H]1CC[C@@H](CN1)O MCULE-7588845174 [0,0,0,1,0,0|1,0,0]=2 1832 B8R1.3 C[C@H]1CC[C@H](CC1)C MCULE-5381492320 [0,0,0,1,0,0|2,0,0]=3 1833 B8R1.3 C[C@H]1CC[C@H](CC1)N MCULE-5470842973 [0,0,0,1,0,0|2,0,0]=3 1834 B8R1.3 C[C@H]1CC[C@H](CC1)N MCULE-9610267582 [0,0,0,1,0,0|2,0,0]=3 1835 B8R1.3 C[C@H]1CC[C@H](CC1)O MCULE-3495737054 [0,0,0,1,0,0|1,0,0]=2 1836 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-1161766631 [0,0,0,1,0,0|1,0,0]=2 1837 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-1646727489 [0,0,0,1,0,0|1,0,0]=2 1838 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-4706855730 [0,0,0,1,0,0|1,0,0]=2 1839 B8R1.3 C[C@H]1CC[C@H](CN1)O MCULE-6031163394 [0,0,0,1,0,0|1,0,0]=2 1840 B8R1.3 C[C@H]1CNC(=O)CO1 MCULE-6169535590 [0,0,0,1,0,0|1,0,2]=4 1841 B8R1.3 C[C@H]1CNC(=O)CO1 MCULE-8876635175 [0,0,0,1,0,0|1,0,2]=4 1842 B8R1.3 C[C@H]1CN[C@@H](CN1)C MCULE-1908384788 [0,0,0,1,0,0|3,0,0]=4 1843 B8R1.3 C[C@H]1CN[C@@H](CO1)C MCULE-4621250808 [0,0,0,1,0,0|2,0,0]=3 1844 B8R1.3 C[C@H]1CN[C@@H](CO1)C MCULE-7331563103 [0,0,0,1,0,0|2,0,0]=3 1845 B8R1.3 C[C@H]1CN[C@H](CN1)C MCULE-1173101457 [0,0,0,1,0,0|3,0,0]=4 1846 B8R1.3 C[C@H]1CN[C@H](CN1)C MCULE-2121261490 [0,0,0,1,0,0|3,0,0]=4 1847 B8R1.3 C[C@H]1CN[C@H](CN1)C MCULE-2499985362 [0,0,0,1,0,0|3,0,0]=4 1848 B8R1.3 C[C@H]1CN[C@H](CN1)C MCULE-5305716542 [0,0,0,1,0,0|3,0,0]=4 1849 B8R1.3 C[C@H]1CN[C@H](CN1)C MCULE-6011287763 [0,0,0,1,0,0|3,0,0]=4 1850 B8R1.3 C[C@H]1CO[C@@H](CN1)C MCULE-5045303209 [0,0,0,1,0,0|2,0,0]=3 1851 B8R1.3 C[C@H]1CO[C@@H](CN1)C MCULE-8352332219 [0,0,0,1,0,0|2,0,0]=3 1852 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-1410633938 [0,0,0,1,0,0|2,0,0]=3 1853 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-1498993915 [0,0,0,1,0,0|2,0,0]=3 1854 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-3545205619 [0,0,0,1,0,0|2,0,0]=3 1855 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-5064602423 [0,0,0,1,0,0|2,0,0]=3 1856 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-5773597642 [0,0,0,1,0,0|2,0,0]=3 1857 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-6073716335 [0,0,0,1,0,0|2,0,0]=3 1858 B8R1.3 ClC1CCC(CC1)Cl MCULE-4367918159 [0,0,0,1,0,0|3,0,0]=4 1859 B8R1.3 Cl[C@H]1CC[C@@H](CC1)Cl MCULE-8069533472 [0,0,0,1,0,0|3,0,0]=4 1860 B8R1.3 NC1CCC(CC1)Br MCULE-2984714817 [0,0,0,1,0,0|3,0,0]=4 1861 B8R1.3 NC1CCC(CC1)Br MCULE-7170151428 [0,0,0,1,0,0|3,0,0]=4 1862 B8R1.3 NC1CCC(CC1)Cl MCULE-8982345279 [0,0,0,1,0,0|3,0,0]=4 1863 B8R1.3 NC1CCC(CC1)Cl MCULE-9224760506 [0,0,0,1,0,0|3,0,0]=4 1864 B8R1.3 NC1CCC(CC1)F MCULE-1081012265 [0,0,0,1,0,0|3,0,0]=4 1865 B8R1.3 NC1CCC(CC1)F MCULE-4888084170 [0,0,0,1,0,0|3,0,0]=4 1866 B8R1.3 NC1CCC(CC1)I MCULE-1457514414 [0,0,0,1,0,0|3,0,0]=4 1867 B8R1.3 NC1CCC(CC1)I MCULE-8371155353 [0,0,0,1,0,0|3,0,0]=4 1868 B8R1.3 NC1CCC(CC1)N MCULE-1675686185 [0,0,0,1,0,0|3,0,0]=4 1869 B8R1.3 NC1CCC(CC1)N MCULE-9308852983 [0,0,0,1,0,0|3,0,0]=4 1870 B8R1.3 NC1CCC(CC1)O MCULE-8546049036 [0,0,0,1,0,0|2,0,0]=3 1871 B8R1.3 NC1CCC(CC1)O MCULE-9716076284 [0,0,0,1,0,0|2,0,0]=3 1872 B8R1.3 NN1CCC(CC1)O MCULE-8397021846 [0,0,0,1,0,0|3,0,0]=4 1873 B8R1.3 N[C@H]1CC[C@@H](CC1)F MCULE-6396367848 [0,0,0,1,0,0|3,0,0]=4 1874 B8R1.3 N[C@H]1CC[C@@H](CC1)F MCULE-6665686539 [0,0,0,1,0,0|3,0,0]=4 1875 B8R1.3 N[C@H]1CC[C@@H](CC1)N MCULE-5630099425 [0,0,0,1,0,0|3,0,0]=4 1876 B8R1.3 N[C@H]1CC[C@@H](CC1)N MCULE-7746015426 [0,0,0,1,0,0|3,0,0]=4 1877 B8R1.3 N[C@H]1CC[C@@H](CC1)O MCULE-5499393551 [0,0,0,1,0,0|2,0,0]=3 1878 B8R1.3 N[C@H]1CC[C@@H](CC1)O MCULE-8986905038 [0,0,0,1,0,0|2,0,0]=3 1879 B8R1.3 N[C@H]1CC[C@H](CC1)N MCULE-6319475446 [0,0,0,1,0,0|3,0,0]=4 1880 B8R1.3 N[C@H]1CC[C@H](CC1)N MCULE-6552936289 [0,0,0,1,0,0|3,0,0]=4 1881 B8R1.3 N[C@H]1CC[C@H](CC1)O MCULE-2039471973 [0,0,0,1,0,0|2,0,0]=3 1882 B8R1.3 N[C@H]1CC[C@H](CC1)O MCULE-9845054375 [0,0,0,1,0,0|2,0,0]=3 1883 B8R1.3 O=C1CCC(CC1)O MCULE-7247867750 [0,0,0,1,0,0|2,0,1]=4 1884 B8R1.3 O=C1CCC(CN1)O MCULE-4501886280 [0,0,0,1,0,0|2,0,1]=4 1885 B8R1.3 O=C1CCC(CO1)O MCULE-6372408261 [0,0,0,1,0,0|1,0,1]=3 1886 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-3426407148 [0,0,0,1,0,0|2,0,1]=4 1887 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-9592320749 [0,0,0,1,0,0|2,0,1]=4 1888 B8R1.3 O=C1CC[C@H](CN1)O MCULE-1500705916 [0,0,0,1,0,0|2,0,1]=4 1889 B8R1.3 O=C1CC[C@H](CN1)O MCULE-9578240246 [0,0,0,1,0,0|2,0,1]=4 1890 B8R1.3 O=S1CCC(CC1)O MCULE-7693506009 [0,0,0,1,0,0|3,0,0]=4 1891 B8R1.3 OC1CCC(CC1)Br MCULE-8198901639 [0,0,0,1,0,0|2,0,0]=3 1892 B8R1.3 OC1CCC(CC1)Cl MCULE-2412299435 [0,0,0,1,0,0|2,0,0]=3 1893 B8R1.3 OC1CCC(CC1)F MCULE-6919245281 [0,0,0,1,0,0|2,0,0]=3 1894 B8R1.3 OC1CCC(CC1)O MCULE-1213045312 [0,0,0,1,0,0|2,0,0]=3 1895 B8R1.3 OC1COC(CO1)O MCULE-6794444946 [0,0,0,1,0,0|2,0,0]=3 1896 B8R1.3 OC1CSC(CS1)O MCULE-1661511057 [0,0,0,1,0,0|2,1,0]=4 1897 B8R1.3 O[C@@H]1C=C[C@H](CC1)O MCULE-6358884039 [0,0,0,1,0,0|2,0,1]=4 1898 B8R1.3 O[C@H]1C=C[C@@H](CC1)O MCULE-2727087872 [0,0,0,1,0,0|2,0,1]=4 1899 B8R1.3 O[C@H]1C=C[C@@H](CC1)O MCULE-9017888653 [0,0,0,1,0,0|2,0,1]=4 1900 B8R1.3 O[C@H]1CC[C@@H](CC1)O MCULE-5169653700 [0,0,0,1,0,0|2,0,0]=3 1901 B8R1.3 O[C@H]1CC[C@H](CC1)O MCULE-1269237683 [0,0,0,1,0,0|2,0,0]=3 1902 B8R1.3 [C@@H]1(CC[C@@H](CC1)C)C MCULE-9917903475 [0,0,0,1,0,0|2,0,0]=3 1903 B8R1.3 [C@@H]1(CC[C@H](CC1)F)N MCULE-1471220632 [0,0,0,1,0,0|3,0,0]=4 1904 B8R1.3 [C@@H]1(CC[C@H](CC1)F)N MCULE-2396143611 [0,0,0,1,0,0|3,0,0]=4 1905 B8R1.3 [C@@H]1(CN[C@@H](CO1)C)C MCULE-3712952908 [0,0,0,1,0,0|2,0,0]=3 1906 B8R1.3 [C@@H]1(CN[C@H](CN1)C)C MCULE-7018259993 [0,0,0,1,0,0|3,0,0]=4 1907 B8R1.3 [C@@H]1(CN[C@H](CN1)C)C MCULE-9216505663 [0,0,0,1,0,0|3,0,0]=4 1908 B8R1.3 [NH+]1(CCC(CC1)Cl)C MCULE-9642904586 [0,0,0,1,0,0|3,0,0]=4 1909 B8R1.5 BrC1CCCCC1Br MCULE-1701720026 [0,0,0,1,0,0|2,0,0]=3 1910 B8R1.5 BrC1CCCOC1Br MCULE-5122148511 [0,0,0,1,0,0|3,0,0]=4 1911 B8R1.5 Br[C@@H]1CCCC[C@H]1Br MCULE-3924798087 [0,0,0,1,0,0|2,0,0]=3 1912 B8R1.5 Br[C@@H]1CCCC[C@H]1Br MCULE-5649353367 [0,0,0,1,0,0|2,0,0]=3 1913 B8R1.5 Br[C@H]1CCCC[C@@H]1Br MCULE-1538086495 [0,0,0,1,0,0|2,0,0]=3 1914 B8R1.5 Br[C@H]1CCCC[C@@H]1Br MCULE-2632706043 [0,0,0,1,0,0|2,0,0]=3 1915 B8R1.5 C=C1CCCCC1O MCULE-3853228524 [0,0,0,1,0,0|1,0,1]=3 1916 B8R1.5 C=C1CCCCC1O MCULE-5911864977 [0,0,0,1,0,0|1,0,1]=3 1917 B8R1.5 CC1CCCCC1=O MCULE-6363555535 [0,0,0,1,0,0|1,0,2]=4 1918 B8R1.5 CC1CCCCC1C MCULE-9841432259 [0,0,0,1,0,0|2,0,0]=3 1919 B8R1.5 CC1CCCCC1N MCULE-3041016580 [0,0,0,1,0,0|2,0,0]=3 1920 B8R1.5 CC1CCCCC1N MCULE-4294403075 [0,0,0,1,0,0|2,0,0]=3 1921 B8R1.5 CC1CCCCC1O MCULE-2704647488 [0,0,0,1,0,0|1,0,0]=2 1922 B8R1.5 CC1CCCCN1C MCULE-8197728941 [0,0,0,1,0,0|3,0,0]=4 1923 B8R1.5 CC1CCCCN1N MCULE-8724967874 [0,0,0,1,0,0|3,0,0]=4 1924 B8R1.5 CC1CCCNC1C MCULE-4611965577 [0,0,0,1,0,0|3,0,0]=4 1925 B8R1.5 CC1CCCNC1C MCULE-5766379292 [0,0,0,1,0,0|3,0,0]=4 1926 B8R1.5 CC1CCCNC1C MCULE-6191112458 [0,0,0,1,0,0|3,0,0]=4 1927 B8R1.5 CC1CCNCC1C MCULE-5683848513 [0,0,0,1,0,0|3,0,0]=4 1928 B8R1.5 CC1CCNCC1F MCULE-2423279658 [0,0,0,1,0,0|3,0,0]=4 1929 B8R1.5 CC1CCNCC1F MCULE-3345403654 [0,0,0,1,0,0|3,0,0]=4 1930 B8R1.5 CC1CCNCC1O MCULE-5450375148 [0,0,0,1,0,0|2,0,0]=3 1931 B8R1.5 CC1CCNCC1O MCULE-5649027214 [0,0,0,1,0,0|2,0,0]=3 1932 B8R1.5 CC1CNCCC1N MCULE-4288510851 [0,0,0,1,0,0|3,0,0]=4 1933 B8R1.5 CC1CNCCC1N MCULE-7264043917 [0,0,0,1,0,0|3,0,0]=4 1934 B8R1.5 CC1CNCCC1O MCULE-1960718296 [0,0,0,1,0,0|2,0,0]=3 1935 B8R1.5 CC1CNCCC1O MCULE-8434519185 [0,0,0,1,0,0|2,0,0]=3 1936 B8R1.5 CC1COCCC1N MCULE-6236890728 [0,0,0,1,0,0|3,0,0]=4 1937 B8R1.5 CC1COCCC1N MCULE-7497946239 [0,0,0,1,0,0|3,0,0]=4 1938 B8R1.5 CC1COCCC1O MCULE-9430778912 [0,0,0,1,0,0|2,0,0]=3 1939 B8R1.5 CC1NCCCC1O MCULE-4670774259 [0,0,0,1,0,0|2,0,0]=3 1940 B8R1.5 CC1NCCCC1O MCULE-7229970366 [0,0,0,1,0,0|2,0,0]=3 1941 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-2207912311 [0,0,0,1,0,0|2,0,0]=3 1942 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-3227199256 [0,0,0,1,0,0|2,0,0]=3 1943 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-4948677049 [0,0,0,1,0,0|2,0,0]=3 1944 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-6377741621 [0,0,0,1,0,0|2,0,0]=3 1945 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-8426223529 [0,0,0,1,0,0|2,0,0]=3 1946 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-9542068395 [0,0,0,1,0,0|2,0,0]=3 1947 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-3547716632 [0,0,0,1,0,0|1,0,0]=2 1948 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-9259793572 [0,0,0,1,0,0|1,0,0]=2 1949 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-2021817746 [0,0,0,1,0,0|2,0,0]=3 1950 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-3944837592 [0,0,0,1,0,0|2,0,0]=3 1951 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-1550031816 [0,0,0,1,0,0|3,0,0]=4 1952 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-6650080658 [0,0,0,1,0,0|3,0,0]=4 1953 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-6715745499 [0,0,0,1,0,0|3,0,0]=4 1954 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-7283977917 [0,0,0,1,0,0|3,0,0]=4 1955 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-6946702609 [0,0,0,1,0,0|2,0,0]=3 1956 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-7899767253 [0,0,0,1,0,0|2,0,0]=3 1957 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-9159305922 [0,0,0,1,0,0|2,0,0]=3 1958 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-9391376462 [0,0,0,1,0,0|2,0,0]=3 1959 B8R1.5 C[C@@H]1CCNC[C@H]1F MCULE-1681100584 [0,0,0,1,0,0|3,0,0]=4 1960 B8R1.5 C[C@@H]1CCNC[C@H]1F MCULE-2733502904 [0,0,0,1,0,0|3,0,0]=4 1961 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-4706073937 [0,0,0,1,0,0|2,0,0]=3 1962 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-5188621987 [0,0,0,1,0,0|2,0,0]=3 1963 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-6031430878 [0,0,0,1,0,0|2,0,0]=3 1964 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-8311134495 [0,0,0,1,0,0|2,0,0]=3 1965 B8R1.5 C[C@@H]1CNCC[C@@H]1N MCULE-1733727000 [0,0,0,1,0,0|3,0,0]=4 1966 B8R1.5 C[C@@H]1CNCC[C@@H]1N MCULE-5971884774 [0,0,0,1,0,0|3,0,0]=4 1967 B8R1.5 C[C@@H]1CNCC[C@H]1N MCULE-4381780061 [0,0,0,1,0,0|3,0,0]=4 1968 B8R1.5 C[C@@H]1CNCC[C@H]1N MCULE-7332887720 [0,0,0,1,0,0|3,0,0]=4 1969 B8R1.5 C[C@@H]1CNCC[C@H]1O MCULE-1211656855 [0,0,0,1,0,0|2,0,0]=3 1970 B8R1.5 C[C@@H]1CNCC[C@H]1O MCULE-8887033073 [0,0,0,1,0,0|2,0,0]=3 1971 B8R1.5 C[C@@H]1COCC[C@@H]1N MCULE-1854737385 [0,0,0,1,0,0|3,0,0]=4 1972 B8R1.5 C[C@@H]1COCC[C@@H]1N MCULE-5272955365 [0,0,0,1,0,0|3,0,0]=4 1973 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-1385721208 [0,0,0,1,0,0|3,0,0]=4 1974 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-1584947952 [0,0,0,1,0,0|3,0,0]=4 1975 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-3448920251 [0,0,0,1,0,0|3,0,0]=4 1976 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-7256484712 [0,0,0,1,0,0|3,0,0]=4 1977 B8R1.5 C[C@@H]1NCCC[C@H]1O MCULE-4565116334 [0,0,0,1,0,0|2,0,0]=3 1978 B8R1.5 C[C@H]1CCCC[C@@H]1C MCULE-3536263334 [0,0,0,1,0,0|2,0,0]=3 1979 B8R1.5 C[C@H]1CCCC[C@@H]1C MCULE-5867798019 [0,0,0,1,0,0|2,0,0]=3 1980 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-3841584035 [0,0,0,1,0,0|2,0,0]=3 1981 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-4158219749 [0,0,0,1,0,0|2,0,0]=3 1982 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-8973971252 [0,0,0,1,0,0|2,0,0]=3 1983 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-9885453921 [0,0,0,1,0,0|2,0,0]=3 1984 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-4879328575 [0,0,0,1,0,0|1,0,0]=2 1985 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-7331434797 [0,0,0,1,0,0|1,0,0]=2 1986 B8R1.5 C[C@H]1CCCC[C@H]1C MCULE-9131794520 [0,0,0,1,0,0|2,0,0]=3 1987 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-1533998857 [0,0,0,1,0,0|2,0,0]=3 1988 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5254242664 [0,0,0,1,0,0|2,0,0]=3 1989 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5432486645 [0,0,0,1,0,0|2,0,0]=3 1990 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-7149509445 [0,0,0,1,0,0|2,0,0]=3 1991 B8R1.5 C[C@H]1CCNC[C@@H]1F MCULE-4761102749 [0,0,0,1,0,0|3,0,0]=4 1992 B8R1.5 C[C@H]1CCNC[C@@H]1F MCULE-8933374788 [0,0,0,1,0,0|3,0,0]=4 1993 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-2413866964 [0,0,0,1,0,0|2,0,0]=3 1994 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-3541397142 [0,0,0,1,0,0|2,0,0]=3 1995 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-4524645861 [0,0,0,1,0,0|2,0,0]=3 1996 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-4989324272 [0,0,0,1,0,0|2,0,0]=3 1997 B8R1.5 C[C@H]1CCNC[C@H]1F MCULE-4253107784 [0,0,0,1,0,0|3,0,0]=4 1998 B8R1.5 C[C@H]1CCNC[C@H]1F MCULE-5700696523 [0,0,0,1,0,0|3,0,0]=4 1999 B8R1.5 C[C@H]1CCNC[C@H]1O MCULE-6149485279 [0,0,0,1,0,0|2,0,0]=3 2000 B8R1.5 C[C@H]1CCNC[C@H]1O MCULE-9609136161 [0,0,0,1,0,0|2,0,0]=3 2001 B8R1.5 C[C@H]1CNCC[C@@H]1N MCULE-1222815331 [0,0,0,1,0,0|3,0,0]=4 2002 B8R1.5 C[C@H]1CNCC[C@@H]1N MCULE-1657518091 [0,0,0,1,0,0|3,0,0]=4 2003 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-1418189839 [0,0,0,1,0,0|2,0,0]=3 2004 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-2162007646 [0,0,0,1,0,0|2,0,0]=3 2005 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-4884869364 [0,0,0,1,0,0|2,0,0]=3 2006 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-9707177849 [0,0,0,1,0,0|2,0,0]=3 2007 B8R1.5 C[C@H]1CNCC[C@H]1N MCULE-2604448103 [0,0,0,1,0,0|3,0,0]=4 2008 B8R1.5 C[C@H]1CNCC[C@H]1N MCULE-4549710847 [0,0,0,1,0,0|3,0,0]=4 2009 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-1909814972 [0,0,0,1,0,0|2,0,0]=3 2010 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-8202226496 [0,0,0,1,0,0|2,0,0]=3 2011 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-9674887824 [0,0,0,1,0,0|2,0,0]=3 2012 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-9888495251 [0,0,0,1,0,0|2,0,0]=3 2013 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-3420685614 [0,0,0,1,0,0|3,0,0]=4 2014 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-4495690357 [0,0,0,1,0,0|3,0,0]=4 2015 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-9724547988 [0,0,0,1,0,0|3,0,0]=4 2016 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-9889716251 [0,0,0,1,0,0|3,0,0]=4 2017 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-3075216082 [0,0,0,1,0,0|3,0,0]=4 2018 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-4276602047 [0,0,0,1,0,0|3,0,0]=4 2019 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-6090606114 [0,0,0,1,0,0|3,0,0]=4 2020 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-6610603811 [0,0,0,1,0,0|3,0,0]=4 2021 B8R1.5 C[C@H]1NCCC[C@@H]1O MCULE-4581708846 [0,0,0,1,0,0|2,0,0]=3 2022 B8R1.5 ClC1CCCCC1Cl MCULE-4249390413 [0,0,0,1,0,0|2,0,0]=3 2023 B8R1.5 Cl[C@@H]1CCCC[C@H]1Cl MCULE-7886724296 [0,0,0,1,0,0|2,0,0]=3 2024 B8R1.5 Cl[C@H]1CCCC[C@@H]1Br MCULE-5215368864 [0,0,0,1,0,0|2,0,0]=3 2025 B8R1.5 Cl[C@H]1CCCC[C@@H]1Cl MCULE-4820169474 [0,0,0,1,0,0|2,0,0]=3 2026 B8R1.5 Cl[C@H]1CCCC[C@@H]1Cl MCULE-7788819843 [0,0,0,1,0,0|2,0,0]=3 2027 B8R1.5 Cl[C@H]1CCCC[C@H]1Cl MCULE-8380485042 [0,0,0,1,0,0|2,0,0]=3 2028 B8R1.5 FC1CCCCC1Br MCULE-5989278401 [0,0,0,1,0,0|2,0,0]=3 2029 B8R1.5 FC1CCNCC1F MCULE-6536309243 [0,0,0,1,0,0|3,0,0]=4 2030 B8R1.5 FC1CCNCC1F MCULE-7145018916 [0,0,0,1,0,0|3,0,0]=4 2031 B8R1.5 F[C@@H]1CCNC[C@H]1F MCULE-6799503527 [0,0,0,1,0,0|3,0,0]=4 2032 B8R1.5 F[C@@H]1CCNC[C@H]1F MCULE-9656045295 [0,0,0,1,0,0|3,0,0]=4 2033 B8R1.5 F[C@H]1CCNC[C@H]1F MCULE-3083739703 [0,0,0,1,0,0|3,0,0]=4 2034 B8R1.5 F[C@H]1CCNC[C@H]1F MCULE-5631085665 [0,0,0,1,0,0|3,0,0]=4 2035 B8R1.5 F[C@H]1CNCC[C@H]1F MCULE-6688369638 [0,0,0,1,0,0|3,0,0]=4 2036 B8R1.5 F[C@H]1CNCC[C@H]1F MCULE-7021410764 [0,0,0,1,0,0|3,0,0]=4 2037 B8R1.5 NC1CCCCC1=O MCULE-2382898926 [0,0,0,1,0,0|1,0,2]=4 2038 B8R1.5 NC1CCCCC1=O MCULE-9230455128 [0,0,0,1,0,0|1,0,2]=4 2039 B8R1.5 NC1CCCCC1Cl MCULE-3676302646 [0,0,0,1,0,0|2,0,0]=3 2040 B8R1.5 NC1CCCCC1Cl MCULE-7920658638 [0,0,0,1,0,0|2,0,0]=3 2041 B8R1.5 NC1CCCCC1F MCULE-6643891539 [0,0,0,1,0,0|2,0,0]=3 2042 B8R1.5 NC1CCCCC1F MCULE-7855236144 [0,0,0,1,0,0|2,0,0]=3 2043 B8R1.5 NC1CCCCC1N MCULE-1677916175 [0,0,0,1,0,0|2,0,0]=3 2044 B8R1.5 NC1CCCCC1N MCULE-9568644004 [0,0,0,1,0,0|2,0,0]=3 2045 B8R1.5 NC1CCCCC1O MCULE-1427424523 [0,0,0,1,0,0|1,0,0]=2 2046 B8R1.5 NC1CCCCC1O MCULE-2793336591 [0,0,0,1,0,0|1,0,0]=2 2047 B8R1.5 NC1CCNCC1O MCULE-2705091841 [0,0,0,1,0,0|2,0,0]=3 2048 B8R1.5 NC1CCOCC1F MCULE-1016932578 [0,0,0,1,0,0|3,0,0]=4 2049 B8R1.5 NC1CCOCC1F MCULE-9622790392 [0,0,0,1,0,0|3,0,0]=4 2050 B8R1.5 NC1CCOCC1O MCULE-2815184899 [0,0,0,1,0,0|2,0,0]=3 2051 B8R1.5 NC1CCOCC1O MCULE-4548392204 [0,0,0,1,0,0|2,0,0]=3 2052 B8R1.5 NC1COCCC1F MCULE-1455837903 [0,0,0,1,0,0|3,0,0]=4 2053 B8R1.5 NC1COCCC1F MCULE-7145252320 [0,0,0,1,0,0|3,0,0]=4 2054 B8R1.5 NC1COCCC1O MCULE-6374385354 [0,0,0,1,0,0|2,0,0]=3 2055 B8R1.5 NC1COCCC1O MCULE-7944406292 [0,0,0,1,0,0|2,0,0]=3 2056 B8R1.5 N[C@@H]1CCCC[C@@H]1F MCULE-1657692826 [0,0,0,1,0,0|2,0,0]=3 2057 B8R1.5 N[C@@H]1CCCC[C@@H]1F MCULE-3328673946 [0,0,0,1,0,0|2,0,0]=3 2058 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2753918610 [0,0,0,1,0,0|1,0,0]=2 2059 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2761271370 [0,0,0,1,0,0|1,0,0]=2 2060 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-4978213189 [0,0,0,1,0,0|1,0,0]=2 2061 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-9182719952 [0,0,0,1,0,0|1,0,0]=2 2062 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-3474870548 [0,0,0,1,0,0|2,0,0]=3 2063 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-3984172565 [0,0,0,1,0,0|2,0,0]=3 2064 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-4705427644 [0,0,0,1,0,0|2,0,0]=3 2065 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-7025237099 [0,0,0,1,0,0|2,0,0]=3 2066 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-1186999216 [0,0,0,1,0,0|2,0,0]=3 2067 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-2134025562 [0,0,0,1,0,0|2,0,0]=3 2068 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6149251599 [0,0,0,1,0,0|2,0,0]=3 2069 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6588424966 [0,0,0,1,0,0|2,0,0]=3 2070 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-1509174959 [0,0,0,1,0,0|1,0,0]=2 2071 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-2336529349 [0,0,0,1,0,0|1,0,0]=2 2072 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-4732604931 [0,0,0,1,0,0|1,0,0]=2 2073 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-6124510830 [0,0,0,1,0,0|1,0,0]=2 2074 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-7301593250 [0,0,0,1,0,0|1,0,0]=2 2075 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-8501577810 [0,0,0,1,0,0|1,0,0]=2 2076 B8R1.5 N[C@@H]1CCNC[C@H]1O MCULE-1435526553 [0,0,0,1,0,0|2,0,0]=3 2077 B8R1.5 N[C@@H]1CCNC[C@H]1O MCULE-8731873892 [0,0,0,1,0,0|2,0,0]=3 2078 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-1239747130 [0,0,0,1,0,0|3,0,0]=4 2079 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-2720196545 [0,0,0,1,0,0|3,0,0]=4 2080 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-4681308404 [0,0,0,1,0,0|3,0,0]=4 2081 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-5510784592 [0,0,0,1,0,0|3,0,0]=4 2082 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-6118396691 [0,0,0,1,0,0|3,0,0]=4 2083 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-9001277868 [0,0,0,1,0,0|3,0,0]=4 2084 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-1888816293 [0,0,0,1,0,0|2,0,0]=3 2085 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-3667258867 [0,0,0,1,0,0|2,0,0]=3 2086 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-3915823883 [0,0,0,1,0,0|2,0,0]=3 2087 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-9959521476 [0,0,0,1,0,0|2,0,0]=3 2088 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-3556707940 [0,0,0,1,0,0|3,0,0]=4 2089 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-4525092522 [0,0,0,1,0,0|3,0,0]=4 2090 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-7086756183 [0,0,0,1,0,0|3,0,0]=4 2091 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-8506007792 [0,0,0,1,0,0|3,0,0]=4 2092 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-1071839837 [0,0,0,1,0,0|2,0,0]=3 2093 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-6051401821 [0,0,0,1,0,0|2,0,0]=3 2094 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-7013720281 [0,0,0,1,0,0|2,0,0]=3 2095 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-8477518337 [0,0,0,1,0,0|2,0,0]=3 2096 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-1031623201 [0,0,0,1,0,0|2,0,0]=3 2097 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-2846030882 [0,0,0,1,0,0|2,0,0]=3 2098 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-8863364874 [0,0,0,1,0,0|2,0,0]=3 2099 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-9836639365 [0,0,0,1,0,0|2,0,0]=3 2100 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-2318671918 [0,0,0,1,0,0|3,0,0]=4 2101 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-3695420668 [0,0,0,1,0,0|3,0,0]=4 2102 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-6955873978 [0,0,0,1,0,0|3,0,0]=4 2103 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-8343413560 [0,0,0,1,0,0|3,0,0]=4 2104 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-4436769496 [0,0,0,1,0,0|2,0,0]=3 2105 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-6163244980 [0,0,0,1,0,0|2,0,0]=3 2106 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-8697534407 [0,0,0,1,0,0|2,0,0]=3 2107 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-9625047427 [0,0,0,1,0,0|2,0,0]=3 2108 B8R1.5 N[C@H]1CCCC[C@@H]1F MCULE-2983212378 [0,0,0,1,0,0|2,0,0]=3 2109 B8R1.5 N[C@H]1CCCC[C@@H]1F MCULE-6196710696 [0,0,0,1,0,0|2,0,0]=3 2110 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-3653211978 [0,0,0,1,0,0|2,0,0]=3 2111 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-5059719804 [0,0,0,1,0,0|2,0,0]=3 2112 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1277967673 [0,0,0,1,0,0|1,0,0]=2 2113 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1301750612 [0,0,0,1,0,0|1,0,0]=2 2114 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-3861922722 [0,0,0,1,0,0|1,0,0]=2 2115 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-8489439004 [0,0,0,1,0,0|1,0,0]=2 2116 B8R1.5 N[C@H]1CCCC[C@H]1F MCULE-7579368841 [0,0,0,1,0,0|2,0,0]=3 2117 B8R1.5 N[C@H]1CCCC[C@H]1F MCULE-8479221038 [0,0,0,1,0,0|2,0,0]=3 2118 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-2011367325 [0,0,0,1,0,0|2,0,0]=3 2119 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-7126233212 [0,0,0,1,0,0|2,0,0]=3 2120 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-1599409645 [0,0,0,1,0,0|1,0,0]=2 2121 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-3318800690 [0,0,0,1,0,0|1,0,0]=2 2122 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-4235445104 [0,0,0,1,0,0|1,0,0]=2 2123 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6518289705 [0,0,0,1,0,0|1,0,0]=2 2124 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6606691116 [0,0,0,1,0,0|1,0,0]=2 2125 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-9979333085 [0,0,0,1,0,0|1,0,0]=2 2126 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-1493875164 [0,0,0,1,0,0|3,0,0]=4 2127 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-2102376472 [0,0,0,1,0,0|3,0,0]=4 2128 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-6109633704 [0,0,0,1,0,0|3,0,0]=4 2129 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-7337274868 [0,0,0,1,0,0|3,0,0]=4 2130 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-9740357152 [0,0,0,1,0,0|3,0,0]=4 2131 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-9831607120 [0,0,0,1,0,0|3,0,0]=4 2132 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-1217623714 [0,0,0,1,0,0|2,0,0]=3 2133 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-4607259008 [0,0,0,1,0,0|2,0,0]=3 2134 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-4749541215 [0,0,0,1,0,0|2,0,0]=3 2135 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-9683658087 [0,0,0,1,0,0|2,0,0]=3 2136 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-1550590585 [0,0,0,1,0,0|3,0,0]=4 2137 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-4067592428 [0,0,0,1,0,0|3,0,0]=4 2138 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-4649837852 [0,0,0,1,0,0|3,0,0]=4 2139 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-6334068028 [0,0,0,1,0,0|3,0,0]=4 2140 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-1807586879 [0,0,0,1,0,0|2,0,0]=3 2141 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-1937023434 [0,0,0,1,0,0|2,0,0]=3 2142 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-4374635229 [0,0,0,1,0,0|2,0,0]=3 2143 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-4873019238 [0,0,0,1,0,0|2,0,0]=3 2144 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-1937054893 [0,0,0,1,0,0|2,0,0]=3 2145 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-4877924283 [0,0,0,1,0,0|2,0,0]=3 2146 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-6674323819 [0,0,0,1,0,0|2,0,0]=3 2147 B8R1.5 N[C@H]1COCC[C@H]1O MCULE-7305089306 [0,0,0,1,0,0|2,0,0]=3 2148 B8R1.5 N[C@H]1COCC[C@H]1O MCULE-8372108333 [0,0,0,1,0,0|2,0,0]=3 2149 B8R1.5 O=C1CCCCC1Br MCULE-9356057483 [0,0,0,1,0,0|1,0,2]=4 2150 B8R1.5 O=C1CCCCC1Cl MCULE-1580566298 [0,0,0,1,0,0|1,0,2]=4 2151 B8R1.5 O=C1CCCCC1F MCULE-6406930837 [0,0,0,1,0,0|1,0,2]=4 2152 B8R1.5 O=C1CCCCC1O MCULE-7509366699 [0,0,0,1,0,0|0,0,2]=3 2153 B8R1.5 O=C1CCOCC1O MCULE-7032874317 [0,0,0,1,0,0|1,0,2]=4 2154 B8R1.5 O=C1NCCCC1O MCULE-4922755542 [0,0,0,1,0,0|1,0,2]=4 2155 B8R1.5 O=C1NCCC[C@@H]1O MCULE-2813817931 [0,0,0,1,0,0|1,0,2]=4 2156 B8R1.5 O=C1NCCC[C@@H]1O MCULE-3354550946 [0,0,0,1,0,0|1,0,2]=4 2157 B8R1.5 O=C1NCCC[C@H]1O MCULE-2892218765 [0,0,0,1,0,0|1,0,2]=4 2158 B8R1.5 O=C1NCCC[C@H]1O MCULE-8394704933 [0,0,0,1,0,0|1,0,2]=4 2159 B8R1.5 O=C1OCCCC1O MCULE-3021418071 [0,0,0,1,0,0|1,0,2]=4 2160 B8R1.5 OC1CCCC=C1Br MCULE-1040444564 [0,0,0,1,0,0|1,0,2]=4 2161 B8R1.5 OC1CCCCC1Cl MCULE-8650942069 [0,0,0,1,0,0|1,0,0]=2 2162 B8R1.5 OC1CCCCC1F MCULE-7634543650 [0,0,0,1,0,0|1,0,0]=2 2163 B8R1.5 OC1CCCCC1O MCULE-2967360901 [0,0,0,1,0,0|0,0,0]=1 2164 B8R1.5 OC1CCNCC1F MCULE-3466397366 [0,0,0,1,0,0|2,0,0]=3 2165 B8R1.5 OC1CCNCC1F MCULE-8065194779 [0,0,0,1,0,0|2,0,0]=3 2166 B8R1.5 OC1CCNCC1O MCULE-3039573850 [0,0,0,1,0,0|1,0,0]=2 2167 B8R1.5 OC1CCNCC1O MCULE-8828122539 [0,0,0,1,0,0|1,0,0]=2 2168 B8R1.5 OC1CCOCC1F MCULE-6531880501 [0,0,0,1,0,0|2,0,0]=3 2169 B8R1.5 OC1CNCCC1F MCULE-2946280821 [0,0,0,1,0,0|2,0,0]=3 2170 B8R1.5 OC1CNCCC1F MCULE-3493148821 [0,0,0,1,0,0|2,0,0]=3 2171 B8R1.5 OC1CSSCC1O MCULE-3716589710 [0,0,0,1,0,0|2,0,0]=3 2172 B8R1.5 OC1OCCOC1O MCULE-9891879099 [0,0,0,1,0,0|2,0,0]=3 2173 B8R1.5 O[C@@H]1CCCC=C1Br MCULE-9847748740 [0,0,0,1,0,0|1,0,2]=4 2174 B8R1.5 O[C@@H]1CCCC[C@H]1F MCULE-2305949625 [0,0,0,1,0,0|1,0,0]=2 2175 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3067807104 [0,0,0,1,0,0|0,0,0]=1 2176 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3429096841 [0,0,0,1,0,0|0,0,0]=1 2177 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-9892753066 [0,0,0,1,0,0|0,0,0]=1 2178 B8R1.5 O[C@@H]1CCCC[C@H]1S MCULE-6222162383 [0,0,0,1,0,0|0,1,0]=2 2179 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-3951980250 [0,0,0,1,0,0|2,0,0]=3 2180 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-4022160407 [0,0,0,1,0,0|2,0,0]=3 2181 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-7163743424 [0,0,0,1,0,0|2,0,0]=3 2182 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-9380154478 [0,0,0,1,0,0|2,0,0]=3 2183 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-2399390264 [0,0,0,1,0,0|2,0,0]=3 2184 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-6405573375 [0,0,0,1,0,0|2,0,0]=3 2185 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-7590255724 [0,0,0,1,0,0|2,0,0]=3 2186 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-8845231230 [0,0,0,1,0,0|2,0,0]=3 2187 B8R1.5 O[C@@H]1CCNC[C@H]1O MCULE-3688872623 [0,0,0,1,0,0|1,0,0]=2 2188 B8R1.5 O[C@@H]1CCNC[C@H]1O MCULE-5098984807 [0,0,0,1,0,0|1,0,0]=2 2189 B8R1.5 O[C@@H]1CCOC[C@@H]1F MCULE-1035298575 [0,0,0,1,0,0|2,0,0]=3 2190 B8R1.5 O[C@@H]1CCOC[C@@H]1F MCULE-7549327189 [0,0,0,1,0,0|2,0,0]=3 2191 B8R1.5 O[C@@H]1CCOC[C@H]1F MCULE-5919881662 [0,0,0,1,0,0|2,0,0]=3 2192 B8R1.5 O[C@@H]1CNCC[C@@H]1F MCULE-1622561753 [0,0,0,1,0,0|2,0,0]=3 2193 B8R1.5 O[C@@H]1CNCC[C@@H]1F MCULE-6945313787 [0,0,0,1,0,0|2,0,0]=3 2194 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-3612777118 [0,0,0,1,0,0|2,0,0]=3 2195 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-5621905223 [0,0,0,1,0,0|2,0,0]=3 2196 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-6188298332 [0,0,0,1,0,0|2,0,0]=3 2197 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-7586426338 [0,0,0,1,0,0|2,0,0]=3 2198 B8R1.5 O[C@@H]1CSSC[C@H]1O MCULE-2981026113 [0,0,0,1,0,0|2,0,0]=3 2199 B8R1.5 O[C@H]1CCCC[C@@H]1F MCULE-7833708338 [0,0,0,1,0,0|1,0,0]=2 2200 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-7078207162 [0,0,0,1,0,0|0,0,0]=1 2201 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-9836847707 [0,0,0,1,0,0|0,0,0]=1 2202 B8R1.5 O[C@H]1CCCC[C@H]1Br MCULE-8133807743 [0,0,0,1,0,0|1,0,0]=2 2203 B8R1.5 O[C@H]1CCCC[C@H]1O MCULE-3539097516 [0,0,0,1,0,0|0,0,0]=1 2204 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-1808200479 [0,0,0,1,0,0|2,0,0]=3 2205 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-5879546904 [0,0,0,1,0,0|2,0,0]=3 2206 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-7720582046 [0,0,0,1,0,0|2,0,0]=3 2207 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-9733376385 [0,0,0,1,0,0|2,0,0]=3 2208 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-1740802653 [0,0,0,1,0,0|1,0,0]=2 2209 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-5396588753 [0,0,0,1,0,0|1,0,0]=2 2210 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-6762598540 [0,0,0,1,0,0|1,0,0]=2 2211 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-9747818285 [0,0,0,1,0,0|1,0,0]=2 2212 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-2742864171 [0,0,0,1,0,0|2,0,0]=3 2213 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-4720397627 [0,0,0,1,0,0|2,0,0]=3 2214 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-7747536704 [0,0,0,1,0,0|2,0,0]=3 2215 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-9341492038 [0,0,0,1,0,0|2,0,0]=3 2216 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-2865586489 [0,0,0,1,0,0|1,0,0]=2 2217 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-6097537639 [0,0,0,1,0,0|1,0,0]=2 2218 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-8152004203 [0,0,0,1,0,0|1,0,0]=2 2219 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-8500578666 [0,0,0,1,0,0|1,0,0]=2 2220 B8R1.5 O[C@H]1CCOC[C@@H]1F MCULE-6227313100 [0,0,0,1,0,0|2,0,0]=3 2221 B8R1.5 O[C@H]1CCOC[C@@H]1F MCULE-8454301102 [0,0,0,1,0,0|2,0,0]=3 2222 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-6598998730 [0,0,0,1,0,0|2,0,0]=3 2223 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-7224746770 [0,0,0,1,0,0|2,0,0]=3 2224 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-7648243504 [0,0,0,1,0,0|2,0,0]=3 2225 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-1003695930 [0,0,0,1,0,0|2,0,0]=3 2226 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-2595427193 [0,0,0,1,0,0|2,0,0]=3 2227 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-4420509139 [0,0,0,1,0,0|2,0,0]=3 2228 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-1178411420 [0,0,0,1,0,0|2,0,0]=3 2229 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-1550810398 [0,0,0,1,0,0|2,0,0]=3 2230 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-9461941348 [0,0,0,1,0,0|2,0,0]=3 2231 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-9787124381 [0,0,0,1,0,0|2,0,0]=3 2232 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-2884977174 [0,0,0,1,0,0|1,0,0]=2 2233 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-4059971580 [0,0,0,1,0,0|1,0,0]=2 2234 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-4860264041 [0,0,0,1,0,0|1,0,0]=2 2235 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-5794552949 [0,0,0,1,0,0|1,0,0]=2 2236 B8R1.5 O[C@H]1CNNC[C@@H]1O MCULE-7867785160 [0,0,0,1,0,0|2,0,0]=3 2237 B8R1.5 O[C@H]1CSSC[C@@H]1O MCULE-2785197932 [0,0,0,1,0,0|2,0,0]=3 2238 B8R1.5 O[C@H]1CSSC[C@@H]1O MCULE-5975753187 [0,0,0,1,0,0|2,0,0]=3 2239 B8R1.5 [C@@H]1(CCNC[C@@H]1F)O MCULE-4552431818 [0,0,0,1,0,0|2,0,0]=3 2240 B8R1.5 [C@@H]1(CCNC[C@@H]1F)O MCULE-6293331305 [0,0,0,1,0,0|2,0,0]=3 2241 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-3406818126 [0,0,0,1,0,0|3,0,0]=4 2242 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-4647745585 [0,0,0,1,0,0|3,0,0]=4 2243 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-8430119550 [0,0,0,1,0,0|3,0,0]=4 2244 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-9944740207 [0,0,0,1,0,0|3,0,0]=4 2245 B8R1.5 [C@@H]1(CCNC[C@H]1F)O MCULE-2598494094 [0,0,0,1,0,0|2,0,0]=3 2246 B8R1.5 [C@@H]1(CCNC[C@H]1F)O MCULE-9897987946 [0,0,0,1,0,0|2,0,0]=3 2247 B8R1.5 [C@@H]1(CCNC[C@H]1O)C MCULE-2307148539 [0,0,0,1,0,0|2,0,0]=3 2248 B8R1.5 [C@@H]1(CCNC[C@H]1O)C MCULE-7550947729 [0,0,0,1,0,0|2,0,0]=3 2249 B8R1.5 [C@@H]1(CCOC[C@@H]1O)N MCULE-2201413833 [0,0,0,1,0,0|2,0,0]=3 2250 B8R1.5 [C@@H]1(CCOC[C@H]1N)O MCULE-7745052941 [0,0,0,1,0,0|2,0,0]=3 2251 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-6806325155 [0,0,0,1,0,0|2,0,0]=3 2252 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-8351727587 [0,0,0,1,0,0|2,0,0]=3 2253 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-9141886243 [0,0,0,1,0,0|2,0,0]=3 2254 B8R1.5 [C@@H]1(CNCC[C@H]1O)O MCULE-7522153539 [0,0,0,1,0,0|1,0,0]=2 2255 B8R1.5 [C@@H]1(CNCC[C@H]1O)O MCULE-8922491067 [0,0,0,1,0,0|1,0,0]=2 2256 B8R1.5 [C@@H]1(COCC[C@@H]1O)N MCULE-2864950342 [0,0,0,1,0,0|2,0,0]=3 2257 B8R1.5 [C@H]1(CCCC[C@H]1F)O MCULE-7751753244 [0,0,0,1,0,0|1,0,0]=2 2258 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-1090696163 [0,0,0,1,0,0|3,0,0]=4 2259 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-4240939724 [0,0,0,1,0,0|3,0,0]=4 2260 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-5876100632 [0,0,0,1,0,0|3,0,0]=4 2261 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-8358389020 [0,0,0,1,0,0|3,0,0]=4 2262 B8R1.5 [C@H]1(CCNC[C@H]1O)O MCULE-2825513554 [0,0,0,1,0,0|1,0,0]=2 2263 B8R1.5 [C@H]1(CCNC[C@H]1O)O MCULE-3902017522 [0,0,0,1,0,0|1,0,0]=2 2264 B8R1.5 [C@H]1(CCOC[C@@H]1O)N MCULE-3291339796 [0,0,0,1,0,0|2,0,0]=3 2265 B8R1.5 [C@H]1(CCOC[C@@H]1O)N MCULE-5641035715 [0,0,0,1,0,0|2,0,0]=3 2266 B8R1.5 [C@H]1(CNCC[C@H]1C)F MCULE-5914413594 [0,0,0,1,0,0|3,0,0]=4 2267 B8R1.5 [C@H]1(CNCC[C@H]1C)F MCULE-6184399583 [0,0,0,1,0,0|3,0,0]=4 2268 B8R1.5 [C@H]1(CNCC[C@H]1C)O MCULE-8053222550 [0,0,0,1,0,0|2,0,0]=3 2269 B8R1.5 [C@H]1(CNCC[C@H]1C)O MCULE-9640568177 [0,0,0,1,0,0|2,0,0]=3 2270 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-1419969909 [0,0,0,1,0,0|2,0,0]=3 2271 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-1584116117 [0,0,0,1,0,0|2,0,0]=3 2272 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-2275992252 [0,0,0,1,0,0|2,0,0]=3 2273 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-4151833845 [0,0,0,1,0,0|2,0,0]=3 2274 B8R1.5 [C@H]1(COCC[C@H]1N)C MCULE-2786096186 [0,0,0,1,0,0|3,0,0]=4 2275 B8R1.5 [C@H]1(COCC[C@H]1N)C MCULE-3516272365 [0,0,0,1,0,0|3,0,0]=4 2276 B8R1.5 [C@H]1(COCC[C@H]1N)O MCULE-2088495989 [0,0,0,1,0,0|2,0,0]=3 2277 B8R1.5 [C@H]1(COCC[C@H]1O)N MCULE-5409068801 [0,0,0,1,0,0|2,0,0]=3 2278 B8R1.10 BrCCCC1CCC1 MCULE-7589486180 [0,0,0,1,0,0|3,0,0]=4 2279 B8R1.10 BrCCOC1COC1 MCULE-7767937054 [0,0,0,1,0,0|3,0,0]=4 2280 B8R1.10 CCCCC1CNC1 MCULE-2618835987 [0,0,0,1,0,0|2,0,0]=3 2281 B8R1.10 CCCCC1CNC1 MCULE-9205198054 [0,0,0,1,0,0|2,0,0]=3 2282 B8R1.10 CCCOC1CNC1 MCULE-3244679891 [0,0,0,1,0,0|3,0,0]=4 2283 B8R1.10 CCCOC1CNC1 MCULE-7869061148 [0,0,0,1,0,0|3,0,0]=4 2284 B8R1.10 CCCOC1CNC1 MCULE-8082413973 [0,0,0,1,0,0|3,0,0]=4 2285 B8R1.10 CCNCC1CCC1 MCULE-3023922128 [0,0,0,1,0,0|3,0,0]=4 2286 B8R1.10 CCNCC1CCC1 MCULE-6528199463 [0,0,0,1,0,0|3,0,0]=4 2287 B8R1.10 CCOCC1CNC1 MCULE-3192183187 [0,0,0,1,0,0|3,0,0]=4 2288 B8R1.10 CCOCC1CNC1 MCULE-4813127228 [0,0,0,1,0,0|3,0,0]=4 2289 B8R1.10 CNCCC1CCC1 MCULE-2745819281 [0,0,0,1,0,0|3,0,0]=4 2290 B8R1.10 CNCCC1CCC1 MCULE-3567323475 [0,0,0,1,0,0|3,0,0]=4 2291 B8R1.10 COCCC1CNC1 MCULE-2270571753 [0,0,0,1,0,0|3,0,0]=4 2292 B8R1.10 COCCC1CNC1 MCULE-3871468888 [0,0,0,1,0,0|3,0,0]=4 2293 B8R1.10 NCCCC1CCC1 MCULE-7549286728 [0,0,0,1,0,0|3,0,0]=4 2294 B8R1.10 NCCNC1COC1 MCULE-4044774824 [0,0,0,1,0,0|3,0,0]=4 2295 B8R1.10 NCCNC1COC1 MCULE-7283474131 [0,0,0,1,0,0|3,0,0]=4 2296 B8R1.10 O=CCCC1CCO1 MCULE-1882673341 [0,0,0,1,0,0|2,0,1]=4 2297 B8R1.10 OCCCC1CCC1 MCULE-1577610703 [0,0,0,1,0,0|3,0,0]=4 2298 B8R1.10 OCCCC1CNC1 MCULE-3148309334 [0,0,0,1,0,0|3,0,0]=4 2299 B8R1.10 OCCCC1CNC1 MCULE-6271488170 [0,0,0,1,0,0|3,0,0]=4 2300 B8R1.10 OCCCC1COC1 MCULE-7151305582 [0,0,0,1,0,0|2,0,0]=3 2301 B8R1.10 OCCNC1COC1 MCULE-3645310966 [0,0,0,1,0,0|3,0,0]=4 2302 B8R1.10 OCCOC1COC1 MCULE-5831415119 [0,0,0,1,0,0|3,0,0]=4 2303 B8R1.13 CCCC1CCC1=O MCULE-7626165824 [0,0,0,1,0,0|1,0,2]=4 2304 B8R1.13 COCC1CCC1N MCULE-2980403375 [0,0,0,1,0,0|3,0,0]=4 2305 B8R1.13 COCC1CCC1N MCULE-4247085069 [0,0,0,1,0,0|3,0,0]=4 2306 B8R1.13 COC[C@@H]1CC[C@@H]1N MCULE-1015639522 [0,0,0,1,0,0|3,0,0]=4 2307 B8R1.13 COC[C@@H]1CC[C@@H]1N MCULE-6601508773 [0,0,0,1,0,0|3,0,0]=4 2308 B8R1.13 COC[C@@H]1CC[C@H]1N MCULE-4823593055 [0,0,0,1,0,0|3,0,0]=4 2309 B8R1.13 COC[C@@H]1CC[C@H]1N MCULE-6349984221 [0,0,0,1,0,0|3,0,0]=4 2310 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-2210338858 [0,0,0,1,0,0|3,0,0]=4 2311 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-2877629860 [0,0,0,1,0,0|3,0,0]=4 2312 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-5582450257 [0,0,0,1,0,0|3,0,0]=4 2313 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-5666025932 [0,0,0,1,0,0|3,0,0]=4 2314 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-6479999687 [0,0,0,1,0,0|3,0,0]=4 2315 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-9238987984 [0,0,0,1,0,0|3,0,0]=4 2316 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-4476949370 [0,0,0,1,0,0|3,0,0]=4 2317 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-4812696512 [0,0,0,1,0,0|3,0,0]=4 2318 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-5922011030 [0,0,0,1,0,0|3,0,0]=4 2319 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-8467603557 [0,0,0,1,0,0|3,0,0]=4 2320 B8R1.17 CCOC1CC1CO MCULE-2173512328 [0,0,0,1,0,0|2,0,0]=3 2321 B8R1.17 CNCC1CC1CN MCULE-9603697675 [0,0,0,1,0,0|3,0,0]=4 2322 B8R1.22 BrC1C=CCCCC1 MCULE-3305569927 [0,0,0,1,0,0|2,0,1]=4 2323 B8R1.22 BrC1CCCCCC1 MCULE-4670856107 [0,0,0,1,0,0|2,0,0]=3 2324 B8R1.22 BrC1CCCOCC1 MCULE-4342557066 [0,0,0,1,0,0|3,0,0]=4 2325 B8R1.22 C=C1CNCCOC1 MCULE-6114191545 [0,0,0,1,0,0|2,0,1]=4 2326 B8R1.22 C=C1CNCCOC1 MCULE-6722705565 [0,0,0,1,0,0|2,0,1]=4 2327 B8R1.22 C=C1COCCOC1 MCULE-3194930888 [0,0,0,1,0,0|2,0,1]=4 2328 B8R1.22 CC1CCCCCN1 MCULE-2095896439 [0,0,0,1,0,0|3,0,0]=4 2329 B8R1.22 CC1CCCCCN1 MCULE-5848089936 [0,0,0,1,0,0|3,0,0]=4 2330 B8R1.22 CC1CCCCNC1 MCULE-4872471007 [0,0,0,1,0,0|2,0,0]=3 2331 B8R1.22 CC1CCCCNC1 MCULE-6320007925 [0,0,0,1,0,0|2,0,0]=3 2332 B8R1.22 CC1CCCNCC1 MCULE-1361067252 [0,0,0,1,0,0|3,0,0]=4 2333 B8R1.22 CC1CCCNCC1 MCULE-8866871990 [0,0,0,1,0,0|3,0,0]=4 2334 B8R1.22 CC1CNCCCN1 MCULE-4765039625 [0,0,0,1,0,0|3,0,0]=4 2335 B8R1.22 CC1CNCCCO1 MCULE-6836650488 [0,0,0,1,0,0|3,0,0]=4 2336 B8R1.22 CC1CNCCCO1 MCULE-8246520743 [0,0,0,1,0,0|3,0,0]=4 2337 B8R1.22 CC1CNCCNC1 MCULE-8657576639 [0,0,0,1,0,0|3,0,0]=4 2338 B8R1.22 CC1CNCCOC1 MCULE-3266198031 [0,0,0,1,0,0|2,0,0]=3 2339 B8R1.22 CC1CNCCOC1 MCULE-7683724120 [0,0,0,1,0,0|2,0,0]=3 2340 B8R1.22 CC1CNCCSC1 MCULE-6522611117 [0,0,0,1,0,0|2,1,0]=4 2341 B8R1.22 CC1COCCCN1 MCULE-5522410500 [0,0,0,1,0,0|2,0,0]=3 2342 B8R1.22 CC1CSCCCN1 MCULE-1217955281 [0,0,0,1,0,0|2,1,0]=4 2343 B8R1.22 CC1CSCCCN1 MCULE-1651941633 [0,0,0,1,0,0|2,1,0]=4 2344 B8R1.22 CN1COCCOC1 MCULE-7955154550 [0,0,0,1,0,0|3,0,0]=4 2345 B8R1.22 C[C@@H]1CCCCCN1 MCULE-6288089261 [0,0,0,1,0,0|3,0,0]=4 2346 B8R1.22 C[C@@H]1CCCCCN1 MCULE-9958468096 [0,0,0,1,0,0|3,0,0]=4 2347 B8R1.22 C[C@H]1CCCCCN1 MCULE-2291249179 [0,0,0,1,0,0|3,0,0]=4 2348 B8R1.22 C[C@H]1CCCCCN1 MCULE-2695293080 [0,0,0,1,0,0|3,0,0]=4 2349 B8R1.22 ClC1CCCCCC1 MCULE-9172347842 [0,0,0,1,0,0|2,0,0]=3 2350 B8R1.22 FC1CCCCNC1 MCULE-5480487921 [0,0,0,1,0,0|2,0,0]=3 2351 B8R1.22 FC1CCCCNC1 MCULE-5782030002 [0,0,0,1,0,0|2,0,0]=3 2352 B8R1.22 FC1CCCNCC1 MCULE-2724514050 [0,0,0,1,0,0|3,0,0]=4 2353 B8R1.22 FC1CCCNCC1 MCULE-3808617764 [0,0,0,1,0,0|3,0,0]=4 2354 B8R1.22 FC1CNCCNC1 MCULE-6019106998 [0,0,0,1,0,0|3,0,0]=4 2355 B8R1.22 FC1CNCCNC1 MCULE-7988909456 [0,0,0,1,0,0|3,0,0]=4 2356 B8R1.22 F[C@H]1CCCNCC1 MCULE-5787198940 [0,0,0,1,0,0|3,0,0]=4 2357 B8R1.22 F[C@H]1CCCNCC1 MCULE-8736460913 [0,0,0,1,0,0|3,0,0]=4 2358 B8R1.22 NC1C=CCCCC1 MCULE-4893389838 [0,0,0,1,0,0|2,0,1]=4 2359 B8R1.22 NC1CCCCCC1 MCULE-6214185878 [0,0,0,1,0,0|2,0,0]=3 2360 B8R1.22 NC1CCCCNC1 MCULE-9702629623 [0,0,0,1,0,0|2,0,0]=3 2361 B8R1.22 NC1CCCCNC1 MCULE-9973726441 [0,0,0,1,0,0|2,0,0]=3 2362 B8R1.22 NC1CCCNCC1 MCULE-5600391911 [0,0,0,1,0,0|3,0,0]=4 2363 B8R1.22 NC1CCCNCC1 MCULE-7390953649 [0,0,0,1,0,0|3,0,0]=4 2364 B8R1.22 NC1CCCOCC1 MCULE-2817475859 [0,0,0,1,0,0|3,0,0]=4 2365 B8R1.22 NC1CCCSCC1 MCULE-1327827987 [0,0,0,1,0,0|3,0,0]=4 2366 B8R1.22 NC1CNCCNC1 MCULE-4228066155 [0,0,0,1,0,0|3,0,0]=4 2367 B8R1.22 NC1CNCCOC1 MCULE-6645165643 [0,0,0,1,0,0|2,0,0]=3 2368 B8R1.22 NC1CNCCOC1 MCULE-6897171234 [0,0,0,1,0,0|2,0,0]=3 2369 B8R1.22 NC1COCCOC1 MCULE-2081266239 [0,0,0,1,0,0|2,0,0]=3 2370 B8R1.22 NC1COCCOC1 MCULE-8164730318 [0,0,0,1,0,0|2,0,0]=3 2371 B8R1.22 NN1CCCCCC1 MCULE-6118274368 [0,0,0,1,0,0|3,0,0]=4 2372 B8R1.22 N[C@@H]1CCCCNC1 MCULE-4063472101 [0,0,0,1,0,0|2,0,0]=3 2373 B8R1.22 N[C@@H]1CCCCNC1 MCULE-6734296273 [0,0,0,1,0,0|2,0,0]=3 2374 B8R1.22 N[C@@H]1CCCNCC1 MCULE-5614702075 [0,0,0,1,0,0|3,0,0]=4 2375 B8R1.22 N[C@H]1CCCCNC1 MCULE-2962012084 [0,0,0,1,0,0|2,0,0]=3 2376 B8R1.22 N[C@H]1CCCCNC1 MCULE-4348209410 [0,0,0,1,0,0|2,0,0]=3 2377 B8R1.22 N[C@H]1CCCCNC1 MCULE-5018449571 [0,0,0,1,0,0|2,0,0]=3 2378 B8R1.22 N[C@H]1CCCCNC1 MCULE-6428493067 [0,0,0,1,0,0|2,0,0]=3 2379 B8R1.22 N[C@H]1CCCCNC1 MCULE-9621520180 [0,0,0,1,0,0|2,0,0]=3 2380 B8R1.22 N[C@H]1CCCNCC1 MCULE-1653914126 [0,0,0,1,0,0|3,0,0]=4 2381 B8R1.22 O=C1CCCCCC1 MCULE-3507111924 [0,0,0,1,0,0|1,0,2]=4 2382 B8R1.22 O=C1CCCCNC1 MCULE-8257380915 [0,0,0,1,0,0|1,0,2]=4 2383 B8R1.22 O=C1CCCCNC1 MCULE-8344538815 [0,0,0,1,0,0|1,0,2]=4 2384 B8R1.22 O=C1CNCCOC1 MCULE-7546546158 [0,0,0,1,0,0|1,0,2]=4 2385 B8R1.22 O=C1CNCCOC1 MCULE-9183427962 [0,0,0,1,0,0|1,0,2]=4 2386 B8R1.22 O=C1COCCCN1 MCULE-1471963909 [0,0,0,1,0,0|1,0,2]=4 2387 B8R1.22 O=C1COCCOC1 MCULE-4481438739 [0,0,0,1,0,0|1,0,2]=4 2388 B8R1.22 OC1CCCCCC1 MCULE-2514105258 [0,0,0,1,0,0|1,0,0]=2 2389 B8R1.22 OC1CCCCNC1 MCULE-1190427956 [0,0,0,1,0,0|1,0,0]=2 2390 B8R1.22 OC1CCCCNC1 MCULE-1421732173 [0,0,0,1,0,0|1,0,0]=2 2391 B8R1.22 OC1CCCNCC1 MCULE-1004110838 [0,0,0,1,0,0|2,0,0]=3 2392 B8R1.22 OC1CCCNCC1 MCULE-3791515829 [0,0,0,1,0,0|2,0,0]=3 2393 B8R1.22 OC1CCCOCC1 MCULE-6712544119 [0,0,0,1,0,0|2,0,0]=3 2394 B8R1.22 OC1CNCCNC1 MCULE-8325443912 [0,0,0,1,0,0|2,0,0]=3 2395 B8R1.22 OC1CNCCNC1 MCULE-8846087954 [0,0,0,1,0,0|2,0,0]=3 2396 B8R1.22 OC1CNCCNC1 MCULE-9258760029 [0,0,0,1,0,0|2,0,0]=3 2397 B8R1.22 OC1CNCCNC1 MCULE-9598330332 [0,0,0,1,0,0|2,0,0]=3 2398 B8R1.22 OC1CNCCOC1 MCULE-2428391064 [0,0,0,1,0,0|1,0,0]=2 2399 B8R1.22 OC1CNCCOC1 MCULE-5528486665 [0,0,0,1,0,0|1,0,0]=2 2400 B8R1.22 OC1COCCOC1 MCULE-2284989485 [0,0,0,1,0,0|1,0,0]=2 2401 B8R1.22 O[C@@H]1CCCCNC1 MCULE-1012232836 [0,0,0,1,0,0|1,0,0]=2 2402 B8R1.22 O[C@@H]1CCCCNC1 MCULE-8021135676 [0,0,0,1,0,0|1,0,0]=2 2403 B8R1.22 O[C@@H]1CCCNCC1 MCULE-4750880036 [0,0,0,1,0,0|2,0,0]=3 2404 B8R1.22 O[C@@H]1CCCNCC1 MCULE-7818554188 [0,0,0,1,0,0|2,0,0]=3 2405 B8R1.22 O[C@@H]1CNCCOC1 MCULE-5133055470 [0,0,0,1,0,0|1,0,0]=2 2406 B8R1.22 O[C@@H]1CNCCOC1 MCULE-7942990292 [0,0,0,1,0,0|1,0,0]=2 2407 B8R1.22 O[C@H]1CCCCNC1 MCULE-3979929214 [0,0,0,1,0,0|1,0,0]=2 2408 B8R1.22 O[C@H]1CCCCNC1 MCULE-8051415954 [0,0,0,1,0,0|1,0,0]=2 2409 B8R1.22 O[C@H]1CCCNCC1 MCULE-3288930041 [0,0,0,1,0,0|2,0,0]=3 2410 B8R1.22 O[C@H]1CCCNCC1 MCULE-4775727156 [0,0,0,1,0,0|2,0,0]=3 2411 B8R1.22 O[C@H]1CCCNCC1 MCULE-9319578978 [0,0,0,1,0,0|2,0,0]=3 2412 B8R1.22 O[C@H]1CCCNCC1 MCULE-9853151234 [0,0,0,1,0,0|2,0,0]=3 2413 B8R1.22 O[C@H]1CNCCOC1 MCULE-6353150297 [0,0,0,1,0,0|1,0,0]=2 2414 B8R1.22 SC1CCCCCC1 MCULE-7667420050 [0,0,0,1,0,0|1,1,0]=3 2415 B8R1.38 C=CC(N)C1CCC1 MCULE-3645428001 [0,0,0,1,0,0|2,0,1]=4 2416 B8R1.38 CC(C#N)C1CCC1 MCULE-9511129910 [0,0,0,1,0,0|2,0,1]=4 2417 B8R1.38 CC(C=O)C1CCC1 MCULE-5860376202 [0,0,0,1,0,0|1,0,2]=4 2418 B8R1.38 CC(CBr)C1CCC1 MCULE-1541605827 [0,0,0,1,0,0|2,0,0]=3 2419 B8R1.38 CC(CO)C1CCC1 MCULE-1784327025 [0,0,0,1,0,0|1,0,0]=2 2420 B8R1.38 CC(CO)C1CCO1 MCULE-2444675648 [0,0,0,1,0,0|2,0,0]=3 2421 B8R1.38 CC(CO)N1CCC1 MCULE-9016935520 [0,0,0,1,0,0|2,0,0]=3 2422 B8R1.38 CCC(=O)C1CCC1 MCULE-2054282062 [0,0,0,1,0,0|1,0,2]=4 2423 B8R1.38 CCC(N)C1CCC1 MCULE-4148346502 [0,0,0,1,0,0|2,0,0]=3 2424 B8R1.38 CCC(N)C1CCC1 MCULE-8370575436 [0,0,0,1,0,0|2,0,0]=3 2425 B8R1.38 CCC(O)C1CCC1 MCULE-5180007399 [0,0,0,1,0,0|1,0,0]=2 2426 B8R1.38 CCC(O)C1COC1 MCULE-1846989475 [0,0,0,1,0,0|2,0,0]=3 2427 B8R1.38 CNC(C)C1CCC1 MCULE-8235929643 [0,0,0,1,0,0|3,0,0]=4 2428 B8R1.38 C[C@@H](CO)N1CCC1 MCULE-2471335655 [0,0,0,1,0,0|2,0,0]=3 2429 B8R1.38 N#CC(N)C1CCC1 MCULE-8208759516 [0,0,0,1,0,0|2,0,1]=4 2430 B8R1.38 N=C(NO)C1CCC1 MCULE-4445464088 [0,0,0,1,0,0|2,0,1]=4 2431 B8R1.38 NC(CO)C1CCC1 MCULE-1060557753 [0,0,0,1,0,0|1,0,0]=2 2432 B8R1.38 NC(CO)C1CCC1 MCULE-4732995704 [0,0,0,1,0,0|1,0,0]=2 2433 B8R1.38 NCC(=O)C1CCC1 MCULE-2102604629 [0,0,0,1,0,0|1,0,2]=4 2434 B8R1.38 NCC(=O)C1CCC1 MCULE-5571071703 [0,0,0,1,0,0|1,0,2]=4 2435 B8R1.38 NCC(N)C1CCC1 MCULE-5439532200 [0,0,0,1,0,0|2,0,0]=3 2436 B8R1.38 NCC(N)C1CCC1 MCULE-8490064832 [0,0,0,1,0,0|2,0,0]=3 2437 B8R1.38 NCC(O)C1CCC1 MCULE-3437732656 [0,0,0,1,0,0|1,0,0]=2 2438 B8R1.38 NCC(O)C1CCC1 MCULE-3764801914 [0,0,0,1,0,0|1,0,0]=2 2439 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-1191204694 [0,0,0,1,0,0|1,0,0]=2 2440 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-4280800914 [0,0,0,1,0,0|1,0,0]=2 2441 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-4912879577 [0,0,0,1,0,0|1,0,0]=2 2442 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-8248389845 [0,0,0,1,0,0|1,0,0]=2 2443 B8R1.38 N[C@H](CO)C1CCC1 MCULE-2165772919 [0,0,0,1,0,0|1,0,0]=2 2444 B8R1.38 N[C@H](CO)C1CCC1 MCULE-5153627963 [0,0,0,1,0,0|1,0,0]=2 2445 B8R1.38 N[C@H](CO)C1CCC1 MCULE-5389043091 [0,0,0,1,0,0|1,0,0]=2 2446 B8R1.38 N[C@H](CO)C1CCC1 MCULE-7675577168 [0,0,0,1,0,0|1,0,0]=2 2447 B8R1.38 N[C@H](CO)C1COC1 MCULE-3365163158 [0,0,0,1,0,0|2,0,0]=3 2448 B8R1.38 N[C@H](CO)C1COC1 MCULE-4558714642 [0,0,0,1,0,0|2,0,0]=3 2449 B8R1.38 O=C(CBr)C1CCC1 MCULE-7056136632 [0,0,0,1,0,0|1,0,2]=4 2450 B8R1.38 O=C(CCl)C1CCC1 MCULE-9286559827 [0,0,0,1,0,0|1,0,2]=4 2451 B8R1.38 O=C(NO)C1CCC1 MCULE-5722727330 [0,0,0,1,0,0|1,0,2]=4 2452 B8R1.38 OCC(O)C1CCC1 MCULE-5695655912 [0,0,0,1,0,0|0,0,0]=1 2453 B8R1.40 CCC(=O)CC1CC1 MCULE-7991524982 [0,0,0,1,0,0|1,0,2]=4 2454 B8R1.40 CCC(C)NC1CC1 MCULE-7058816446 [0,0,0,1,0,0|3,0,0]=4 2455 B8R1.40 CCC(N)CC1CC1 MCULE-5542802833 [0,0,0,1,0,0|2,0,0]=3 2456 B8R1.40 N/C(=N\O)/CC1CC1 MCULE-2177833388 [0,0,0,1,0,0|2,0,1]=4 2457 B8R1.40 NC(CO)CC1CC1 MCULE-7286476383 [0,0,0,1,0,0|1,0,0]=2 2458 B8R1.40 NC(CO)CC1CC1 MCULE-9063082551 [0,0,0,1,0,0|1,0,0]=2 2459 B8R1.40 NCC(=O)CC1CC1 MCULE-2543196441 [0,0,0,1,0,0|1,0,2]=4 2460 B8R1.40 NCC(=O)CC1CC1 MCULE-5112659326 [0,0,0,1,0,0|1,0,2]=4 2461 B8R1.40 N[C@@H](CO)CC1CC1 MCULE-2751028745 [0,0,0,1,0,0|1,0,0]=2 2462 B8R1.40 N[C@@H](CO)CC1CC1 MCULE-5358245814 [0,0,0,1,0,0|1,0,0]=2 2463 B8R1.40 N[C@H](CO)CC1CC1 MCULE-2936761410 [0,0,0,1,0,0|1,0,0]=2 2464 B8R1.40 N[C@H](CO)CC1CC1 MCULE-4806571417 [0,0,0,1,0,0|1,0,0]=2 2465 B8R1.40 N[C@H](CO)CC1CC1 MCULE-6129944826 [0,0,0,1,0,0|1,0,0]=2 2466 B8R1.40 O=C(CBr)CC1CC1 MCULE-2483365582 [0,0,0,1,0,0|1,0,2]=4 2467 B8R1.40 O=C(CO)NC1CC1 MCULE-8403900056 [0,0,0,1,0,0|1,0,2]=4 2468 B8R1.41 CC1(CC1)CCCBr MCULE-4765272716 [0,0,0,1,0,0|3,0,0]=4 2469 B8R1.41 CC1(CC1)CCCO MCULE-8679401406 [0,0,0,1,0,0|3,0,0]=4 2470 B8R1.41 CCCCC1(CC1)N MCULE-2085147327 [0,0,0,1,0,0|2,0,0]=3 2471 B8R1.41 CCCCC1(CC1)N MCULE-7418078660 [0,0,0,1,0,0|2,0,0]=3 2472 B8R1.41 CCCCC1(CC1)N MCULE-9328726980 [0,0,0,1,0,0|2,0,0]=3 2473 B8R1.41 CCCCC1(CC1)O MCULE-3219412686 [0,0,0,1,0,0|1,0,0]=2 2474 B8R1.41 CCOCC1(CC1)N MCULE-4470984672 [0,0,0,1,0,0|3,0,0]=4 2475 B8R1.41 CCOCC1(CC1)N MCULE-9426716299 [0,0,0,1,0,0|3,0,0]=4 2476 B8R1.41 CCSCC1(CC1)N MCULE-4585217295 [0,0,0,1,0,0|3,0,0]=4 2477 B8R1.41 CCSCC1(CC1)N MCULE-4778128049 [0,0,0,1,0,0|3,0,0]=4 2478 B8R1.41 COCCC1(CC1)N MCULE-3979238152 [0,0,0,1,0,0|3,0,0]=4 2479 B8R1.41 COCCC1(CC1)N MCULE-4345460554 [0,0,0,1,0,0|3,0,0]=4 2480 B8R1.41 NC1(CC1)CCCO MCULE-4302426407 [0,0,0,1,0,0|3,0,0]=4 2481 B8R1.41 NC1(CC1)CCCO MCULE-9152492050 [0,0,0,1,0,0|3,0,0]=4 2482 B8R1.47 C#CC1CC(C1)CO MCULE-4414437740 [0,0,0,1,0,0|1,0,2]=4 2483 B8R1.47 C#C[C@H]1C[C@@H](C1)CO MCULE-4031242814 [0,0,0,1,0,0|1,0,2]=4 2484 B8R1.47 C#C[C@H]1C[C@H](C1)CO MCULE-3488967606 [0,0,0,1,0,0|1,0,2]=4 2485 B8R1.47 CCN1CC(C1)CN MCULE-5151874412 [0,0,0,1,0,0|3,0,0]=4 2486 B8R1.47 CCN1CC(C1)CO MCULE-1727098405 [0,0,0,1,0,0|2,0,0]=3 2487 B8R1.47 CCN1CC(C1)CO MCULE-9726920458 [0,0,0,1,0,0|2,0,0]=3 2488 B8R1.47 CN[C@H]1C[C@@H](C1)CO MCULE-8295172775 [0,0,0,1,0,0|2,0,0]=3 2489 B8R1.47 CN[C@H]1C[C@H](C1)CO MCULE-4504786267 [0,0,0,1,0,0|2,0,0]=3 2490 B8R1.47 COC1CC(C1)CBr MCULE-7547750524 [0,0,0,1,0,0|3,0,0]=4 2491 B8R1.47 COC1CC(C1)CN MCULE-1876436922 [0,0,0,1,0,0|3,0,0]=4 2492 B8R1.47 COC1CC(C1)CN MCULE-2671284483 [0,0,0,1,0,0|3,0,0]=4 2493 B8R1.47 COC1CC(C1)CO MCULE-9110825744 [0,0,0,1,0,0|2,0,0]=3 2494 B8R1.47 CO[C@H]1C[C@@H](C1)CN MCULE-2551820721 [0,0,0,1,0,0|3,0,0]=4 2495 B8R1.47 CO[C@H]1C[C@@H](C1)CN MCULE-3234945341 [0,0,0,1,0,0|3,0,0]=4 2496 B8R1.47 CO[C@H]1C[C@H](C1)CN MCULE-1935507713 [0,0,0,1,0,0|3,0,0]=4 2497 B8R1.47 CO[C@H]1C[C@H](C1)CN MCULE-8411728691 [0,0,0,1,0,0|3,0,0]=4 2498 B8R1.47 N#CC1CC(C1)CO MCULE-2019665172 [0,0,0,1,0,0|2,0,1]=4 2499 B8R1.47 NCC1CC(C1)CO MCULE-5012949238 [0,0,0,1,0,0|2,0,0]=3 2500 B8R1.47 NCC1CC(C1)CO MCULE-7199790178 [0,0,0,1,0,0|2,0,0]=3 2501 B8R1.47 NC[C@H]1C[C@@H](C1)CO MCULE-3562556540 [0,0,0,1,0,0|2,0,0]=3 2502 B8R1.47 NC[C@H]1C[C@@H](C1)CO MCULE-7456554862 [0,0,0,1,0,0|2,0,0]=3 2503 B8R1.47 NC[C@H]1C[C@H](C1)CO MCULE-5103568519 [0,0,0,1,0,0|2,0,0]=3 2504 B8R1.47 NC[C@H]1C[C@H](C1)CO MCULE-5155041811 [0,0,0,1,0,0|2,0,0]=3 2505 B8R1.47 OCC1CC(C1)CBr MCULE-2597862386 [0,0,0,1,0,0|2,0,0]=3 2506 B8R1.47 OCC1CC(C1)CO MCULE-9877034202 [0,0,0,1,0,0|2,0,0]=3 2507 B8R1.47 OCC1CC(N1)CO MCULE-1455435267 [0,0,0,1,0,0|2,0,0]=3 2508 B8R1.47 OCC1CC(N1)CO MCULE-7256280066 [0,0,0,1,0,0|2,0,0]=3 2509 B8R1.47 OC[C@@H]1C[C@@H](N1)CO MCULE-9594945818 [0,0,0,1,0,0|2,0,0]=3 2510 B8R1.47 OC[C@@H]1C[C@@H](N1)CO MCULE-9708181621 [0,0,0,1,0,0|2,0,0]=3 2511 B8R1.47 OC[C@H]1C[C@@H](N1)CO MCULE-9233798202 [0,0,0,1,0,0|2,0,0]=3 2512 B8R1.47 OC[C@H]1C[C@H](C1)CO MCULE-4308306731 [0,0,0,1,0,0|2,0,0]=3 2513 B8R1.50 CC1C(CCN1C)N MCULE-9387568843 [0,0,0,1,0,0|3,0,0]=4 2514 B8R1.50 CC1CCC(C1=O)C MCULE-1473375660 [0,0,0,1,0,0|1,0,2]=4 2515 B8R1.50 CC1CCC(C1N)C MCULE-5534270110 [0,0,0,1,0,0|2,0,0]=3 2516 B8R1.50 CC1CCC(C1N)C MCULE-9569539393 [0,0,0,1,0,0|2,0,0]=3 2517 B8R1.50 CC1CCC(C1O)O MCULE-3292232581 [0,0,0,1,0,0|0,0,0]=1 2518 B8R1.50 CN1CCC(C1=O)O MCULE-6867263123 [0,0,0,1,0,0|1,0,2]=4 2519 B8R1.50 NC1CCC(C1O)O MCULE-2902511864 [0,0,0,1,0,0|1,0,0]=2 2520 B8R1.50 NC1CCC(C1O)O MCULE-2997796956 [0,0,0,1,0,0|1,0,0]=2 2521 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-4654712954 [0,0,0,1,0,0|1,0,0]=2 2522 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-4756579413 [0,0,0,1,0,0|1,0,0]=2 2523 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-5386854672 [0,0,0,1,0,0|1,0,0]=2 2524 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-8517121727 [0,0,0,1,0,0|1,0,0]=2 2525 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-1001347318 [0,0,0,1,0,0|1,0,0]=2 2526 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-3161518566 [0,0,0,1,0,0|1,0,0]=2 2527 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-8097854840 [0,0,0,1,0,0|1,0,0]=2 2528 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-9614047785 [0,0,0,1,0,0|1,0,0]=2 2529 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-3397642974 [0,0,0,1,0,0|1,0,0]=2 2530 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-5620525999 [0,0,0,1,0,0|1,0,0]=2 2531 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-8393185418 [0,0,0,1,0,0|1,0,0]=2 2532 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-9763920178 [0,0,0,1,0,0|1,0,0]=2 2533 B8R1.50 O=C1OCC(C1O)O MCULE-9766741798 [0,0,0,1,0,0|2,0,1]=4 2534 B8R1.50 O=C1OC[C@@H]([C@@H]1O)O MCULE-8629460196 [0,0,0,1,0,0|2,0,1]=4 2535 B8R1.50 O=C1OC[C@@H]([C@H]1O)O MCULE-7303431003 [0,0,0,1,0,0|2,0,1]=4 2536 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-4704805755 [0,0,0,1,0,0|2,0,1]=4 2537 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7070309718 [0,0,0,1,0,0|2,0,1]=4 2538 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7824820688 [0,0,0,1,0,0|2,0,1]=4 2539 B8R1.50 OC1COC(C1O)O MCULE-2562953459 [0,0,0,1,0,0|2,0,0]=3 2540 B8R1.50 OC1OC[C@@H]([C@H]1O)O MCULE-4484765937 [0,0,0,1,0,0|2,0,0]=3 2541 B8R1.50 OC1OC[C@H]([C@@H]1O)O MCULE-4663451850 [0,0,0,1,0,0|2,0,0]=3 2542 B8R1.52 C#CC1(CCCC1)C MCULE-9671261567 [0,0,0,1,0,0|2,0,1]=4 2543 B8R1.52 C#CC1(CCCC1)N MCULE-2932081709 [0,0,0,1,0,0|2,0,1]=4 2544 B8R1.52 C#CC1(CCCC1)N MCULE-9707098843 [0,0,0,1,0,0|2,0,1]=4 2545 B8R1.52 C#CC1(CCCC1)O MCULE-7428088952 [0,0,0,1,0,0|1,0,1]=3 2546 B8R1.52 C#CC1(CCNC1)O MCULE-3731266973 [0,0,0,1,0,0|2,0,1]=4 2547 B8R1.52 C#CC1(CCNC1)O MCULE-4773494274 [0,0,0,1,0,0|2,0,1]=4 2548 B8R1.52 C#CC1(CCOC1)O MCULE-4031241962 [0,0,0,1,0,0|2,0,1]=4 2549 B8R1.52 CC1(C=CCC1)CO MCULE-5775332492 [0,0,0,1,0,0|1,0,2]=4 2550 B8R1.52 CC1(CCCC1)C#N MCULE-2721276425 [0,0,0,1,0,0|2,0,1]=4 2551 B8R1.52 CC1(CCCC1)C=O MCULE-2794420297 [0,0,0,1,0,0|1,0,2]=4 2552 B8R1.52 CC1(CCCC1)CBr MCULE-8731175743 [0,0,0,1,0,0|2,0,0]=3 2553 B8R1.52 CC1(CCCC1)CN MCULE-5367013560 [0,0,0,1,0,0|2,0,0]=3 2554 B8R1.52 CC1(CCCC1)CN MCULE-5646661577 [0,0,0,1,0,0|2,0,0]=3 2555 B8R1.52 CC1(CCCC1)CO MCULE-5781311918 [0,0,0,1,0,0|1,0,0]=2 2556 B8R1.52 CC1(CCCN1)CO MCULE-6540579872 [0,0,0,1,0,0|2,0,0]=3 2557 B8R1.52 CC1(CCCN1)CO MCULE-8257131278 [0,0,0,1,0,0|2,0,0]=3 2558 B8R1.52 CC1(CCCN1)CO MCULE-8482084576 [0,0,0,1,0,0|2,0,0]=3 2559 B8R1.52 CC1(CCCN1)CO MCULE-8834174428 [0,0,0,1,0,0|2,0,0]=3 2560 B8R1.52 CC1(CCCO1)CN MCULE-2071513677 [0,0,0,1,0,0|3,0,0]=4 2561 B8R1.52 CC1(CCCO1)CN MCULE-4256725320 [0,0,0,1,0,0|3,0,0]=4 2562 B8R1.52 CC1(CCCO1)CO MCULE-9259109857 [0,0,0,1,0,0|2,0,0]=3 2563 B8R1.52 CC1(CCNC1)CF MCULE-2051136618 [0,0,0,1,0,0|3,0,0]=4 2564 B8R1.52 CC1(CCNC1)CF MCULE-4434373184 [0,0,0,1,0,0|3,0,0]=4 2565 B8R1.52 CC1(CCNC1)CN MCULE-6365919473 [0,0,0,1,0,0|3,0,0]=4 2566 B8R1.52 CC1(CCNC1)CN MCULE-7079996143 [0,0,0,1,0,0|3,0,0]=4 2567 B8R1.52 CC1(CCNC1)CN MCULE-9566315933 [0,0,0,1,0,0|3,0,0]=4 2568 B8R1.52 CC1(CCNC1)CO MCULE-4860869358 [0,0,0,1,0,0|2,0,0]=3 2569 B8R1.52 CC1(CCNC1)CO MCULE-5952337109 [0,0,0,1,0,0|2,0,0]=3 2570 B8R1.52 CC1(CCNC1)CO MCULE-8822036636 [0,0,0,1,0,0|2,0,0]=3 2571 B8R1.52 CC1(CCOC1)CBr MCULE-6515619846 [0,0,0,1,0,0|3,0,0]=4 2572 B8R1.52 CC1(CCOC1)CN MCULE-4260151246 [0,0,0,1,0,0|3,0,0]=4 2573 B8R1.52 CC1(CCOC1)CO MCULE-7949441451 [0,0,0,1,0,0|2,0,0]=3 2574 B8R1.52 CC1(OCCO1)CO MCULE-7424031624 [0,0,0,1,0,0|3,0,0]=4 2575 B8R1.52 CCC1(CCCC1)C MCULE-5104658069 [0,0,0,1,0,0|2,0,0]=3 2576 B8R1.52 CCC1(CCCC1)N MCULE-6321282069 [0,0,0,1,0,0|2,0,0]=3 2577 B8R1.52 CCC1(CCCC1)N MCULE-9310297702 [0,0,0,1,0,0|2,0,0]=3 2578 B8R1.52 CCC1(CCCC1)O MCULE-2200843488 [0,0,0,1,0,0|1,0,0]=2 2579 B8R1.52 CCC1(CCNC1)C MCULE-4557651490 [0,0,0,1,0,0|3,0,0]=4 2580 B8R1.52 CCC1(CCNC1)C MCULE-5425858794 [0,0,0,1,0,0|3,0,0]=4 2581 B8R1.52 CCC1(CCNC1)O MCULE-1736563759 [0,0,0,1,0,0|2,0,0]=3 2582 B8R1.52 CCC1(CCNC1)O MCULE-4929877683 [0,0,0,1,0,0|2,0,0]=3 2583 B8R1.52 CCC1(CCOC1)N MCULE-8793166698 [0,0,0,1,0,0|3,0,0]=4 2584 B8R1.52 CCC1(CCOC1)N MCULE-9932095979 [0,0,0,1,0,0|3,0,0]=4 2585 B8R1.52 CCC1(CCOC1)O MCULE-9156641960 [0,0,0,1,0,0|2,0,0]=3 2586 B8R1.52 CC[N+]1(CCCC1)C MCULE-1996992656 [0,0,0,1,0,0|3,0,0]=4 2587 B8R1.52 CC[N+]1(CCCC1)C MCULE-5468205365 [0,0,0,1,0,0|3,0,0]=4 2588 B8R1.52 CC[N+]1(CCCC1)C MCULE-6004225859 [0,0,0,1,0,0|3,0,0]=4 2589 B8R1.52 CNC1(CCCC1)C MCULE-5523013258 [0,0,0,1,0,0|3,0,0]=4 2590 B8R1.52 CNC1(CCCC1)C MCULE-5558514698 [0,0,0,1,0,0|3,0,0]=4 2591 B8R1.52 C[C@@]1(CCCN1)CO MCULE-1770277535 [0,0,0,1,0,0|2,0,0]=3 2592 B8R1.52 C[C@@]1(CCCN1)CO MCULE-2540626362 [0,0,0,1,0,0|2,0,0]=3 2593 B8R1.52 C[C@@]1(CCCN1)CO MCULE-4264108295 [0,0,0,1,0,0|2,0,0]=3 2594 B8R1.52 C[C@@]1(CCCN1)CO MCULE-8418846570 [0,0,0,1,0,0|2,0,0]=3 2595 B8R1.52 C[C@@]1(CCCO1)CN MCULE-1372081592 [0,0,0,1,0,0|3,0,0]=4 2596 B8R1.52 C[C@@]1(CCCO1)CN MCULE-6512781753 [0,0,0,1,0,0|3,0,0]=4 2597 B8R1.52 C[C@@]1(CCNC1)CO MCULE-4028027381 [0,0,0,1,0,0|2,0,0]=3 2598 B8R1.52 C[C@@]1(CCNC1)CO MCULE-5703640559 [0,0,0,1,0,0|2,0,0]=3 2599 B8R1.52 C[C@@]1(CCOC1)CN MCULE-6847854708 [0,0,0,1,0,0|3,0,0]=4 2600 B8R1.52 C[C@@]1(CCOC1)CO MCULE-7732534995 [0,0,0,1,0,0|2,0,0]=3 2601 B8R1.52 C[C@]1(CCCN1)CO MCULE-2761771924 [0,0,0,1,0,0|2,0,0]=3 2602 B8R1.52 C[C@]1(CCCN1)CO MCULE-4095594473 [0,0,0,1,0,0|2,0,0]=3 2603 B8R1.52 C[C@]1(CCCN1)CO MCULE-7014210855 [0,0,0,1,0,0|2,0,0]=3 2604 B8R1.52 C[C@]1(CCCN1)CO MCULE-9276164161 [0,0,0,1,0,0|2,0,0]=3 2605 B8R1.52 C[C@]1(CCNC1)CO MCULE-3181896367 [0,0,0,1,0,0|2,0,0]=3 2606 B8R1.52 C[C@]1(CCNC1)CO MCULE-5981712550 [0,0,0,1,0,0|2,0,0]=3 2607 B8R1.52 C[C@]1(CCOC1)CO MCULE-3142340099 [0,0,0,1,0,0|2,0,0]=3 2608 B8R1.52 FC1(CCCC1)CBr MCULE-5544045757 [0,0,0,1,0,0|2,0,0]=3 2609 B8R1.52 FC1(CCNC1)CBr MCULE-6472281492 [0,0,0,1,0,0|3,0,0]=4 2610 B8R1.52 FC1(CCNC1)CBr MCULE-8505052083 [0,0,0,1,0,0|3,0,0]=4 2611 B8R1.52 N#CC1(CCCC1)F MCULE-9519990946 [0,0,0,1,0,0|2,0,1]=4 2612 B8R1.52 N#CC1(CCCC1)N MCULE-2771828085 [0,0,0,1,0,0|2,0,1]=4 2613 B8R1.52 N#CC1(CCCC1)N MCULE-9817793665 [0,0,0,1,0,0|2,0,1]=4 2614 B8R1.52 N#CC1(CCCC1)O MCULE-6757441617 [0,0,0,1,0,0|1,0,1]=3 2615 B8R1.52 NC1(CC=CC1)CO MCULE-5106747123 [0,0,0,1,0,0|1,0,2]=4 2616 B8R1.52 NC1(CC=CC1)CO MCULE-8638464155 [0,0,0,1,0,0|1,0,2]=4 2617 B8R1.52 NC1(CCCC1)CO MCULE-6075612462 [0,0,0,1,0,0|1,0,0]=2 2618 B8R1.52 NC1(CCCC1)CO MCULE-6080383421 [0,0,0,1,0,0|1,0,0]=2 2619 B8R1.52 NC1(CCCC1)CO MCULE-9669923041 [0,0,0,1,0,0|1,0,0]=2 2620 B8R1.52 NC1(CCNC1)CO MCULE-5174166000 [0,0,0,1,0,0|2,0,0]=3 2621 B8R1.52 NC1(CCNC1)CO MCULE-7340627867 [0,0,0,1,0,0|2,0,0]=3 2622 B8R1.52 NC1(CCOC1)CO MCULE-9666933944 [0,0,0,1,0,0|2,0,0]=3 2623 B8R1.52 NC1(CCSC1)CO MCULE-2703002887 [0,0,0,1,0,0|2,0,0]=3 2624 B8R1.52 NCC1(CCCC1)F MCULE-5401302824 [0,0,0,1,0,0|2,0,0]=3 2625 B8R1.52 NCC1(CCCC1)F MCULE-7203857001 [0,0,0,1,0,0|2,0,0]=3 2626 B8R1.52 NCC1(CCCC1)N MCULE-1134056027 [0,0,0,1,0,0|2,0,0]=3 2627 B8R1.52 NCC1(CCCC1)N MCULE-5743820145 [0,0,0,1,0,0|2,0,0]=3 2628 B8R1.52 NCC1(CCCC1)O MCULE-7890258140 [0,0,0,1,0,0|1,0,0]=2 2629 B8R1.52 NCC1(CCCC1)O MCULE-7985204108 [0,0,0,1,0,0|1,0,0]=2 2630 B8R1.52 NCC1(CCOC1)F MCULE-1120303922 [0,0,0,1,0,0|3,0,0]=4 2631 B8R1.52 NCC1(CCOC1)F MCULE-4396555008 [0,0,0,1,0,0|3,0,0]=4 2632 B8R1.52 NCC1(CCOC1)O MCULE-1810319650 [0,0,0,1,0,0|2,0,0]=3 2633 B8R1.52 NCC1(CCOC1)O MCULE-9097947174 [0,0,0,1,0,0|2,0,0]=3 2634 B8R1.52 NCC1(CCSC1)O MCULE-7330229410 [0,0,0,1,0,0|2,0,0]=3 2635 B8R1.52 N[C@]1(CCOC1)CO MCULE-4577771704 [0,0,0,1,0,0|2,0,0]=3 2636 B8R1.52 O=CC1(CCCC1)F MCULE-6748021302 [0,0,0,1,0,0|1,0,2]=4 2637 B8R1.52 OC1(CCNC1)CF MCULE-4156735055 [0,0,0,1,0,0|2,0,0]=3 2638 B8R1.52 OC1(CCNC1)CF MCULE-7402422167 [0,0,0,1,0,0|2,0,0]=3 2639 B8R1.52 OCC1(CCCC1)F MCULE-3500711576 [0,0,0,1,0,0|1,0,0]=2 2640 B8R1.52 OCC1(CCCC1)O MCULE-2433996412 [0,0,0,1,0,0|0,0,0]=1 2641 B8R1.52 OCC1(CCNC1)F MCULE-1926268666 [0,0,0,1,0,0|2,0,0]=3 2642 B8R1.52 OCC1(CCNC1)F MCULE-9900094466 [0,0,0,1,0,0|2,0,0]=3 2643 B8R1.52 OCC1(CCNC1)O MCULE-3674536626 [0,0,0,1,0,0|1,0,0]=2 2644 B8R1.52 OCC1(CCNC1)O MCULE-5764281061 [0,0,0,1,0,0|1,0,0]=2 2645 B8R1.52 OCC1(CCOC1)O MCULE-3033948661 [0,0,0,1,0,0|1,0,0]=2 2646 B8R1.52 OCC1(CCSC1)O MCULE-1555119227 [0,0,0,1,0,0|1,0,0]=2 2647 B8R1.52 OC[C@@]1(CCNC1)O MCULE-1108854673 [0,0,0,1,0,0|1,0,0]=2 2648 B8R1.52 OC[C@@]1(CCNC1)O MCULE-3832592153 [0,0,0,1,0,0|1,0,0]=2 2649 B8R1.52 O[C@]1(CCNC1)CF MCULE-4579275960 [0,0,0,1,0,0|2,0,0]=3 2650 B8R1.52 O[C@]1(CCNC1)CF MCULE-9755709526 [0,0,0,1,0,0|2,0,0]=3 2651 B8R1.58 CN1CCC1(C)CO MCULE-5575447175 [0,0,0,1,0,0|2,0,0]=3 2652 B8R1.58 CN1CCC1(C)CO MCULE-5625722356 [0,0,0,1,0,0|2,0,0]=3 2653 B8R1.83 CC1CC1/C(=N/O)/N MCULE-9358928072 [0,0,0,1,0,0|2,0,1]=4 2654 B8R1.83 CC1CC1C(=O)CCl MCULE-1203840849 [0,0,0,1,0,0|1,0,2]=4 2655 B8R1.83 CCC(=O)C1CC1C MCULE-4552256059 [0,0,0,1,0,0|1,0,2]=4 2656 B8R1.83 CCC(N)C1CC1C MCULE-5927058941 [0,0,0,1,0,0|2,0,0]=3 2657 B5R0.1 C#CCC(C)O MCULE-2487589857 [2,0,0,0,0,0|0,0,2]=4 2658 B5R0.1 C(C)(N)CCC MCULE-4800297905 [2,0,0,0,0,0|1,0,0]=3 2659 B5R0.1 C(C)(N)CCC MCULE-7674864567 [2,0,0,0,0,0|1,0,0]=3 2660 B5R0.1 C(C)(N)CCO MCULE-5545469271 [2,0,0,0,0,0|2,0,0]=4 2661 B5R0.1 C/C=C/C(C)O MCULE-3191147789 [2,0,0,0,0,0|0,0,2]=4 2662 B5R0.1 C=C(C)CCC MCULE-8225129744 [2,0,0,0,0,0|1,0,1]=4 2663 B5R0.1 C=CCC(C)O MCULE-7724200334 [2,0,0,0,0,0|0,0,2]=4 2664 B5R0.1 C=CCC(C)O MCULE-9910771503 [2,0,0,0,0,0|0,0,2]=4 2665 B5R0.1 C=CC[C@@H](C)O MCULE-1663575568 [2,0,0,0,0,0|0,0,2]=4 2666 B5R0.1 C=CC[C@@H](C)O MCULE-3971480179 [2,0,0,0,0,0|0,0,2]=4 2667 B5R0.1 C=CC[C@H](C)O MCULE-5783959808 [2,0,0,0,0,0|0,0,2]=4 2668 B5R0.1 C=CC[C@H](C)O MCULE-6146696600 [2,0,0,0,0,0|0,0,2]=4 2669 B5R0.1 CC#CC(C)O MCULE-5523814936 [2,0,0,0,0,0|0,0,2]=4 2670 B5R0.1 CC(Br)CCBr MCULE-1045475402 [2,0,0,0,0,0|2,0,0]=4 2671 B5R0.1 CC(C)CCBr MCULE-7163010428 [2,0,0,0,0,0|2,0,0]=4 2672 B5R0.1 CC(C)CCCl MCULE-8360122696 [2,0,0,0,0,0|2,0,0]=4 2673 B5R0.1 CC(C)CCCl MCULE-9017922949 [2,0,0,0,0,0|2,0,0]=4 2674 B5R0.1 CC(C)CCI MCULE-4934529500 [2,0,0,0,0,0|2,0,0]=4 2675 B5R0.1 CC(C)CCN MCULE-3081003576 [2,0,0,0,0,0|2,0,0]=4 2676 B5R0.1 CC(C)CCN MCULE-5118782389 [2,0,0,0,0,0|2,0,0]=4 2677 B5R0.1 CC(C)CCN MCULE-5217981670 [2,0,0,0,0,0|2,0,0]=4 2678 B5R0.1 CC(C)CCN MCULE-6280940933 [2,0,0,0,0,0|2,0,0]=4 2679 B5R0.1 CC(C)CCO MCULE-7411270401 [2,0,0,0,0,0|2,0,0]=4 2680 B5R0.1 CC(C)CCS MCULE-7115473363 [2,0,0,0,0,0|2,0,0]=4 2681 B5R0.1 CC(Cl)CCCl MCULE-3656498608 [2,0,0,0,0,0|2,0,0]=4 2682 B5R0.1 CC(Cl)CCO MCULE-1955496242 [2,0,0,0,0,0|2,0,0]=4 2683 B5R0.1 CC(F)CCBr MCULE-3035340901 [2,0,0,0,0,0|2,0,0]=4 2684 B5R0.1 CC(F)CCI MCULE-6469250150 [2,0,0,0,0,0|2,0,0]=4 2685 B5R0.1 CC(F)CCN MCULE-2805813131 [2,0,0,0,0,0|2,0,0]=4 2686 B5R0.1 CC(F)CCN MCULE-5849913362 [2,0,0,0,0,0|2,0,0]=4 2687 B5R0.1 CC(N)CCN MCULE-5308134596 [2,0,0,0,0,0|2,0,0]=4 2688 B5R0.1 CC(N)CCN MCULE-5880045507 [2,0,0,0,0,0|2,0,0]=4 2689 B5R0.1 CC(N)CCN MCULE-7827515430 [2,0,0,0,0,0|2,0,0]=4 2690 B5R0.1 CC(N)CCO MCULE-1771399942 [2,0,0,0,0,0|2,0,0]=4 2691 B5R0.1 CC(N)CCO MCULE-7239872808 [2,0,0,0,0,0|2,0,0]=4 2692 B5R0.1 CC(O)CC#N MCULE-7172428142 [2,0,0,0,0,0|1,0,1]=4 2693 B5R0.1 CC(O)CCBr MCULE-7983169885 [2,0,0,0,0,0|1,0,0]=3 2694 B5R0.1 CC(O)CCCl MCULE-2952545606 [2,0,0,0,0,0|1,0,0]=3 2695 B5R0.1 CC(O)CCN MCULE-6836791276 [2,0,0,0,0,0|1,0,0]=3 2696 B5R0.1 CC(O)CCN MCULE-7186260925 [2,0,0,0,0,0|1,0,0]=3 2697 B5R0.1 CC(O)CCO MCULE-1694239851 [2,0,0,0,0,0|1,0,0]=3 2698 B5R0.1 CC(O)CCO MCULE-7784884948 [2,0,0,0,0,0|1,0,0]=3 2699 B5R0.1 CC(O)CNN MCULE-4956670781 [2,0,0,0,0,0|2,0,0]=4 2700 B5R0.1 CC(O)CNN MCULE-7917439573 [2,0,0,0,0,0|2,0,0]=4 2701 B5R0.1 CC(O)CON MCULE-1051091134 [2,0,0,0,0,0|2,0,0]=4 2702 B5R0.1 CC(O)CON MCULE-6722092589 [2,0,0,0,0,0|2,0,0]=4 2703 B5R0.1 CC(S)CCO MCULE-5702212503 [2,0,0,0,0,0|1,1,0]=4 2704 B5R0.1 CC=CC(C)O MCULE-4806592836 [2,0,0,0,0,0|0,0,2]=4 2705 B5R0.1 CCCB(O)O MCULE-4994980798 [2,0,0,0,0,0|1,0,0]=3 2706 B5R0.1 CCCC(=O)C MCULE-7174095676 [2,0,0,0,0,0|0,0,2]=4 2707 B5R0.1 CCCC(=O)O MCULE-4116382006 [2,0,0,0,0,0|0,0,2]=4 2708 B5R0.1 CCCC(=S)O MCULE-3382199964 [2,0,0,0,0,0|0,1,1]=4 2709 B5R0.1 CCCC(C)Br MCULE-3178073667 [2,0,0,0,0,0|1,0,0]=3 2710 B5R0.1 CCCC(C)C MCULE-9604552974 [2,0,0,0,0,0|1,0,0]=3 2711 B5R0.1 CCCC(C)N MCULE-2640298430 [2,0,0,0,0,0|1,0,0]=3 2712 B5R0.1 CCCC(C)N MCULE-7225905167 [2,0,0,0,0,0|1,0,0]=3 2713 B5R0.1 CCCC(C)O MCULE-8205906299 [2,0,0,0,0,0|0,0,0]=2 2714 B5R0.1 CCCC(C)S MCULE-1649095713 [2,0,0,0,0,0|0,1,0]=3 2715 B5R0.1 CCCC(O)Cl MCULE-3188577082 [2,0,0,0,0,0|1,0,0]=3 2716 B5R0.1 CCCN(C)C MCULE-8702643596 [2,0,0,0,0,0|2,0,0]=4 2717 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [2,0,0,0,0,0|1,0,0]=3 2718 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [2,0,0,0,0,0|1,0,0]=3 2719 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [2,0,0,0,0,0|1,0,0]=3 2720 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [2,0,0,0,0,0|1,0,0]=3 2721 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [2,0,0,0,0,0|0,0,0]=2 2722 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [2,0,0,0,0,0|1,0,0]=3 2723 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [2,0,0,0,0,0|1,0,0]=3 2724 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [2,0,0,0,0,0|1,0,0]=3 2725 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [2,0,0,0,0,0|1,0,0]=3 2726 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [2,0,0,0,0,0|0,0,0]=2 2727 B5R0.1 CCNC(C)C MCULE-8064118469 [2,0,0,0,0,0|2,0,0]=4 2728 B5R0.1 CCOC(C)C MCULE-1934548340 [2,0,0,0,0,0|2,0,0]=4 2729 B5R0.1 CCOC(C)Cl MCULE-8486994638 [2,0,0,0,0,0|2,0,0]=4 2730 B5R0.1 CCSC(C)C MCULE-3738251898 [2,0,0,0,0,0|2,0,0]=4 2731 B5R0.1 CNCC(C)C MCULE-6582386339 [2,0,0,0,0,0|2,0,0]=4 2732 B5R0.1 CNCC(C)C MCULE-6856717783 [2,0,0,0,0,0|2,0,0]=4 2733 B5R0.1 CNCC(C)F MCULE-4381138647 [2,0,0,0,0,0|2,0,0]=4 2734 B5R0.1 CNCC(C)F MCULE-9018181183 [2,0,0,0,0,0|2,0,0]=4 2735 B5R0.1 CNCC(C)O MCULE-3671071529 [2,0,0,0,0,0|1,0,0]=3 2736 B5R0.1 CNCC(C)O MCULE-4171705304 [2,0,0,0,0,0|1,0,0]=3 2737 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [2,0,0,0,0,0|1,0,0]=3 2738 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [2,0,0,0,0,0|1,0,0]=3 2739 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [2,0,0,0,0,0|1,0,0]=3 2740 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [2,0,0,0,0,0|1,0,0]=3 2741 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [2,0,0,0,0,0|1,0,0]=3 2742 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [2,0,0,0,0,0|1,0,0]=3 2743 B5R0.1 COCC(C)Br MCULE-6850689931 [2,0,0,0,0,0|2,0,0]=4 2744 B5R0.1 COCC(C)I MCULE-8608265714 [2,0,0,0,0,0|2,0,0]=4 2745 B5R0.1 COCC(C)N MCULE-1896873634 [2,0,0,0,0,0|2,0,0]=4 2746 B5R0.1 COCC(C)N MCULE-2549420211 [2,0,0,0,0,0|2,0,0]=4 2747 B5R0.1 COCC(C)N MCULE-3490410444 [2,0,0,0,0,0|2,0,0]=4 2748 B5R0.1 COCC(C)N MCULE-7089888882 [2,0,0,0,0,0|2,0,0]=4 2749 B5R0.1 COCC(C)O MCULE-4022733014 [2,0,0,0,0,0|1,0,0]=3 2750 B5R0.1 COCC(C)O MCULE-7513310960 [2,0,0,0,0,0|1,0,0]=3 2751 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [2,0,0,0,0,0|2,0,0]=4 2752 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [2,0,0,0,0,0|2,0,0]=4 2753 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [2,0,0,0,0,0|2,0,0]=4 2754 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [2,0,0,0,0,0|2,0,0]=4 2755 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [2,0,0,0,0,0|1,0,0]=3 2756 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [2,0,0,0,0,0|1,0,0]=3 2757 B5R0.1 COC[C@H](C)N MCULE-2465679418 [2,0,0,0,0,0|2,0,0]=4 2758 B5R0.1 COC[C@H](C)N MCULE-2998593539 [2,0,0,0,0,0|2,0,0]=4 2759 B5R0.1 COC[C@H](C)N MCULE-3161045661 [2,0,0,0,0,0|2,0,0]=4 2760 B5R0.1 COC[C@H](C)N MCULE-9550165578 [2,0,0,0,0,0|2,0,0]=4 2761 B5R0.1 COC[C@H](C)O MCULE-5908531683 [2,0,0,0,0,0|1,0,0]=3 2762 B5R0.1 COC[C@H](C)O MCULE-8619138238 [2,0,0,0,0,0|1,0,0]=3 2763 B5R0.1 CSCC(C)N MCULE-7985946030 [2,0,0,0,0,0|2,0,0]=4 2764 B5R0.1 CSCC(C)O MCULE-2227652351 [2,0,0,0,0,0|1,0,0]=3 2765 B5R0.1 C[C@@H](N)CCO MCULE-4224878672 [2,0,0,0,0,0|2,0,0]=4 2766 B5R0.1 C[C@@H](N)CCO MCULE-5727539473 [2,0,0,0,0,0|2,0,0]=4 2767 B5R0.1 C[C@@H](O)CC#N MCULE-2879004464 [2,0,0,0,0,0|1,0,1]=4 2768 B5R0.1 C[C@@H](O)CCN MCULE-7588849994 [2,0,0,0,0,0|1,0,0]=3 2769 B5R0.1 C[C@@H](O)CCN MCULE-7895006310 [2,0,0,0,0,0|1,0,0]=3 2770 B5R0.1 C[C@@H](O)CCN MCULE-9071323255 [2,0,0,0,0,0|1,0,0]=3 2771 B5R0.1 C[C@@H](O)CCN MCULE-9627550610 [2,0,0,0,0,0|1,0,0]=3 2772 B5R0.1 C[C@@H](O)CCO MCULE-6277947442 [2,0,0,0,0,0|1,0,0]=3 2773 B5R0.1 C[C@@H](O)CCO MCULE-9742368348 [2,0,0,0,0,0|1,0,0]=3 2774 B5R0.1 C[C@@H](O)CON MCULE-3740397343 [2,0,0,0,0,0|2,0,0]=4 2775 B5R0.1 C[C@@H](O)CON MCULE-8274376872 [2,0,0,0,0,0|2,0,0]=4 2776 B5R0.1 C[C@H](N)CCO MCULE-1496375567 [2,0,0,0,0,0|2,0,0]=4 2777 B5R0.1 C[C@H](N)CCO MCULE-4744824708 [2,0,0,0,0,0|2,0,0]=4 2778 B5R0.1 C[C@H](N)CCO MCULE-7219173683 [2,0,0,0,0,0|2,0,0]=4 2779 B5R0.1 C[C@H](N)CCO MCULE-9164942837 [2,0,0,0,0,0|2,0,0]=4 2780 B5R0.1 C[C@H](O)CC#N MCULE-1968982761 [2,0,0,0,0,0|1,0,1]=4 2781 B5R0.1 C[C@H](O)CCN MCULE-7570743309 [2,0,0,0,0,0|1,0,0]=3 2782 B5R0.1 C[C@H](O)CCN MCULE-9428853702 [2,0,0,0,0,0|1,0,0]=3 2783 B5R0.1 C[C@H](O)CCO MCULE-2504912618 [2,0,0,0,0,0|1,0,0]=3 2784 B5R0.1 C[C@H](O)CCO MCULE-2958119786 [2,0,0,0,0,0|1,0,0]=3 2785 B5R0.1 C[C@H](O)CON MCULE-4216605221 [2,0,0,0,0,0|2,0,0]=4 2786 B5R0.1 C[C@H](O)CON MCULE-9863094719 [2,0,0,0,0,0|2,0,0]=4 2787 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [2,0,0,0,0,0|0,0,0]=2 2788 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [2,0,0,0,0,0|1,0,0]=3 2789 B5R0.1 [C@H](C)(O)CC#N MCULE-6894178072 [2,0,0,0,0,0|1,0,1]=4 2790 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [2,0,0,0,0,0|0,0,0]=2 2791 B5R0.2 BrCCCCBr MCULE-5088378536 [2,0,0,0,0,0|2,0,0]=4 2792 B5R0.2 C#CCCCC MCULE-5706969297 [2,0,0,0,0,0|0,0,2]=4 2793 B5R0.2 C#CCCCO MCULE-6360852809 [2,0,0,0,0,0|0,0,2]=4 2794 B5R0.2 C/C=C/CCC MCULE-9851656818 [2,0,0,0,0,0|0,0,2]=4 2795 B5R0.2 C/C=C/CCO MCULE-3952855392 [2,0,0,0,0,0|0,0,2]=4 2796 B5R0.2 C/C=C\CCC MCULE-1013657748 [2,0,0,0,0,0|0,0,2]=4 2797 B5R0.2 C=CCCCC MCULE-4750698031 [2,0,0,0,0,0|0,0,2]=4 2798 B5R0.2 C=CCCCO MCULE-5946342321 [2,0,0,0,0,0|0,0,2]=4 2799 B5R0.2 CC#CCCC MCULE-8179328151 [2,0,0,0,0,0|0,0,2]=4 2800 B5R0.2 CC#CCCO MCULE-9400138491 [2,0,0,0,0,0|0,0,2]=4 2801 B5R0.2 CC/C=C/CC MCULE-6762040186 [2,0,0,0,0,0|0,0,2]=4 2802 B5R0.2 CC/C=C\CC MCULE-9418110460 [2,0,0,0,0,0|0,0,2]=4 2803 B5R0.2 CC/C=C\CO MCULE-5480473249 [2,0,0,0,0,0|0,0,2]=4 2804 B5R0.2 CC=CCCC MCULE-8736231124 [2,0,0,0,0,0|0,0,2]=4 2805 B5R0.2 CC=CCCO MCULE-4302367089 [2,0,0,0,0,0|0,0,2]=4 2806 B5R0.2 CCC#CCC MCULE-2027962178 [2,0,0,0,0,0|0,0,2]=4 2807 B5R0.2 CCC#CCO MCULE-8633965917 [2,0,0,0,0,0|0,0,2]=4 2808 B5R0.2 CCC=CCC MCULE-5435957422 [2,0,0,0,0,0|0,0,2]=4 2809 B5R0.2 CCC=CCO MCULE-5633399984 [2,0,0,0,0,0|0,0,2]=4 2810 B5R0.2 CCCC=NO MCULE-7364375780 [2,0,0,0,0,0|1,0,1]=4 2811 B5R0.2 CCCCC#N MCULE-4015236167 [2,0,0,0,0,0|1,0,1]=4 2812 B5R0.2 CCCCC=O MCULE-4736782822 [2,0,0,0,0,0|0,0,2]=4 2813 B5R0.2 CCCCCBr MCULE-8513521912 [2,0,0,0,0,0|1,0,0]=3 2814 B5R0.2 CCCCCC MCULE-3465692202 [2,0,0,0,0,0|0,0,0]=2 2815 B5R0.2 CCCCCCl MCULE-4412759460 [2,0,0,0,0,0|1,0,0]=3 2816 B5R0.2 CCCCCF MCULE-6399883281 [2,0,0,0,0,0|1,0,0]=3 2817 B5R0.2 CCCCCI MCULE-4590300793 [2,0,0,0,0,0|1,0,0]=3 2818 B5R0.2 CCCCCN MCULE-3371742982 [2,0,0,0,0,0|1,0,0]=3 2819 B5R0.2 CCCCCN MCULE-4371067300 [2,0,0,0,0,0|1,0,0]=3 2820 B5R0.2 CCCCCN MCULE-6547961798 [2,0,0,0,0,0|1,0,0]=3 2821 B5R0.2 CCCCCN MCULE-7483248760 [2,0,0,0,0,0|1,0,0]=3 2822 B5R0.2 CCCCCO MCULE-8714292632 [2,0,0,0,0,0|0,0,0]=2 2823 B5R0.2 CCCCCS MCULE-5476379340 [2,0,0,0,0,0|0,1,0]=3 2824 B5R0.2 CCCCNC MCULE-9321610906 [2,0,0,0,0,0|1,0,0]=3 2825 B5R0.2 CCCCNN MCULE-6681305566 [2,0,0,0,0,0|2,0,0]=4 2826 B5R0.2 CCCCNN MCULE-6890760890 [2,0,0,0,0,0|2,0,0]=4 2827 B5R0.2 CCCCNN MCULE-7362497327 [2,0,0,0,0,0|2,0,0]=4 2828 B5R0.2 CCCCNN MCULE-8463623644 [2,0,0,0,0,0|2,0,0]=4 2829 B5R0.2 CCCCNO MCULE-1911206569 [2,0,0,0,0,0|1,0,0]=3 2830 B5R0.2 CCCCNO MCULE-3820646216 [2,0,0,0,0,0|1,0,0]=3 2831 B5R0.2 CCCCOC MCULE-9814272675 [2,0,0,0,0,0|1,0,0]=3 2832 B5R0.2 CCCCON MCULE-7582349983 [2,0,0,0,0,0|2,0,0]=4 2833 B5R0.2 CCCCON MCULE-8175627798 [2,0,0,0,0,0|2,0,0]=4 2834 B5R0.2 CCCCSC MCULE-2799775567 [2,0,0,0,0,0|1,0,0]=3 2835 B5R0.2 CCCNCC MCULE-7948828264 [2,0,0,0,0,0|1,0,0]=3 2836 B5R0.2 CCCNCC MCULE-9107549207 [2,0,0,0,0,0|1,0,0]=3 2837 B5R0.2 CCCOCBr MCULE-3585683043 [2,0,0,0,0,0|2,0,0]=4 2838 B5R0.2 CCCOCC MCULE-9971916790 [2,0,0,0,0,0|1,0,0]=3 2839 B5R0.2 CCCOCCl MCULE-1932627202 [2,0,0,0,0,0|2,0,0]=4 2840 B5R0.2 CCCSCC MCULE-4547385568 [2,0,0,0,0,0|1,0,0]=3 2841 B5R0.2 CCCSSC MCULE-3127072032 [2,0,0,0,0,0|2,0,0]=4 2842 B5R0.2 CCNCCCl MCULE-2589770119 [2,0,0,0,0,0|2,0,0]=4 2843 B5R0.2 CCNCCCl MCULE-3098032672 [2,0,0,0,0,0|2,0,0]=4 2844 B5R0.2 CCNCCN MCULE-7854769899 [2,0,0,0,0,0|2,0,0]=4 2845 B5R0.2 CCNCCO MCULE-2537734730 [2,0,0,0,0,0|1,0,0]=3 2846 B5R0.2 CCNCCO MCULE-3738714907 [2,0,0,0,0,0|1,0,0]=3 2847 B5R0.2 CCNNCC MCULE-4789314801 [2,0,0,0,0,0|2,0,0]=4 2848 B5R0.2 CCNNCC MCULE-9060220585 [2,0,0,0,0,0|2,0,0]=4 2849 B5R0.2 CCOCCBr MCULE-4818900555 [2,0,0,0,0,0|2,0,0]=4 2850 B5R0.2 CCOCCCl MCULE-1290576729 [2,0,0,0,0,0|2,0,0]=4 2851 B5R0.2 CCOCCI MCULE-1833092968 [2,0,0,0,0,0|2,0,0]=4 2852 B5R0.2 CCOCCN MCULE-1254431240 [2,0,0,0,0,0|2,0,0]=4 2853 B5R0.2 CCOCCN MCULE-4039110889 [2,0,0,0,0,0|2,0,0]=4 2854 B5R0.2 CCOCCN MCULE-4400456933 [2,0,0,0,0,0|2,0,0]=4 2855 B5R0.2 CCOCCO MCULE-4311513289 [2,0,0,0,0,0|1,0,0]=3 2856 B5R0.2 CCOCCS MCULE-3968740645 [2,0,0,0,0,0|1,1,0]=4 2857 B5R0.2 CCSCCBr MCULE-9449933342 [2,0,0,0,0,0|2,0,0]=4 2858 B5R0.2 CCSCCCl MCULE-4057847237 [2,0,0,0,0,0|2,0,0]=4 2859 B5R0.2 CCSCCN MCULE-3375644872 [2,0,0,0,0,0|2,0,0]=4 2860 B5R0.2 CCSCCN MCULE-4466279976 [2,0,0,0,0,0|2,0,0]=4 2861 B5R0.2 CCSCCO MCULE-3557086162 [2,0,0,0,0,0|1,0,0]=3 2862 B5R0.2 CCSCCS MCULE-4583054157 [2,0,0,0,0,0|1,1,0]=4 2863 B5R0.2 CCSSCC MCULE-7989926475 [2,0,0,0,0,0|2,0,0]=4 2864 B5R0.2 CC[Se][Se]CC MCULE-2725282576 [2,0,0,0,0,0|2,0,0]=4 2865 B5R0.2 CNCCCBr MCULE-3376600253 [2,0,0,0,0,0|2,0,0]=4 2866 B5R0.2 CNCCCBr MCULE-6212326106 [2,0,0,0,0,0|2,0,0]=4 2867 B5R0.2 CNCCCCl MCULE-1007719210 [2,0,0,0,0,0|2,0,0]=4 2868 B5R0.2 CNCCCCl MCULE-6146901643 [2,0,0,0,0,0|2,0,0]=4 2869 B5R0.2 CNCCCF MCULE-7647417887 [2,0,0,0,0,0|2,0,0]=4 2870 B5R0.2 CNCCCN MCULE-1736081896 [2,0,0,0,0,0|2,0,0]=4 2871 B5R0.2 CNCCCO MCULE-9530478547 [2,0,0,0,0,0|1,0,0]=3 2872 B5R0.2 CNCCNC MCULE-1378979868 [2,0,0,0,0,0|2,0,0]=4 2873 B5R0.2 CNCCNC MCULE-3281508478 [2,0,0,0,0,0|2,0,0]=4 2874 B5R0.2 CNCCOC MCULE-2857904484 [2,0,0,0,0,0|2,0,0]=4 2875 B5R0.2 CNCCOC MCULE-5342712496 [2,0,0,0,0,0|2,0,0]=4 2876 B5R0.2 CNCCSC MCULE-2812984399 [2,0,0,0,0,0|2,0,0]=4 2877 B5R0.2 CNCCSC MCULE-2942435951 [2,0,0,0,0,0|2,0,0]=4 2878 B5R0.2 COCCCBr MCULE-6489536401 [2,0,0,0,0,0|2,0,0]=4 2879 B5R0.2 COCCCCl MCULE-9192274624 [2,0,0,0,0,0|2,0,0]=4 2880 B5R0.2 COCCCF MCULE-5055725246 [2,0,0,0,0,0|2,0,0]=4 2881 B5R0.2 COCCCI MCULE-9111605439 [2,0,0,0,0,0|2,0,0]=4 2882 B5R0.2 COCCCN MCULE-1421362990 [2,0,0,0,0,0|2,0,0]=4 2883 B5R0.2 COCCCN MCULE-4783132205 [2,0,0,0,0,0|2,0,0]=4 2884 B5R0.2 COCCCO MCULE-4041418048 [2,0,0,0,0,0|1,0,0]=3 2885 B5R0.2 COCCCS MCULE-2371333731 [2,0,0,0,0,0|1,1,0]=4 2886 B5R0.2 COCCOC MCULE-7572196731 [2,0,0,0,0,0|2,0,0]=4 2887 B5R0.2 COCCSC MCULE-5362054021 [2,0,0,0,0,0|2,0,0]=4 2888 B5R0.2 CONCCO MCULE-9787830121 [2,0,0,0,0,0|2,0,0]=4 2889 B5R0.2 CSCCCBr MCULE-8399851816 [2,0,0,0,0,0|2,0,0]=4 2890 B5R0.2 CSCCCCl MCULE-1829120476 [2,0,0,0,0,0|2,0,0]=4 2891 B5R0.2 CSCCCN MCULE-1030938424 [2,0,0,0,0,0|2,0,0]=4 2892 B5R0.2 CSCCCN MCULE-4664984921 [2,0,0,0,0,0|2,0,0]=4 2893 B5R0.2 CSCCCO MCULE-9232413185 [2,0,0,0,0,0|1,0,0]=3 2894 B5R0.2 CSCCCS MCULE-8405766359 [2,0,0,0,0,0|1,1,0]=4 2895 B5R0.2 ClCCCCBr MCULE-7973194927 [2,0,0,0,0,0|2,0,0]=4 2896 B5R0.2 ClCCCCCl MCULE-4863501782 [2,0,0,0,0,0|2,0,0]=4 2897 B5R0.2 ClCCCCI MCULE-4303507089 [2,0,0,0,0,0|2,0,0]=4 2898 B5R0.2 FCCCCBr MCULE-8408956872 [2,0,0,0,0,0|2,0,0]=4 2899 B5R0.2 FCCCCF MCULE-1347438150 [2,0,0,0,0,0|2,0,0]=4 2900 B5R0.2 ICCCCI MCULE-1390457250 [2,0,0,0,0,0|2,0,0]=4 2901 B5R0.2 N#CCCCO MCULE-2108386837 [2,0,0,0,0,0|1,0,1]=4 2902 B5R0.2 NCCCCBr MCULE-7095299053 [2,0,0,0,0,0|2,0,0]=4 2903 B5R0.2 NCCCCBr MCULE-7716027825 [2,0,0,0,0,0|2,0,0]=4 2904 B5R0.2 NCCCCCl MCULE-8484381726 [2,0,0,0,0,0|2,0,0]=4 2905 B5R0.2 NCCCCCl MCULE-9917306082 [2,0,0,0,0,0|2,0,0]=4 2906 B5R0.2 NCCCCF MCULE-4260727945 [2,0,0,0,0,0|2,0,0]=4 2907 B5R0.2 NCCCCF MCULE-7716720921 [2,0,0,0,0,0|2,0,0]=4 2908 B5R0.2 NCCCCN MCULE-3098044935 [2,0,0,0,0,0|2,0,0]=4 2909 B5R0.2 NCCCCN MCULE-7898833229 [2,0,0,0,0,0|2,0,0]=4 2910 B5R0.2 NCCCCN MCULE-8029479697 [2,0,0,0,0,0|2,0,0]=4 2911 B5R0.2 NCCCCN MCULE-8509656776 [2,0,0,0,0,0|2,0,0]=4 2912 B5R0.2 NCCCCO MCULE-7395674091 [2,0,0,0,0,0|1,0,0]=3 2913 B5R0.2 NCCCCS MCULE-4353910418 [2,0,0,0,0,0|1,1,0]=4 2914 B5R0.2 NCCCCS MCULE-9812416858 [2,0,0,0,0,0|1,1,0]=4 2915 B5R0.2 NNCCCO MCULE-5557482626 [2,0,0,0,0,0|2,0,0]=4 2916 B5R0.2 NNCCCO MCULE-7351853032 [2,0,0,0,0,0|2,0,0]=4 2917 B5R0.2 NNCCCO MCULE-7919314403 [2,0,0,0,0,0|2,0,0]=4 2918 B5R0.2 NOCCCO MCULE-1072312935 [2,0,0,0,0,0|2,0,0]=4 2919 B5R0.2 NOCCCO MCULE-3715520109 [2,0,0,0,0,0|2,0,0]=4 2920 B5R0.2 O=CCCCO MCULE-8728420992 [2,0,0,0,0,0|1,0,1]=4 2921 B5R0.2 OCCCCBr MCULE-9231591925 [2,0,0,0,0,0|1,0,0]=3 2922 B5R0.2 OCCCCCl MCULE-3507644812 [2,0,0,0,0,0|1,0,0]=3 2923 B5R0.2 OCCCCF MCULE-9242285588 [2,0,0,0,0,0|1,0,0]=3 2924 B5R0.2 OCCCCI MCULE-8723720522 [2,0,0,0,0,0|1,0,0]=3 2925 B5R0.2 OCCCCO MCULE-2010022287 [2,0,0,0,0,0|1,0,0]=3 2926 B5R0.2 OCCCCO MCULE-6551106098 [2,0,0,0,0,0|1,0,0]=3 2927 B5R0.2 OCCCCS MCULE-8169490949 [2,0,0,0,0,0|1,0,0]=3 2928 B5R0.2 OCCNCO MCULE-2141033453 [2,0,0,0,0,0|2,0,0]=4 2929 B5R0.2 SCCCCS MCULE-6695609899 [2,0,0,0,0,0|1,1,0]=4 2930 B5R0.3 C#CC(O)CC MCULE-9890863731 [2,0,0,0,0,0|1,0,1]=4 2931 B5R0.3 C=C(CC)CO MCULE-8127766352 [2,0,0,0,0,0|1,0,1]=4 2932 B5R0.3 C=CC(O)CC MCULE-2794806228 [2,0,0,0,0,0|1,0,1]=4 2933 B5R0.3 C=CC(O)CO MCULE-6172654550 [2,0,0,0,0,0|0,0,2]=4 2934 B5R0.3 C=C[C@@H](O)CO MCULE-5957455616 [2,0,0,0,0,0|0,0,2]=4 2935 B5R0.3 C=C[C@H](O)CO MCULE-6068203844 [2,0,0,0,0,0|0,0,2]=4 2936 B5R0.3 C=C[C@H](O)CO MCULE-9367072182 [2,0,0,0,0,0|0,0,2]=4 2937 B5R0.3 CC(CN)CO MCULE-5880795484 [2,0,0,0,0,0|2,0,0]=4 2938 B5R0.3 CC(CN)CO MCULE-8083007887 [2,0,0,0,0,0|2,0,0]=4 2939 B5R0.3 CC(CO)CBr MCULE-3815333295 [2,0,0,0,0,0|2,0,0]=4 2940 B5R0.3 CC(CO)CBr MCULE-5695891877 [2,0,0,0,0,0|2,0,0]=4 2941 B5R0.3 CC(CO)CO MCULE-2340730326 [2,0,0,0,0,0|2,0,0]=4 2942 B5R0.3 CC(CO)CS MCULE-1990992504 [2,0,0,0,0,0|2,0,0]=4 2943 B5R0.3 CCC(=O)CO MCULE-8674894820 [2,0,0,0,0,0|0,0,2]=4 2944 B5R0.3 CCC(Br)CBr MCULE-5254958560 [2,0,0,0,0,0|2,0,0]=4 2945 B5R0.3 CCC(Br)CC MCULE-7435628721 [2,0,0,0,0,0|2,0,0]=4 2946 B5R0.3 CCC(Br)CO MCULE-7211805716 [2,0,0,0,0,0|1,0,0]=3 2947 B5R0.3 CCC(C)CBr MCULE-5451416952 [2,0,0,0,0,0|2,0,0]=4 2948 B5R0.3 CCC(C)CC MCULE-2542807917 [2,0,0,0,0,0|2,0,0]=4 2949 B5R0.3 CCC(C)CCl MCULE-7450386476 [2,0,0,0,0,0|2,0,0]=4 2950 B5R0.3 CCC(C)CI MCULE-5444509280 [2,0,0,0,0,0|2,0,0]=4 2951 B5R0.3 CCC(C)CN MCULE-2777327284 [2,0,0,0,0,0|2,0,0]=4 2952 B5R0.3 CCC(C)CN MCULE-7014901600 [2,0,0,0,0,0|2,0,0]=4 2953 B5R0.3 CCC(C)CO MCULE-6521026296 [2,0,0,0,0,0|1,0,0]=3 2954 B5R0.3 CCC(C)CS MCULE-7795095685 [2,0,0,0,0,0|1,1,0]=4 2955 B5R0.3 CCC(C)NO MCULE-1247092627 [2,0,0,0,0,0|2,0,0]=4 2956 B5R0.3 CCC(C)NO MCULE-6169819668 [2,0,0,0,0,0|2,0,0]=4 2957 B5R0.3 CCC(Cl)CCl MCULE-5122022797 [2,0,0,0,0,0|2,0,0]=4 2958 B5R0.3 CCC(Cl)CO MCULE-1756262629 [2,0,0,0,0,0|1,0,0]=3 2959 B5R0.3 CCC(F)CBr MCULE-3226052264 [2,0,0,0,0,0|2,0,0]=4 2960 B5R0.3 CCC(F)CN MCULE-1291385596 [2,0,0,0,0,0|2,0,0]=4 2961 B5R0.3 CCC(F)CN MCULE-7421331323 [2,0,0,0,0,0|2,0,0]=4 2962 B5R0.3 CCC(I)CC MCULE-1119844552 [2,0,0,0,0,0|2,0,0]=4 2963 B5R0.3 CCC(N)CBr MCULE-3567691924 [2,0,0,0,0,0|2,0,0]=4 2964 B5R0.3 CCC(N)CC MCULE-4261937519 [2,0,0,0,0,0|2,0,0]=4 2965 B5R0.3 CCC(N)CC MCULE-5899128891 [2,0,0,0,0,0|2,0,0]=4 2966 B5R0.3 CCC(N)CN MCULE-6911484065 [2,0,0,0,0,0|2,0,0]=4 2967 B5R0.3 CCC(N)CN MCULE-8376506697 [2,0,0,0,0,0|2,0,0]=4 2968 B5R0.3 CCC(N)CO MCULE-1135809021 [2,0,0,0,0,0|1,0,0]=3 2969 B5R0.3 CCC(N)CO MCULE-7588854111 [2,0,0,0,0,0|1,0,0]=3 2970 B5R0.3 CCC(O)C#N MCULE-5389816542 [2,0,0,0,0,0|1,0,1]=4 2971 B5R0.3 CCC(O)CBr MCULE-4205031860 [2,0,0,0,0,0|1,0,0]=3 2972 B5R0.3 CCC(O)CC MCULE-5553645045 [2,0,0,0,0,0|1,0,0]=3 2973 B5R0.3 CCC(O)CCl MCULE-8359810208 [2,0,0,0,0,0|1,0,0]=3 2974 B5R0.3 CCC(O)CN MCULE-5197026448 [2,0,0,0,0,0|1,0,0]=3 2975 B5R0.3 CCC(O)CO MCULE-2488753438 [2,0,0,0,0,0|0,0,0]=2 2976 B5R0.3 CCC(O)CO MCULE-7297282094 [2,0,0,0,0,0|0,0,0]=2 2977 B5R0.3 CCC(S)CC MCULE-2556259434 [2,0,0,0,0,0|1,1,0]=4 2978 B5R0.3 CCC(S)CS MCULE-9332449950 [2,0,0,0,0,0|0,2,0]=4 2979 B5R0.3 CCC([NH3+])CBr MCULE-6971158198 [2,0,0,0,0,0|2,0,0]=4 2980 B5R0.3 CCN(O)CC MCULE-6022935768 [2,0,0,0,0,0|2,0,0]=4 2981 B5R0.3 CC[C@@H](C)CBr MCULE-5675886072 [2,0,0,0,0,0|2,0,0]=4 2982 B5R0.3 CC[C@@H](C)CN MCULE-7612408107 [2,0,0,0,0,0|2,0,0]=4 2983 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [2,0,0,0,0,0|1,0,0]=3 2984 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [2,0,0,0,0,0|1,0,0]=3 2985 B5R0.3 CC[C@@H](N)CO MCULE-3821348404 [2,0,0,0,0,0|1,0,0]=3 2986 B5R0.3 CC[C@@H](N)CO MCULE-7190248306 [2,0,0,0,0,0|1,0,0]=3 2987 B5R0.3 CC[C@@H](O)CN MCULE-2854535153 [2,0,0,0,0,0|1,0,0]=3 2988 B5R0.3 CC[C@@H](O)CN MCULE-8228547956 [2,0,0,0,0,0|1,0,0]=3 2989 B5R0.3 CC[C@@H](O)CO MCULE-3948477298 [2,0,0,0,0,0|0,0,0]=2 2990 B5R0.3 CC[C@@H](O)CO MCULE-5098109795 [2,0,0,0,0,0|0,0,0]=2 2991 B5R0.3 CC[C@H](C)CBr MCULE-3263714447 [2,0,0,0,0,0|2,0,0]=4 2992 B5R0.3 CC[C@H](C)CBr MCULE-3384648570 [2,0,0,0,0,0|2,0,0]=4 2993 B5R0.3 CC[C@H](C)CCl MCULE-6795758745 [2,0,0,0,0,0|2,0,0]=4 2994 B5R0.3 CC[C@H](C)CCl MCULE-8147276830 [2,0,0,0,0,0|2,0,0]=4 2995 B5R0.3 CC[C@H](C)CI MCULE-9690776923 [2,0,0,0,0,0|2,0,0]=4 2996 B5R0.3 CC[C@H](C)CN MCULE-1380819951 [2,0,0,0,0,0|2,0,0]=4 2997 B5R0.3 CC[C@H](C)CN MCULE-1396096112 [2,0,0,0,0,0|2,0,0]=4 2998 B5R0.3 CC[C@H](C)CN MCULE-2971933862 [2,0,0,0,0,0|2,0,0]=4 2999 B5R0.3 CC[C@H](C)CN MCULE-3698084674 [2,0,0,0,0,0|2,0,0]=4 3000 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [2,0,0,0,0,0|1,0,0]=3 3001 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [2,0,0,0,0,0|1,0,0]=3 3002 B5R0.3 CC[C@H](N)CF MCULE-3646304583 [2,0,0,0,0,0|2,0,0]=4 3003 B5R0.3 CC[C@H](N)CF MCULE-4493834638 [2,0,0,0,0,0|2,0,0]=4 3004 B5R0.3 CC[C@H](N)CO MCULE-5500083870 [2,0,0,0,0,0|1,0,0]=3 3005 B5R0.3 CC[C@H](N)CO MCULE-6312512384 [2,0,0,0,0,0|1,0,0]=3 3006 B5R0.3 CC[C@H](O)CN MCULE-4385930741 [2,0,0,0,0,0|1,0,0]=3 3007 B5R0.3 CC[C@H](O)CO MCULE-2194264642 [2,0,0,0,0,0|0,0,0]=2 3008 B5R0.3 CC[C@H](O)CO MCULE-5503575962 [2,0,0,0,0,0|0,0,0]=2 3009 B5R0.3 CNC(C)CO MCULE-3841057780 [2,0,0,0,0,0|2,0,0]=4 3010 B5R0.3 CNC(C)CO MCULE-6474892275 [2,0,0,0,0,0|2,0,0]=4 3011 B5R0.3 CN[C@@H](C)CO MCULE-1633741835 [2,0,0,0,0,0|2,0,0]=4 3012 B5R0.3 CN[C@@H](C)CO MCULE-6736108875 [2,0,0,0,0,0|2,0,0]=4 3013 B5R0.3 CN[C@@H](C)CO MCULE-7554801630 [2,0,0,0,0,0|2,0,0]=4 3014 B5R0.3 CN[C@@H](C)CO MCULE-9312521497 [2,0,0,0,0,0|2,0,0]=4 3015 B5R0.3 CN[C@H](C)CO MCULE-2402322400 [2,0,0,0,0,0|2,0,0]=4 3016 B5R0.3 CN[C@H](C)CO MCULE-4362091386 [2,0,0,0,0,0|2,0,0]=4 3017 B5R0.3 CN[C@H](C)CO MCULE-5426855707 [2,0,0,0,0,0|2,0,0]=4 3018 B5R0.3 CN[C@H](C)CO MCULE-9777995604 [2,0,0,0,0,0|2,0,0]=4 3019 B5R0.3 COC(C)CO MCULE-5269990702 [2,0,0,0,0,0|2,0,0]=4 3020 B5R0.3 COC(C)CO MCULE-7173093332 [2,0,0,0,0,0|2,0,0]=4 3021 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [2,0,0,0,0,0|2,0,0]=4 3022 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [2,0,0,0,0,0|2,0,0]=4 3023 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [2,0,0,0,0,0|2,0,0]=4 3024 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [2,0,0,0,0,0|2,0,0]=4 3025 B5R0.3 CSC(C)CO MCULE-4646435737 [2,0,0,0,0,0|2,0,0]=4 3026 B5R0.3 C[C@@H](CN)CO MCULE-4662215148 [2,0,0,0,0,0|2,0,0]=4 3027 B5R0.3 C[C@@H](CN)CO MCULE-7870198689 [2,0,0,0,0,0|2,0,0]=4 3028 B5R0.3 C[C@@H](CO)CBr MCULE-3691541800 [2,0,0,0,0,0|2,0,0]=4 3029 B5R0.3 C[C@@H](CO)CBr MCULE-4447849056 [2,0,0,0,0,0|2,0,0]=4 3030 B5R0.3 C[C@H](CO)CBr MCULE-4031825779 [2,0,0,0,0,0|2,0,0]=4 3031 B5R0.3 C[C@H](CO)CBr MCULE-6846167456 [2,0,0,0,0,0|2,0,0]=4 3032 B5R0.3 NC(CO)CF MCULE-3756808200 [2,0,0,0,0,0|2,0,0]=4 3033 B5R0.3 NC(CO)CF MCULE-9468719402 [2,0,0,0,0,0|2,0,0]=4 3034 B5R0.3 NC(CO)CO MCULE-1559988016 [2,0,0,0,0,0|2,0,0]=4 3035 B5R0.3 NC(CO)CO MCULE-4954119952 [2,0,0,0,0,0|2,0,0]=4 3036 B5R0.3 NCC(F)CO MCULE-6156319956 [2,0,0,0,0,0|2,0,0]=4 3037 B5R0.3 NCC(F)CO MCULE-7472307328 [2,0,0,0,0,0|2,0,0]=4 3038 B5R0.3 NCC(O)CCl MCULE-1566349721 [2,0,0,0,0,0|2,0,0]=4 3039 B5R0.3 NCC(O)CCl MCULE-3532626994 [2,0,0,0,0,0|2,0,0]=4 3040 B5R0.3 NCC(O)CCl MCULE-5045913208 [2,0,0,0,0,0|2,0,0]=4 3041 B5R0.3 NCC(O)CCl MCULE-7168455596 [2,0,0,0,0,0|2,0,0]=4 3042 B5R0.3 NCC(O)CF MCULE-7529777116 [2,0,0,0,0,0|2,0,0]=4 3043 B5R0.3 NCC(O)CF MCULE-8092861019 [2,0,0,0,0,0|2,0,0]=4 3044 B5R0.3 NCC(O)CN MCULE-4689186078 [2,0,0,0,0,0|2,0,0]=4 3045 B5R0.3 NCC(O)CO MCULE-2689763818 [2,0,0,0,0,0|1,0,0]=3 3046 B5R0.3 NCC(O)CO MCULE-6096620010 [2,0,0,0,0,0|1,0,0]=3 3047 B5R0.3 NCC(O)CO MCULE-7307777212 [2,0,0,0,0,0|1,0,0]=3 3048 B5R0.3 NC[C@@H](F)CO MCULE-3273711180 [2,0,0,0,0,0|2,0,0]=4 3049 B5R0.3 NC[C@@H](F)CO MCULE-6673969522 [2,0,0,0,0,0|2,0,0]=4 3050 B5R0.3 NC[C@@H](N)CO MCULE-7333007012 [2,0,0,0,0,0|2,0,0]=4 3051 B5R0.3 NC[C@@H](N)CO MCULE-9200386635 [2,0,0,0,0,0|2,0,0]=4 3052 B5R0.3 NC[C@@H](O)CCl MCULE-1905964392 [2,0,0,0,0,0|2,0,0]=4 3053 B5R0.3 NC[C@@H](O)CCl MCULE-5592096864 [2,0,0,0,0,0|2,0,0]=4 3054 B5R0.3 NC[C@@H](O)CCl MCULE-5723497450 [2,0,0,0,0,0|2,0,0]=4 3055 B5R0.3 NC[C@@H](O)CCl MCULE-7112738263 [2,0,0,0,0,0|2,0,0]=4 3056 B5R0.3 NC[C@@H](O)CO MCULE-7897503444 [2,0,0,0,0,0|1,0,0]=3 3057 B5R0.3 NC[C@@H](O)CO MCULE-8044821624 [2,0,0,0,0,0|1,0,0]=3 3058 B5R0.3 NC[C@@H](O)CO MCULE-9443333756 [2,0,0,0,0,0|1,0,0]=3 3059 B5R0.3 NC[C@H](F)CO MCULE-2595736378 [2,0,0,0,0,0|2,0,0]=4 3060 B5R0.3 NC[C@H](F)CO MCULE-7417074078 [2,0,0,0,0,0|2,0,0]=4 3061 B5R0.3 NC[C@H](F)CO MCULE-7938231499 [2,0,0,0,0,0|2,0,0]=4 3062 B5R0.3 NC[C@H](N)CO MCULE-1060049548 [2,0,0,0,0,0|2,0,0]=4 3063 B5R0.3 NC[C@H](N)CO MCULE-9942356112 [2,0,0,0,0,0|2,0,0]=4 3064 B5R0.3 NC[C@H](O)CBr MCULE-4679771824 [2,0,0,0,0,0|2,0,0]=4 3065 B5R0.3 NC[C@H](O)CBr MCULE-4785059460 [2,0,0,0,0,0|2,0,0]=4 3066 B5R0.3 NC[C@H](O)CCl MCULE-3625478007 [2,0,0,0,0,0|2,0,0]=4 3067 B5R0.3 NC[C@H](O)CCl MCULE-6692503791 [2,0,0,0,0,0|2,0,0]=4 3068 B5R0.3 NC[C@H](O)CO MCULE-5835551322 [2,0,0,0,0,0|1,0,0]=3 3069 B5R0.3 NC[C@H](O)CO MCULE-6021133883 [2,0,0,0,0,0|1,0,0]=3 3070 B5R0.3 NC[C@H](O)CO MCULE-7461568841 [2,0,0,0,0,0|1,0,0]=3 3071 B5R0.3 NC[C@H](O)CO MCULE-8112454132 [2,0,0,0,0,0|1,0,0]=3 3072 B5R0.3 N[C@@H](CO)CF MCULE-1103631898 [2,0,0,0,0,0|2,0,0]=4 3073 B5R0.3 N[C@@H](CO)CF MCULE-1137418239 [2,0,0,0,0,0|2,0,0]=4 3074 B5R0.3 N[C@@H](CO)CF MCULE-7452275160 [2,0,0,0,0,0|2,0,0]=4 3075 B5R0.3 N[C@@H](CO)CF MCULE-9154795583 [2,0,0,0,0,0|2,0,0]=4 3076 B5R0.3 N[C@H](CO)CF MCULE-1070351343 [2,0,0,0,0,0|2,0,0]=4 3077 B5R0.3 N[C@H](CO)CF MCULE-4715788718 [2,0,0,0,0,0|2,0,0]=4 3078 B5R0.3 N[C@H](CO)CF MCULE-8220585202 [2,0,0,0,0,0|2,0,0]=4 3079 B5R0.3 N[C@H](CO)CF MCULE-8991857376 [2,0,0,0,0,0|2,0,0]=4 3080 B5R0.3 O=CC(O)CO MCULE-9581740191 [2,0,0,0,0,0|1,0,1]=4 3081 B5R0.3 O=C[C@@H](O)CO MCULE-3883857491 [2,0,0,0,0,0|1,0,1]=4 3082 B5R0.3 O=C[C@@H](O)CO MCULE-7852783182 [2,0,0,0,0,0|1,0,1]=4 3083 B5R0.3 O=C[C@H](O)CO MCULE-4574984840 [2,0,0,0,0,0|1,0,1]=4 3084 B5R0.3 OC(CBr)CBr MCULE-9071238259 [2,0,0,0,0,0|2,0,0]=4 3085 B5R0.3 OC(CCl)CBr MCULE-3844020597 [2,0,0,0,0,0|2,0,0]=4 3086 B5R0.3 OC(CCl)CCl MCULE-7873018520 [2,0,0,0,0,0|2,0,0]=4 3087 B5R0.3 OC(CCl)CI MCULE-3276637880 [2,0,0,0,0,0|2,0,0]=4 3088 B5R0.3 OC(CF)CBr MCULE-3915880352 [2,0,0,0,0,0|2,0,0]=4 3089 B5R0.3 OC(CF)CCl MCULE-6441743377 [2,0,0,0,0,0|2,0,0]=4 3090 B5R0.3 OC(CF)CF MCULE-3360341794 [2,0,0,0,0,0|2,0,0]=4 3091 B5R0.3 OC(CI)CI MCULE-6842895270 [2,0,0,0,0,0|2,0,0]=4 3092 B5R0.3 OCC(Br)CBr MCULE-9616107956 [2,0,0,0,0,0|2,0,0]=4 3093 B5R0.3 OCC(Br)CO MCULE-9272628834 [2,0,0,0,0,0|2,0,0]=4 3094 B5R0.3 OCC(Cl)CCl MCULE-2120585852 [2,0,0,0,0,0|2,0,0]=4 3095 B5R0.3 OCC(Cl)CO MCULE-7487945326 [2,0,0,0,0,0|2,0,0]=4 3096 B5R0.3 OCC(F)CBr MCULE-2889937576 [2,0,0,0,0,0|2,0,0]=4 3097 B5R0.3 OCC(F)CO MCULE-2970537690 [2,0,0,0,0,0|2,0,0]=4 3098 B5R0.3 OCC(O)CBr MCULE-9116190245 [2,0,0,0,0,0|1,0,0]=3 3099 B5R0.3 OCC(O)CCl MCULE-7895191088 [2,0,0,0,0,0|1,0,0]=3 3100 B5R0.3 OCC(O)CCl MCULE-8992242488 [2,0,0,0,0,0|1,0,0]=3 3101 B5R0.3 OCC(O)CF MCULE-3575952891 [2,0,0,0,0,0|1,0,0]=3 3102 B5R0.3 OCC(O)CF MCULE-8981430411 [2,0,0,0,0,0|1,0,0]=3 3103 B5R0.3 OCC(O)CI MCULE-6705992930 [2,0,0,0,0,0|1,0,0]=3 3104 B5R0.3 OCC(O)CO MCULE-6349111826 [2,0,0,0,0,0|1,0,0]=3 3105 B5R0.3 OCC(O)CS MCULE-6300188207 [2,0,0,0,0,0|1,0,0]=3 3106 B5R0.3 OCC(S)CS MCULE-9735516119 [2,0,0,0,0,0|1,1,0]=4 3107 B5R0.3 OC[C@@H](O)CCl MCULE-1311776512 [2,0,0,0,0,0|1,0,0]=3 3108 B5R0.3 OC[C@@H](O)CCl MCULE-2685107404 [2,0,0,0,0,0|1,0,0]=3 3109 B5R0.3 OC[C@@H](O)CF MCULE-3274443966 [2,0,0,0,0,0|1,0,0]=3 3110 B5R0.3 OC[C@@H](O)CF MCULE-5908395855 [2,0,0,0,0,0|1,0,0]=3 3111 B5R0.3 OC[C@H](O)CBr MCULE-5035020863 [2,0,0,0,0,0|1,0,0]=3 3112 B5R0.3 OC[C@H](O)CCl MCULE-2098232262 [2,0,0,0,0,0|1,0,0]=3 3113 B5R0.3 OC[C@H](O)CCl MCULE-5801605349 [2,0,0,0,0,0|1,0,0]=3 3114 B5R0.3 OC[C@H](O)CF MCULE-3309672397 [2,0,0,0,0,0|1,0,0]=3 3115 B5R0.3 OC[C@H](O)CF MCULE-7695783253 [2,0,0,0,0,0|1,0,0]=3 3116 B5R0.3 O[C@@H](CCl)CI MCULE-5324720097 [2,0,0,0,0,0|2,0,0]=4 3117 B5R0.3 O[C@H](CCl)CI MCULE-2790157830 [2,0,0,0,0,0|2,0,0]=4 3118 B5R0.3 [C@H](O)(CN)CCl MCULE-1220791610 [2,0,0,0,0,0|2,0,0]=4 3119 B5R0.3 [C@H](O)(CN)CCl MCULE-4106901858 [2,0,0,0,0,0|2,0,0]=4 3120 B7R0.2 C#CC(O)CC(C)C MCULE-1610080651 [1,1,0,0,0,0|1,0,1]=4 3121 B7R0.2 C=C(C)CC(N)CO MCULE-9114906744 [1,1,0,0,0,0|1,0,1]=4 3122 B7R0.2 C=CC(O)CC(C)C MCULE-7389371130 [1,1,0,0,0,0|1,0,1]=4 3123 B7R0.2 CC(C)CC(C)CBr MCULE-6800285380 [1,1,0,0,0,0|2,0,0]=4 3124 B7R0.2 CC(C)CC(C)CO MCULE-5856507691 [1,1,0,0,0,0|1,0,0]=3 3125 B7R0.2 CC(C)CC(N)CF MCULE-3937400151 [1,1,0,0,0,0|2,0,0]=4 3126 B7R0.2 CC(C)CC(N)CF MCULE-7951827838 [1,1,0,0,0,0|2,0,0]=4 3127 B7R0.2 CC(C)CC(N)CN MCULE-3441513735 [1,1,0,0,0,0|2,0,0]=4 3128 B7R0.2 CC(C)CC(N)CO MCULE-6347344178 [1,1,0,0,0,0|1,0,0]=3 3129 B7R0.2 CC(C)CC(N)CO MCULE-7024759986 [1,1,0,0,0,0|1,0,0]=3 3130 B7R0.2 CC(C)CC(N)CS MCULE-8932651812 [1,1,0,0,0,0|1,1,0]=4 3131 B7R0.2 CC(C)CC(O)C#N MCULE-7308674465 [1,1,0,0,0,0|1,0,1]=4 3132 B7R0.2 CC(C)CC(O)CN MCULE-9414833333 [1,1,0,0,0,0|1,0,0]=3 3133 B7R0.2 CC(C)CC(O)CN MCULE-9784331526 [1,1,0,0,0,0|1,0,0]=3 3134 B7R0.2 CC(C)C[C@@H](N)CBr MCULE-4869966214 [1,1,0,0,0,0|2,0,0]=4 3135 B7R0.2 CC(C)C[C@@H](N)CO MCULE-1979401982 [1,1,0,0,0,0|1,0,0]=3 3136 B7R0.2 CC(C)C[C@@H](N)CO MCULE-3025407298 [1,1,0,0,0,0|1,0,0]=3 3137 B7R0.2 CC(C)C[C@H](N)CBr MCULE-4224057266 [1,1,0,0,0,0|2,0,0]=4 3138 B7R0.2 CC(C)C[C@H](N)CO MCULE-2790872575 [1,1,0,0,0,0|1,0,0]=3 3139 B7R0.2 CC(C)C[C@H](N)CO MCULE-9198147139 [1,1,0,0,0,0|1,0,0]=3 3140 B7R0.2 CC(CO)CC(F)F MCULE-1470130605 [1,1,0,0,0,0|2,0,0]=4 3141 B7R0.2 CC(CO)CN(C)C MCULE-3103307387 [1,1,0,0,0,0|2,0,0]=4 3142 B7R0.2 CC(O)CC(C)CN MCULE-3086796159 [1,1,0,0,0,0|2,0,0]=4 3143 B7R0.2 CCC(C)CC(C)C MCULE-9492683095 [1,1,0,0,0,0|2,0,0]=4 3144 B7R0.2 CCC(C)CC(C)N MCULE-2633957870 [1,1,0,0,0,0|2,0,0]=4 3145 B7R0.2 CCC(C)CC(C)N MCULE-5740038174 [1,1,0,0,0,0|2,0,0]=4 3146 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [1,1,0,0,0,0|2,0,0]=4 3147 B7R0.2 CCC(O)CC(=O)C MCULE-1222748729 [1,1,0,0,0,0|1,0,1]=4 3148 B7R0.2 CCC(O)CC(C)O MCULE-3115543235 [1,1,0,0,0,0|1,0,0]=3 3149 B7R0.2 CCC(O)CN(C)C MCULE-5823673760 [1,1,0,0,0,0|2,0,0]=4 3150 B7R0.2 CN(C)CC(N)CO MCULE-2789134862 [1,1,0,0,0,0|2,0,0]=4 3151 B7R0.2 CN(C)CC(N)CO MCULE-4090276677 [1,1,0,0,0,0|2,0,0]=4 3152 B7R0.2 CN(C)CC(O)CCl MCULE-3657515294 [1,1,0,0,0,0|2,0,0]=4 3153 B7R0.2 CN(C)CC(O)CCl MCULE-8459273595 [1,1,0,0,0,0|2,0,0]=4 3154 B7R0.2 CN(C)CC(O)CN MCULE-7476161270 [1,1,0,0,0,0|2,0,0]=4 3155 B7R0.2 CN(C)CC(O)CN MCULE-8533203733 [1,1,0,0,0,0|2,0,0]=4 3156 B7R0.2 CN(C)CC(O)CO MCULE-3436894516 [1,1,0,0,0,0|1,0,0]=3 3157 B7R0.2 CN(C)C[C@@H](O)CO MCULE-7101033572 [1,1,0,0,0,0|1,0,0]=3 3158 B7R0.2 CN(C)C[C@H](O)CO MCULE-4297947949 [1,1,0,0,0,0|1,0,0]=3 3159 B7R0.2 NC(CO)CC(F)F MCULE-5033329865 [1,1,0,0,0,0|2,0,0]=4 3160 B7R0.2 NC(CO)CC(F)F MCULE-6986507912 [1,1,0,0,0,0|2,0,0]=4 3161 B7R0.2 O=C(O)CC(O)CO MCULE-2851149196 [1,1,0,0,0,0|1,0,1]=4 3162 B7R0.2 O=C(O)C[C@H](O)CO MCULE-5671818548 [1,1,0,0,0,0|1,0,1]=4 3163 B7R0.2 O=C([O-])CC(O)CO MCULE-5202762172 [1,1,0,0,0,0|1,0,1]=4 3164 B7R0.2 O=C([O-])CC(O)CO MCULE-6219855770 [1,1,0,0,0,0|1,0,1]=4 3165 B7R0.5 CC(C)C(O)CCCl MCULE-3510291624 [1,1,0,0,0,0|2,0,0]=4 3166 B7R0.5 CC(C)C(O)CCN MCULE-2039463209 [1,1,0,0,0,0|2,0,0]=4 3167 B7R0.5 CC(C)C(O)CCN MCULE-2941304015 [1,1,0,0,0,0|2,0,0]=4 3168 B7R0.5 CC(C)C(O)CCO MCULE-8819967893 [1,1,0,0,0,0|2,0,0]=4 3169 B7R0.5 CC(C)[C@H](O)CCN MCULE-1853419872 [1,1,0,0,0,0|2,0,0]=4 3170 B7R0.5 CC(C)[C@H](O)CCN MCULE-1886424228 [1,1,0,0,0,0|2,0,0]=4 3171 B7R0.5 CC(C)[C@H](O)CCN MCULE-7762475170 [1,1,0,0,0,0|2,0,0]=4 3172 B7R0.5 CC(C)[C@H](O)CCN MCULE-8675177820 [1,1,0,0,0,0|2,0,0]=4 3173 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [1,1,0,0,0,0|1,0,1]=4 3174 B7R0.5 CCCC(Br)C(C)Br MCULE-4740207556 [1,1,0,0,0,0|2,0,0]=4 3175 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [1,1,0,0,0,0|1,0,1]=4 3176 B7R0.5 CCCC(C)C(C)C MCULE-1008931357 [1,1,0,0,0,0|2,0,0]=4 3177 B7R0.5 CCCC(C)C(C)N MCULE-3555650010 [1,1,0,0,0,0|2,0,0]=4 3178 B7R0.5 CCCC(C)C(C)N MCULE-8637319249 [1,1,0,0,0,0|2,0,0]=4 3179 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [1,1,0,0,0,0|1,0,0]=3 3180 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [1,1,0,0,0,0|1,0,1]=4 3181 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [1,1,0,0,0,0|1,0,1]=4 3182 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [1,1,0,0,0,0|1,0,1]=4 3183 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [1,1,0,0,0,0|1,0,1]=4 3184 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [1,1,0,0,0,0|1,0,1]=4 3185 B7R0.5 CCCC(O)C(=O)N MCULE-3143432132 [1,1,0,0,0,0|0,0,2]=4 3186 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [1,1,0,0,0,0|0,0,1]=3 3187 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [1,1,0,0,0,0|0,0,1]=3 3188 B7R0.5 CCCC(O)C(C)C MCULE-8942406791 [1,1,0,0,0,0|1,0,0]=3 3189 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [1,1,0,0,0,0|1,0,1]=4 3190 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [1,1,0,0,0,0|1,0,1]=4 3191 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [1,1,0,0,0,0|0,0,1]=3 3192 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [1,1,0,0,0,0|1,0,1]=4 3193 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [1,1,0,0,0,0|1,0,1]=4 3194 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [1,1,0,0,0,0|1,0,1]=4 3195 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [1,1,0,0,0,0|1,0,1]=4 3196 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [1,1,0,0,0,0|0,0,1]=3 3197 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [1,1,0,0,0,0|0,0,1]=3 3198 B7R0.5 CCOC(O)C(F)F MCULE-2123177092 [1,1,0,0,0,0|2,0,0]=4 3199 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [1,1,0,0,0,0|1,0,1]=4 3200 B7R0.5 COCC(O)C(C)C MCULE-3818851772 [1,1,0,0,0,0|2,0,0]=4 3201 B7R0.5 NCCC(O)C(=O)O MCULE-3670080484 [1,1,0,0,0,0|1,0,1]=4 3202 B7R0.5 NCCC(O)C(=O)O MCULE-6540935279 [1,1,0,0,0,0|1,0,1]=4 3203 B7R0.5 NCCC(O)C(F)F MCULE-7251767327 [1,1,0,0,0,0|2,0,0]=4 3204 B7R0.5 NCC[C@@H](O)C(=O)O MCULE-9726912888 [1,1,0,0,0,0|1,0,1]=4 3205 B7R0.5 NCC[C@H](O)C(=O)O MCULE-3296998083 [1,1,0,0,0,0|1,0,1]=4 3206 B7R0.5 NCC[C@H](O)C(=O)O MCULE-7901866019 [1,1,0,0,0,0|1,0,1]=4 3207 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [1,1,0,0,0,0|1,0,1]=4 3208 B7R0.7 C#CC[C@@H](O)COC MCULE-5751153207 [1,1,0,0,0,0|0,0,2]=4 3209 B7R0.7 C#CC[C@H](O)COC MCULE-1465786417 [1,1,0,0,0,0|0,0,2]=4 3210 B7R0.7 C=C(CCC)CCO MCULE-1774943854 [1,1,0,0,0,0|1,0,1]=4 3211 B7R0.7 C=CCC(O)CCC MCULE-4006607391 [1,1,0,0,0,0|1,0,0]=3 3212 B7R0.7 CC(CCN)CCO MCULE-7864092529 [1,1,0,0,0,0|2,0,0]=4 3213 B7R0.7 CC(CCO)CCO MCULE-5426211201 [1,1,0,0,0,0|2,0,0]=4 3214 B7R0.7 CC=CC(O)CCC MCULE-2375824505 [1,1,0,0,0,0|1,0,1]=4 3215 B7R0.7 CCCC(Br)CCBr MCULE-7954993658 [1,1,0,0,0,0|2,0,0]=4 3216 B7R0.7 CCCC(Br)CCC MCULE-4124374663 [1,1,0,0,0,0|2,0,0]=4 3217 B7R0.7 CCCC(C)CCC MCULE-5291190768 [1,1,0,0,0,0|2,0,0]=4 3218 B7R0.7 CCCC(C)CCO MCULE-6887128167 [1,1,0,0,0,0|1,0,0]=3 3219 B7R0.7 CCCC(C)NCC MCULE-3443551812 [1,1,0,0,0,0|2,0,0]=4 3220 B7R0.7 CCCC(C)NCC MCULE-7227087576 [1,1,0,0,0,0|2,0,0]=4 3221 B7R0.7 CCCC(C)OCC MCULE-2678814077 [1,1,0,0,0,0|2,0,0]=4 3222 B7R0.7 CCCC(N)CCC MCULE-1003038397 [1,1,0,0,0,0|2,0,0]=4 3223 B7R0.7 CCCC(N)CCC MCULE-3454953409 [1,1,0,0,0,0|2,0,0]=4 3224 B7R0.7 CCCC(N)CCO MCULE-3641094890 [1,1,0,0,0,0|1,0,0]=3 3225 B7R0.7 CCCC(N)CCO MCULE-5323991138 [1,1,0,0,0,0|1,0,0]=3 3226 B7R0.7 CCCC(N)CCO MCULE-6597027417 [1,1,0,0,0,0|1,0,0]=3 3227 B7R0.7 CCCC(N)CCO MCULE-8093709628 [1,1,0,0,0,0|1,0,0]=3 3228 B7R0.7 CCCC(O)CCC MCULE-1942797307 [1,1,0,0,0,0|1,0,0]=3 3229 B7R0.7 CCCC(O)CCN MCULE-3796998426 [1,1,0,0,0,0|1,0,0]=3 3230 B7R0.7 CCCC(O)CCO MCULE-6957178966 [1,1,0,0,0,0|0,0,0]=2 3231 B7R0.7 CCCC(S)CCC MCULE-4775274873 [1,1,0,0,0,0|1,1,0]=4 3232 B7R0.7 CCCC(S)CCO MCULE-7972451905 [1,1,0,0,0,0|0,1,0]=3 3233 B7R0.7 CCC[C@@H](N)CCO MCULE-1862127512 [1,1,0,0,0,0|1,0,0]=3 3234 B7R0.7 CCC[C@@H](N)CCO MCULE-3031366486 [1,1,0,0,0,0|1,0,0]=3 3235 B7R0.7 CCC[C@@H](N)CCO MCULE-4433535200 [1,1,0,0,0,0|1,0,0]=3 3236 B7R0.7 CCC[C@@H](N)CCO MCULE-8325506694 [1,1,0,0,0,0|1,0,0]=3 3237 B7R0.7 CCC[C@H](N)CCO MCULE-3164100995 [1,1,0,0,0,0|1,0,0]=3 3238 B7R0.7 CCC[C@H](N)CCO MCULE-3262978007 [1,1,0,0,0,0|1,0,0]=3 3239 B7R0.7 CCC[C@H](N)CCO MCULE-3382311889 [1,1,0,0,0,0|1,0,0]=3 3240 B7R0.7 CCC[C@H](N)CCO MCULE-4865013919 [1,1,0,0,0,0|1,0,0]=3 3241 B7R0.7 CCNC(C)CCO MCULE-5904294074 [1,1,0,0,0,0|2,0,0]=4 3242 B7R0.7 CCNC(C)COC MCULE-3519332383 [1,1,0,0,0,0|2,0,0]=4 3243 B7R0.7 CCNC(C)COC MCULE-9226487666 [1,1,0,0,0,0|2,0,0]=4 3244 B7R0.7 CNCC(O)CNC MCULE-3978089543 [1,1,0,0,0,0|2,0,0]=4 3245 B7R0.7 CNCC(O)COC MCULE-8497493216 [1,1,0,0,0,0|1,0,0]=3 3246 B7R0.7 COCC(Br)COC MCULE-8590528928 [1,1,0,0,0,0|2,0,0]=4 3247 B7R0.7 COCC(C)CCO MCULE-6812981556 [1,1,0,0,0,0|2,0,0]=4 3248 B7R0.7 COCC(Cl)COC MCULE-1871071718 [1,1,0,0,0,0|2,0,0]=4 3249 B7R0.7 COCC(N)CCO MCULE-2569422233 [1,1,0,0,0,0|2,0,0]=4 3250 B7R0.7 COCC(N)COC MCULE-3531117264 [1,1,0,0,0,0|2,0,0]=4 3251 B7R0.7 COCC(N)COC MCULE-3609597955 [1,1,0,0,0,0|2,0,0]=4 3252 B7R0.7 COCC(O)CCN MCULE-9524454931 [1,1,0,0,0,0|1,0,0]=3 3253 B7R0.7 COCC(O)COC MCULE-5364514636 [1,1,0,0,0,0|1,0,0]=3 3254 B7R0.7 COCC(O)CON MCULE-3159534337 [1,1,0,0,0,0|1,0,0]=3 3255 B7R0.7 CSCC(N)CCO MCULE-2899374338 [1,1,0,0,0,0|2,0,0]=4 3256 B7R0.7 CSCC(O)CNN MCULE-9232488868 [1,1,0,0,0,0|2,0,0]=4 3257 B7R0.7 OCCC(O)CCO MCULE-1162803524 [1,1,0,0,0,0|1,0,0]=3 3258 B7R0.10 CC(CN)C(N)CO MCULE-1520376315 [1,1,0,0,0,0|2,0,0]=4 3259 B7R0.10 CC(CN)[C@H](N)CO MCULE-9250442888 [1,1,0,0,0,0|2,0,0]=4 3260 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [1,1,0,0,0,0|1,0,1]=4 3261 B7R0.10 CCC(C)C(C)CC MCULE-8164178184 [1,1,0,0,0,0|2,0,0]=4 3262 B7R0.10 CCC(C)C(N)CO MCULE-3990781918 [1,1,0,0,0,0|1,0,0]=3 3263 B7R0.10 CCC(C)C(N)CO MCULE-9261445768 [1,1,0,0,0,0|1,0,0]=3 3264 B7R0.10 CCC(C)C(O)CC MCULE-3936368693 [1,1,0,0,0,0|1,0,0]=3 3265 B7R0.10 CCC(C)C(O)CN MCULE-1941564207 [1,1,0,0,0,0|1,0,0]=3 3266 B7R0.10 CCC(C)C(O)CO MCULE-9999862073 [1,1,0,0,0,0|0,0,0]=2 3267 B7R0.10 CCC(N)C(O)CC MCULE-3578258801 [1,1,0,0,0,0|1,0,0]=3 3268 B7R0.10 CCC(O)C(C)CO MCULE-3930931405 [1,1,0,0,0,0|1,0,0]=3 3269 B7R0.10 CCC(O)C(C)CO MCULE-4472852672 [1,1,0,0,0,0|1,0,0]=3 3270 B7R0.10 CCC(S)C(C)CO MCULE-1500370684 [1,1,0,0,0,0|1,0,0]=3 3271 B7R0.10 CCN(C)C(C)CO MCULE-3647031998 [1,1,0,0,0,0|2,0,0]=4 3272 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-2122638055 [1,1,0,0,0,0|1,0,0]=3 3273 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-7964651759 [1,1,0,0,0,0|1,0,0]=3 3274 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-8482653298 [1,1,0,0,0,0|1,0,0]=3 3275 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-3409941550 [1,1,0,0,0,0|2,0,0]=4 3276 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-9750756690 [1,1,0,0,0,0|2,0,0]=4 3277 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-3647332227 [1,1,0,0,0,0|1,0,0]=3 3278 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-5774547825 [1,1,0,0,0,0|1,0,0]=3 3279 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8401203397 [1,1,0,0,0,0|1,0,0]=3 3280 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8452836661 [1,1,0,0,0,0|1,0,0]=3 3281 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-9307589673 [1,1,0,0,0,0|1,0,0]=3 3282 B7R0.10 COC(=O)C(O)CO MCULE-1234820163 [1,1,0,0,0,0|1,0,1]=4 3283 B7R0.10 COC(=O)C(O)CO MCULE-2142801284 [1,1,0,0,0,0|1,0,1]=4 3284 B7R0.10 COC(=O)[C@@H](O)CO MCULE-3655137528 [1,1,0,0,0,0|1,0,1]=4 3285 B7R0.10 COC(=O)[C@@H](O)CO MCULE-5801355812 [1,1,0,0,0,0|1,0,1]=4 3286 B7R0.10 COC(=O)[C@H](O)CO MCULE-4219956218 [1,1,0,0,0,0|1,0,1]=4 3287 B7R0.10 COC(=O)[C@H](O)CO MCULE-8891571940 [1,1,0,0,0,0|1,0,1]=4 3288 B7R0.10 NC[C@H](O)[C@H](O)CN MCULE-1073397630 [1,1,0,0,0,0|2,0,0]=4 3289 B7R0.10 NC[C@H](O)[C@H](O)CN MCULE-8068595970 [1,1,0,0,0,0|2,0,0]=4 3290 B7R0.10 N[C@@H](CO)[C@@H](N)CO MCULE-2394488011 [1,1,0,0,0,0|2,0,0]=4 3291 B7R0.10 O=C(CO)C(O)CO MCULE-9818197491 [1,1,0,0,0,0|1,0,1]=4 3292 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8306776225 [1,1,0,0,0,0|1,0,1]=4 3293 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8666498937 [1,1,0,0,0,0|1,0,1]=4 3294 B7R0.10 O=C(CO)[C@H](O)CO MCULE-7828531161 [1,1,0,0,0,0|1,0,1]=4 3295 B7R0.10 O=CC(O)C(O)CO MCULE-9564469242 [1,1,0,0,0,0|1,0,1]=4 3296 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-3532911413 [1,1,0,0,0,0|1,0,1]=4 3297 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-5707669784 [1,1,0,0,0,0|1,0,1]=4 3298 B7R0.10 O=C[C@@H](O)[C@H](O)CO MCULE-4902023669 [1,1,0,0,0,0|1,0,1]=4 3299 B7R0.10 O=C[C@H](O)[C@@H](O)CO MCULE-5975565699 [1,1,0,0,0,0|1,0,1]=4 3300 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-3036594515 [1,1,0,0,0,0|1,0,1]=4 3301 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-5412566780 [1,1,0,0,0,0|1,0,1]=4 3302 B7R0.10 OC(CBr)C(O)CBr MCULE-4608370293 [1,1,0,0,0,0|2,0,0]=4 3303 B7R0.10 OC(CCl)C(O)CCl MCULE-9282587936 [1,1,0,0,0,0|2,0,0]=4 3304 B7R0.10 OC(CS)C(O)CS MCULE-7432075835 [1,1,0,0,0,0|1,1,0]=4 3305 B7R0.10 OCC(Br)C(Br)CO MCULE-4593943249 [1,1,0,0,0,0|2,0,0]=4 3306 B7R0.10 OCC(O)C(O)CO MCULE-9009953851 [1,1,0,0,0,0|1,0,0]=3 3307 B7R0.10 OC[C@@H](Br)[C@H](Br)CO MCULE-7293448690 [1,1,0,0,0,0|2,0,0]=4 3308 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-1593828237 [1,1,0,0,0,0|1,0,0]=3 3309 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-7577661973 [1,1,0,0,0,0|1,0,0]=3 3310 B7R0.10 OC[C@@H](O)[C@H](S)CS MCULE-1423721945 [1,1,0,0,0,0|1,0,0]=3 3311 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-7306394407 [1,1,0,0,0,0|1,0,0]=3 3312 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-8013265935 [1,1,0,0,0,0|1,0,0]=3 3313 B7R0.10 OC[C@H](O)[C@H](O)CO MCULE-6886999157 [1,1,0,0,0,0|1,0,0]=3 3314 B7R0.10 O[C@@H](CS)[C@@H](O)CS MCULE-6947486648 [1,1,0,0,0,0|1,1,0]=4 3315 B7R0.10 O[C@@H](CS)[C@@H](O)CS MCULE-8883019394 [1,1,0,0,0,0|1,1,0]=4 3316 B7R0.10 O[C@H](CBr)[C@H](O)CBr MCULE-5914686116 [1,1,0,0,0,0|2,0,0]=4 3317 B7R0.10 O[C@H](CCl)[C@@H](O)CCl MCULE-8266433235 [1,1,0,0,0,0|2,0,0]=4 3318 B7R0.10 O[C@H](CS)[C@@H](O)CS MCULE-3618084743 [1,1,0,0,0,0|1,1,0]=4 3319 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-3329450277 [1,1,0,0,0,0|1,1,0]=4 3320 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-9065556670 [1,1,0,0,0,0|1,1,0]=4 3321 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-9666091728 [1,1,0,0,0,0|1,1,0]=4 3322 B7R0.10 [C@@H](C)(CC)[C@@H](N)CO MCULE-4423825378 [1,1,0,0,0,0|1,0,0]=3 3323 B7R0.11 C#CC(C)(O)CCC MCULE-3734924257 [1,1,0,0,0,0|1,0,1]=4 3324 B7R0.11 CC(C)(CO)CCN MCULE-5221703852 [1,1,0,0,0,0|2,0,0]=4 3325 B7R0.11 CC(C)(CO)CCN MCULE-7380535368 [1,1,0,0,0,0|2,0,0]=4 3326 B7R0.11 CC(C)(CO)CCO MCULE-1756560398 [1,1,0,0,0,0|2,0,0]=4 3327 B7R0.11 CC(N)(CO)CCF MCULE-5569472665 [1,1,0,0,0,0|2,0,0]=4 3328 B7R0.11 CC(O)(CO)CCO MCULE-4148316300 [1,1,0,0,0,0|1,0,0]=3 3329 B7R0.11 CCC(C)(O)CCO MCULE-6173398477 [1,1,0,0,0,0|2,0,0]=4 3330 B7R0.11 CCCC(C)(C)CC MCULE-6673337989 [1,1,0,0,0,0|2,0,0]=4 3331 B7R0.11 CCCC(C)(N)CN MCULE-3215432035 [1,1,0,0,0,0|2,0,0]=4 3332 B7R0.11 CCCC(C)(N)CO MCULE-9180767555 [1,1,0,0,0,0|1,0,0]=3 3333 B7R0.11 CCCC(C)(O)C#N MCULE-3772295069 [1,1,0,0,0,0|1,0,1]=4 3334 B7R0.11 CCCC(C)(O)CC MCULE-9155096022 [1,1,0,0,0,0|1,0,0]=3 3335 B7R0.11 CCCC(C)(O)CN MCULE-4716937953 [1,1,0,0,0,0|1,0,0]=3 3336 B7R0.11 CCCC(C)(O)CO MCULE-3737630396 [1,1,0,0,0,0|0,0,0]=2 3337 B7R0.11 CCNC(C)(C)CO MCULE-9120392867 [1,1,0,0,0,0|2,0,0]=4 3338 B7R0.11 CCNC(C)(C)CO MCULE-9465450982 [1,1,0,0,0,0|2,0,0]=4 3339 B7R0.11 CCOC(C)(C)CO MCULE-6294474255 [1,1,0,0,0,0|2,0,0]=4 3340 B7R0.11 CCO[C@](C)(O)CO MCULE-2547633573 [1,1,0,0,0,0|1,0,0]=3 3341 B7R0.11 CNCC(C)(C)CO MCULE-1912751262 [1,1,0,0,0,0|2,0,0]=4 3342 B7R0.11 CNCC(F)(F)CO MCULE-2629238823 [1,1,0,0,0,0|2,0,0]=4 3343 B7R0.11 COCC(C)(C)CO MCULE-2985367717 [1,1,0,0,0,0|2,0,0]=4 3344 B7R0.11 COCC(C)(N)CO MCULE-2603485329 [1,1,0,0,0,0|2,0,0]=4 3345 B7R0.11 COCC(C)(N)CO MCULE-3416999559 [1,1,0,0,0,0|2,0,0]=4 3346 B7R0.11 COCC(C)(O)CN MCULE-8403551049 [1,1,0,0,0,0|2,0,0]=4 3347 B7R0.11 COCC(C)(O)CN MCULE-8479817538 [1,1,0,0,0,0|2,0,0]=4 3348 B7R0.11 COCC(F)(F)CO MCULE-7603400715 [1,1,0,0,0,0|2,0,0]=4 3349 B7R0.11 CSCC(C)(C)CO MCULE-4089291196 [1,1,0,0,0,0|2,0,0]=4 3350 B7R0.11 CSCC(C)(O)CN MCULE-7935135383 [1,1,0,0,0,0|2,0,0]=4 3351 B7R0.11 OCCC(F)(F)CO MCULE-9524877710 [1,1,0,0,0,0|2,0,0]=4 3352 B7R0.12 C=CCC(CO)CO MCULE-4178696072 [1,1,0,0,0,0|0,0,2]=4 3353 B7R0.12 CCCC(C#N)OC MCULE-8004262029 [1,1,0,0,0,0|1,0,1]=4 3354 B7R0.12 CCCC(CN)OC MCULE-6456891707 [1,1,0,0,0,0|1,0,0]=3 3355 B7R0.12 CCCC(CO)CO MCULE-2372919180 [1,1,0,0,0,0|0,0,0]=2 3356 B7R0.12 CCCC(CO)OC MCULE-9427398002 [1,1,0,0,0,0|0,0,0]=2 3357 B7R0.12 CCCC(OC)OC MCULE-9755419351 [1,1,0,0,0,0|2,0,0]=4 3358 B7R0.12 CCNC(CC)CO MCULE-2240229411 [1,1,0,0,0,0|2,0,0]=4 3359 B7R0.12 CCN[C@@H](CC)CO MCULE-3793090402 [1,1,0,0,0,0|2,0,0]=4 3360 B7R0.12 CCN[C@@H](CC)CO MCULE-7960570694 [1,1,0,0,0,0|2,0,0]=4 3361 B7R0.12 CCOC(CO)CBr MCULE-3004663873 [1,1,0,0,0,0|2,0,0]=4 3362 B7R0.12 COC(CN)CCN MCULE-6044078562 [1,1,0,0,0,0|2,0,0]=4 3363 B7R0.12 COC(CO)CCN MCULE-1177905249 [1,1,0,0,0,0|1,0,0]=3 3364 B7R0.12 COCC(CBr)OC MCULE-9551672317 [1,1,0,0,0,0|2,0,0]=4 3365 B7R0.12 COCC(CN)OC MCULE-4660699329 [1,1,0,0,0,0|2,0,0]=4 3366 B7R0.12 COCC(CO)OC MCULE-6775038884 [1,1,0,0,0,0|1,0,0]=3 3367 B7R0.12 COC[C@@H](CO)OC MCULE-7098934437 [1,1,0,0,0,0|1,0,0]=3 3368 B7R0.12 COC[C@H](CN)OC MCULE-7911151873 [1,1,0,0,0,0|2,0,0]=4 3369 B7R0.12 NCCC(CO)CO MCULE-7028267284 [1,1,0,0,0,0|1,0,0]=3 3370 B7R0.12 NCCC(CO)CO MCULE-8865812482 [1,1,0,0,0,0|1,0,0]=3 3371 B7R0.12 OCCC(CO)CO MCULE-7198799967 [1,1,0,0,0,0|1,0,0]=3 3372 B7R0.4 C#CCCCC(C)O MCULE-7136902430 [1,1,0,0,0,0|0,0,1]=3 3373 B7R0.4 C#CCCC[C@@H](C)O MCULE-3650631732 [1,1,0,0,0,0|0,0,1]=3 3374 B7R0.4 C#CCOCC(C)O MCULE-9051899250 [1,1,0,0,0,0|0,0,2]=4 3375 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [1,1,0,0,0,0|1,0,1]=4 3376 B7R0.4 C=CCCCB(O)O MCULE-3337238704 [1,1,0,0,0,0|1,0,1]=4 3377 B7R0.4 C=CCCCC(C)C MCULE-7578384030 [1,1,0,0,0,0|1,0,1]=4 3378 B7R0.4 C=CCCCC(C)N MCULE-4101795283 [1,1,0,0,0,0|1,0,1]=4 3379 B7R0.4 C=CCCCC(C)O MCULE-6692920526 [1,1,0,0,0,0|0,0,1]=3 3380 B7R0.4 CC(=O)CCCCBr MCULE-8801446022 [1,1,0,0,0,0|0,0,2]=4 3381 B7R0.4 CC(=O)CCCCCl MCULE-2883443563 [1,1,0,0,0,0|0,0,2]=4 3382 B7R0.4 CC(=O)CCCCO MCULE-9846338144 [1,1,0,0,0,0|0,0,2]=4 3383 B7R0.4 CC(Br)CCCCO MCULE-2106751856 [1,1,0,0,0,0|1,0,0]=3 3384 B7R0.4 CC(C)CCCC#N MCULE-8851952716 [1,1,0,0,0,0|1,0,1]=4 3385 B7R0.4 CC(C)CCCC=O MCULE-2846844109 [1,1,0,0,0,0|1,0,1]=4 3386 B7R0.4 CC(C)CCCCBr MCULE-9236389539 [1,1,0,0,0,0|1,0,0]=3 3387 B7R0.4 CC(C)CCCCCl MCULE-5223516486 [1,1,0,0,0,0|1,0,0]=3 3388 B7R0.4 CC(C)CCCCN MCULE-3591523204 [1,1,0,0,0,0|1,0,0]=3 3389 B7R0.4 CC(C)CCCCO MCULE-9053698607 [1,1,0,0,0,0|1,0,0]=3 3390 B7R0.4 CC(C)CCCON MCULE-5299845209 [1,1,0,0,0,0|2,0,0]=4 3391 B7R0.4 CC(C)CCCON MCULE-8643496539 [1,1,0,0,0,0|2,0,0]=4 3392 B7R0.4 CC(C)CNCCN MCULE-3059280265 [1,1,0,0,0,0|2,0,0]=4 3393 B7R0.4 CC(C)CNCCO MCULE-3948234461 [1,1,0,0,0,0|2,0,0]=4 3394 B7R0.4 CC(C)CNCCO MCULE-6673201049 [1,1,0,0,0,0|2,0,0]=4 3395 B7R0.4 CC(C)COCCBr MCULE-7232103778 [1,1,0,0,0,0|2,0,0]=4 3396 B7R0.4 CC(C)COCCN MCULE-9238454281 [1,1,0,0,0,0|2,0,0]=4 3397 B7R0.4 CC(C)COCCN MCULE-9987398976 [1,1,0,0,0,0|2,0,0]=4 3398 B7R0.4 CC(C)COCCO MCULE-2997702641 [1,1,0,0,0,0|2,0,0]=4 3399 B7R0.4 CC(C)CSCCCl MCULE-1798266957 [1,1,0,0,0,0|2,0,0]=4 3400 B7R0.4 CC(C)CSCCN MCULE-6100886830 [1,1,0,0,0,0|2,0,0]=4 3401 B7R0.4 CC(C)CSCCN MCULE-8368453687 [1,1,0,0,0,0|2,0,0]=4 3402 B7R0.4 CC(C)CSCCO MCULE-5481216581 [1,1,0,0,0,0|2,0,0]=4 3403 B7R0.4 CC(C)NCCCN MCULE-2900400569 [1,1,0,0,0,0|2,0,0]=4 3404 B7R0.4 CC(C)NCCCO MCULE-4556994899 [1,1,0,0,0,0|2,0,0]=4 3405 B7R0.4 CC(C)NCCCO MCULE-9550690390 [1,1,0,0,0,0|2,0,0]=4 3406 B7R0.4 CC(C)OCCCBr MCULE-6061340501 [1,1,0,0,0,0|2,0,0]=4 3407 B7R0.4 CC(C)OCCCCl MCULE-5339928259 [1,1,0,0,0,0|2,0,0]=4 3408 B7R0.4 CC(C)OCCCN MCULE-6787172017 [1,1,0,0,0,0|2,0,0]=4 3409 B7R0.4 CC(C)OCCCN MCULE-8495001717 [1,1,0,0,0,0|2,0,0]=4 3410 B7R0.4 CC(C)OCCCO MCULE-9280654202 [1,1,0,0,0,0|2,0,0]=4 3411 B7R0.4 CC(C)SCCCN MCULE-6322440113 [1,1,0,0,0,0|2,0,0]=4 3412 B7R0.4 CC(C)SCCCO MCULE-4296249117 [1,1,0,0,0,0|2,0,0]=4 3413 B7R0.4 CC(Cl)CCCCCl MCULE-4829013540 [1,1,0,0,0,0|1,0,0]=3 3414 B7R0.4 CC(Cl)CNCCCl MCULE-2269449058 [1,1,0,0,0,0|2,0,0]=4 3415 B7R0.4 CC(Cl)CNCCCl MCULE-4107266640 [1,1,0,0,0,0|2,0,0]=4 3416 B7R0.4 CC(Cl)COCCCl MCULE-5744839272 [1,1,0,0,0,0|2,0,0]=4 3417 B7R0.4 CC(N)CCCCN MCULE-3497267062 [1,1,0,0,0,0|1,0,0]=3 3418 B7R0.4 CC(N)CCCCN MCULE-9887360104 [1,1,0,0,0,0|1,0,0]=3 3419 B7R0.4 CC(N)CCCCO MCULE-7039935081 [1,1,0,0,0,0|1,0,0]=3 3420 B7R0.4 CC(N)CCCCO MCULE-8167834378 [1,1,0,0,0,0|1,0,0]=3 3421 B7R0.4 CC(O)CCCCO MCULE-3790969400 [1,1,0,0,0,0|0,0,0]=2 3422 B7R0.4 CC(O)CNCCN MCULE-3904214677 [1,1,0,0,0,0|1,0,0]=3 3423 B7R0.4 CC(O)CNCCO MCULE-4873845500 [1,1,0,0,0,0|1,0,0]=3 3424 B7R0.4 CC(O)CSCCO MCULE-8885458360 [1,1,0,0,0,0|1,0,0]=3 3425 B7R0.4 CCC#CCC(C)O MCULE-4633396611 [1,1,0,0,0,0|0,0,1]=3 3426 B7R0.4 CCC/C=C/B(O)O MCULE-9613885434 [1,1,0,0,0,0|1,0,1]=4 3427 B7R0.4 CCC=CCC(C)C MCULE-6798729321 [1,1,0,0,0,0|1,0,1]=4 3428 B7R0.4 CCCC#CC(C)O MCULE-4333844811 [1,1,0,0,0,0|0,0,1]=3 3429 B7R0.4 CCCC=CB(O)O MCULE-4057687975 [1,1,0,0,0,0|1,0,1]=4 3430 B7R0.4 CCCC=CC(C)C MCULE-6546702510 [1,1,0,0,0,0|1,0,1]=4 3431 B7R0.4 CCCCCB(O)O MCULE-3441747739 [1,1,0,0,0,0|1,0,0]=3 3432 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [1,1,0,0,0,0|0,0,2]=4 3433 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [1,1,0,0,0,0|0,0,2]=4 3434 B7R0.4 CCCCCC(C)Br MCULE-4688847972 [1,1,0,0,0,0|1,0,0]=3 3435 B7R0.4 CCCCCC(C)C MCULE-9815158757 [1,1,0,0,0,0|1,0,0]=3 3436 B7R0.4 CCCCCC(C)Cl MCULE-1461261404 [1,1,0,0,0,0|1,0,0]=3 3437 B7R0.4 CCCCCC(C)N MCULE-1307982487 [1,1,0,0,0,0|1,0,0]=3 3438 B7R0.4 CCCCCC(C)N MCULE-8625441795 [1,1,0,0,0,0|1,0,0]=3 3439 B7R0.4 CCCCCC(C)N MCULE-9791654909 [1,1,0,0,0,0|1,0,0]=3 3440 B7R0.4 CCCCCC(C)O MCULE-2463855771 [1,1,0,0,0,0|0,0,0]=2 3441 B7R0.4 CCCCCC(C)S MCULE-3173115736 [1,1,0,0,0,0|0,1,0]=3 3442 B7R0.4 CCCCC[C@@H](C)N MCULE-2460238945 [1,1,0,0,0,0|1,0,0]=3 3443 B7R0.4 CCCCC[C@@H](C)N MCULE-6386771130 [1,1,0,0,0,0|1,0,0]=3 3444 B7R0.4 CCCCC[C@@H](C)N MCULE-6470246577 [1,1,0,0,0,0|1,0,0]=3 3445 B7R0.4 CCCCC[C@@H](C)O MCULE-1984852239 [1,1,0,0,0,0|0,0,0]=2 3446 B7R0.4 CCCCC[C@@H](C)O MCULE-2769933740 [1,1,0,0,0,0|0,0,0]=2 3447 B7R0.4 CCCCC[C@H](C)N MCULE-8119988811 [1,1,0,0,0,0|1,0,0]=3 3448 B7R0.4 CCCCC[C@H](C)N MCULE-9987283826 [1,1,0,0,0,0|1,0,0]=3 3449 B7R0.4 CCCCC[C@H](C)O MCULE-2305379902 [1,1,0,0,0,0|0,0,0]=2 3450 B7R0.4 CCCCC[C@H](C)O MCULE-5898721044 [1,1,0,0,0,0|0,0,0]=2 3451 B7R0.4 CCCCNC(=O)C MCULE-7266335096 [1,1,0,0,0,0|0,0,2]=4 3452 B7R0.4 CCCCNC(C)C MCULE-2695970517 [1,1,0,0,0,0|1,0,0]=3 3453 B7R0.4 CCCCNC(C)C MCULE-9973816117 [1,1,0,0,0,0|1,0,0]=3 3454 B7R0.4 CCCCOC(=O)C MCULE-2107021121 [1,1,0,0,0,0|0,0,2]=4 3455 B7R0.4 CCCCOC(C)C MCULE-1504269570 [1,1,0,0,0,0|1,0,0]=3 3456 B7R0.4 CCCCOC(Cl)Cl MCULE-2958816896 [1,1,0,0,0,0|2,0,0]=4 3457 B7R0.4 CCCCSC(=O)C MCULE-2653182488 [1,1,0,0,0,0|0,0,2]=4 3458 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [1,1,0,0,0,0|0,0,2]=4 3459 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [1,1,0,0,0,0|0,0,2]=4 3460 B7R0.4 CCCNCC(C)C MCULE-2869656642 [1,1,0,0,0,0|1,0,0]=3 3461 B7R0.4 CCCNCC(C)O MCULE-8110237473 [1,1,0,0,0,0|0,0,0]=2 3462 B7R0.4 CCCNCC(F)F MCULE-5407680209 [1,1,0,0,0,0|2,0,0]=4 3463 B7R0.4 CCCNCC(F)F MCULE-9676670786 [1,1,0,0,0,0|2,0,0]=4 3464 B7R0.4 CCCOCC(=O)O MCULE-6841640058 [1,1,0,0,0,0|0,0,2]=4 3465 B7R0.4 CCCOCC(C)O MCULE-9214840563 [1,1,0,0,0,0|0,0,0]=2 3466 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [1,1,0,0,0,0|0,0,2]=4 3467 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [1,1,0,0,0,0|0,0,2]=4 3468 B7R0.4 CCNCCC(=O)O MCULE-4226597657 [1,1,0,0,0,0|0,0,2]=4 3469 B7R0.4 CCNCCC(=O)O MCULE-9183951914 [1,1,0,0,0,0|0,0,2]=4 3470 B7R0.4 CCNCCN(C)C MCULE-6722045380 [1,1,0,0,0,0|2,0,0]=4 3471 B7R0.4 CCOCCC(=O)C MCULE-8449201493 [1,1,0,0,0,0|0,0,2]=4 3472 B7R0.4 CCOCCC(=O)O MCULE-3962084059 [1,1,0,0,0,0|0,0,2]=4 3473 B7R0.4 CCONCC(C)C MCULE-3595879270 [1,1,0,0,0,0|2,0,0]=4 3474 B7R0.4 CCONCC(C)C MCULE-6329996438 [1,1,0,0,0,0|2,0,0]=4 3475 B7R0.4 CCSCCC(=O)O MCULE-9385724904 [1,1,0,0,0,0|0,0,2]=4 3476 B7R0.4 CCSCCC(C)N MCULE-6854502332 [1,1,0,0,0,0|1,0,0]=3 3477 B7R0.4 CN(C)CCCCBr MCULE-3700239066 [1,1,0,0,0,0|2,0,0]=4 3478 B7R0.4 CN(C)CCCCBr MCULE-5243977766 [1,1,0,0,0,0|2,0,0]=4 3479 B7R0.4 CN(C)CCCCCl MCULE-5038597183 [1,1,0,0,0,0|2,0,0]=4 3480 B7R0.4 CN(C)CCCCCl MCULE-8885080954 [1,1,0,0,0,0|2,0,0]=4 3481 B7R0.4 CN(C)CCCCN MCULE-4457571368 [1,1,0,0,0,0|2,0,0]=4 3482 B7R0.4 CN(C)CCCCN MCULE-9067239115 [1,1,0,0,0,0|2,0,0]=4 3483 B7R0.4 CN(C)CCCCO MCULE-6973654872 [1,1,0,0,0,0|2,0,0]=4 3484 B7R0.4 CNCCCC(=O)O MCULE-7598762485 [1,1,0,0,0,0|0,0,2]=4 3485 B7R0.4 CNCCCC(=O)O MCULE-7877286915 [1,1,0,0,0,0|0,0,2]=4 3486 B7R0.4 CNCCCC(C)C MCULE-1784678333 [1,1,0,0,0,0|1,0,0]=3 3487 B7R0.4 CNCCCN(C)C MCULE-2186520808 [1,1,0,0,0,0|2,0,0]=4 3488 B7R0.4 CNCCNC(C)C MCULE-9007534493 [1,1,0,0,0,0|2,0,0]=4 3489 B7R0.4 COCCCC(=O)C MCULE-3606369396 [1,1,0,0,0,0|0,0,2]=4 3490 B7R0.4 COCCCC(=O)O MCULE-3165881573 [1,1,0,0,0,0|0,0,2]=4 3491 B7R0.4 COCCCC(C)N MCULE-4298611846 [1,1,0,0,0,0|1,0,0]=3 3492 B7R0.4 COCCCC(C)N MCULE-8139434838 [1,1,0,0,0,0|1,0,0]=3 3493 B7R0.4 COCCCC(C)O MCULE-4190294636 [1,1,0,0,0,0|0,0,0]=2 3494 B7R0.4 COCCNC(C)C MCULE-2061720092 [1,1,0,0,0,0|2,0,0]=4 3495 B7R0.4 CSCCCC(=O)O MCULE-2126637794 [1,1,0,0,0,0|0,0,2]=4 3496 B7R0.4 N#CCCCB(O)O MCULE-7776098132 [1,1,0,0,0,0|1,0,1]=4 3497 B7R0.4 NCCCCC(=O)O MCULE-1155829905 [1,1,0,0,0,0|0,0,2]=4 3498 B7R0.4 NCCCCC(=O)O MCULE-3920398524 [1,1,0,0,0,0|0,0,2]=4 3499 B7R0.4 NCCCCC(=O)O MCULE-4404796498 [1,1,0,0,0,0|0,0,2]=4 3500 B7R0.4 NCCCCC(=O)O MCULE-4971679857 [1,1,0,0,0,0|0,0,2]=4 3501 B7R0.4 O=C(O)CCCCBr MCULE-2655919094 [1,1,0,0,0,0|0,0,2]=4 3502 B7R0.4 O=C(O)CCCCCl MCULE-4094641005 [1,1,0,0,0,0|0,0,2]=4 3503 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [1,1,0,0,0,0|0,0,2]=4 3504 B7R0.4 O=C(O)CCCCS MCULE-2427465795 [1,1,0,0,0,0|0,0,2]=4 3505 B7R0.4 OB(O)CCCCBr MCULE-3231135677 [1,1,0,0,0,0|1,0,0]=3 3506 B7R0.6 C=C(C)CCC(C)Br MCULE-6437209576 [1,1,0,0,0,0|1,0,1]=4 3507 B7R0.6 C=C(C)CCC(C)C MCULE-2459654294 [1,1,0,0,0,0|1,0,1]=4 3508 B7R0.6 C=C(C)CCC(C)N MCULE-9861269774 [1,1,0,0,0,0|1,0,1]=4 3509 B7R0.6 C=C(C)CCC(C)O MCULE-5005514248 [1,1,0,0,0,0|0,0,1]=3 3510 B7R0.6 CC(=O)CCC(C)C MCULE-8518693213 [1,1,0,0,0,0|0,0,2]=4 3511 B7R0.6 CC(=O)NCC(C)O MCULE-2406798273 [1,1,0,0,0,0|1,0,1]=4 3512 B7R0.6 CC(=O)OCC(C)O MCULE-3660209140 [1,1,0,0,0,0|1,0,1]=4 3513 B7R0.6 CC(Br)CCC(C)Br MCULE-4511070452 [1,1,0,0,0,0|1,0,0]=3 3514 B7R0.6 CC(C)CCB(O)O MCULE-7387060292 [1,1,0,0,0,0|1,0,0]=3 3515 B7R0.6 CC(C)CCC(=O)O MCULE-7691755837 [1,1,0,0,0,0|0,0,2]=4 3516 B7R0.6 CC(C)CCC(C)Br MCULE-4005079361 [1,1,0,0,0,0|1,0,0]=3 3517 B7R0.6 CC(C)CCC(C)C MCULE-4093485278 [1,1,0,0,0,0|1,0,0]=3 3518 B7R0.6 CC(C)CCC(C)N MCULE-3038746969 [1,1,0,0,0,0|1,0,0]=3 3519 B7R0.6 CC(C)CCC(C)N MCULE-7972635029 [1,1,0,0,0,0|1,0,0]=3 3520 B7R0.6 CC(C)CCC(C)O MCULE-6292509345 [1,1,0,0,0,0|0,0,0]=2 3521 B7R0.6 CC(C)CNC(C)C MCULE-1556200503 [1,1,0,0,0,0|2,0,0]=4 3522 B7R0.6 CC(C)CNC(C)C MCULE-9703437877 [1,1,0,0,0,0|2,0,0]=4 3523 B7R0.6 CC(C)OC[C@H](C)O MCULE-2195035455 [1,1,0,0,0,0|1,0,0]=3 3524 B7R0.6 CC(N)CCC(=O)O MCULE-3711689460 [1,1,0,0,0,0|0,0,2]=4 3525 B7R0.6 CC(N)CCC(=O)O MCULE-5008572656 [1,1,0,0,0,0|0,0,2]=4 3526 B7R0.6 CC(N)CCC(F)F MCULE-6444451088 [1,1,0,0,0,0|2,0,0]=4 3527 B7R0.6 CC(N)CCC(F)F MCULE-9287101789 [1,1,0,0,0,0|2,0,0]=4 3528 B7R0.6 CC(N)CCN(C)C MCULE-9256005237 [1,1,0,0,0,0|2,0,0]=4 3529 B7R0.6 CC(N)CCS(=O)C MCULE-2870651099 [1,1,0,0,0,0|1,0,1]=4 3530 B7R0.6 CC(N)CCS(=O)C MCULE-7863963703 [1,1,0,0,0,0|1,0,1]=4 3531 B7R0.6 CC(O)C#CC(C)O MCULE-5307271719 [1,1,0,0,0,0|0,0,2]=4 3532 B7R0.6 CC(O)C=CC(C)O MCULE-1362403822 [1,1,0,0,0,0|0,0,2]=4 3533 B7R0.6 CC(O)CCC(=O)O MCULE-6352217997 [1,1,0,0,0,0|0,0,2]=4 3534 B7R0.6 CC(O)CCC(=O)[O-] MCULE-5872581098 [1,1,0,0,0,0|1,0,1]=4 3535 B7R0.6 CC(O)CCC(C)O MCULE-6170497684 [1,1,0,0,0,0|0,0,0]=2 3536 B7R0.6 CC(O)CCN(C)C MCULE-7246080230 [1,1,0,0,0,0|1,0,0]=3 3537 B7R0.6 CC(O)CNC(C)C MCULE-9932831006 [1,1,0,0,0,0|1,0,0]=3 3538 B7R0.6 CC(O)COC(C)C MCULE-3357280817 [1,1,0,0,0,0|1,0,0]=3 3539 B7R0.6 CC(S)CCC(=O)O MCULE-9612173883 [1,1,0,0,0,0|0,0,2]=4 3540 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-3295260637 [1,1,0,0,0,0|0,0,2]=4 3541 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-5409083898 [1,1,0,0,0,0|0,0,2]=4 3542 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-6530230723 [1,1,0,0,0,0|0,0,2]=4 3543 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-7530095699 [1,1,0,0,0,0|0,0,2]=4 3544 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-3982464496 [1,1,0,0,0,0|0,0,0]=2 3545 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-6083261012 [1,1,0,0,0,0|0,0,0]=2 3546 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-8142548171 [1,1,0,0,0,0|0,0,0]=2 3547 B7R0.6 C[C@H](N)CCC(=O)O MCULE-3621527632 [1,1,0,0,0,0|0,0,2]=4 3548 B7R0.6 C[C@H](N)CCC(=O)O MCULE-7670557122 [1,1,0,0,0,0|0,0,2]=4 3549 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-5867971604 [1,1,0,0,0,0|0,0,0]=2 3550 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-7024859164 [1,1,0,0,0,0|0,0,0]=2 3551 B7R0.8 C#CCCC(C)(C)O MCULE-8518979057 [1,1,0,0,0,0|0,0,2]=4 3552 B7R0.8 C=CCCC(C)(C)O MCULE-6514590251 [1,1,0,0,0,0|0,0,2]=4 3553 B7R0.8 CC(C)(C)CCCBr MCULE-4957327319 [1,1,0,0,0,0|2,0,0]=4 3554 B7R0.8 CC(C)(C)CCCCl MCULE-2639997289 [1,1,0,0,0,0|2,0,0]=4 3555 B7R0.8 CC(C)(C)CCCN MCULE-4819398612 [1,1,0,0,0,0|2,0,0]=4 3556 B7R0.8 CC(C)(C)CCCN MCULE-8532835162 [1,1,0,0,0,0|2,0,0]=4 3557 B7R0.8 CC(C)(C)CCCO MCULE-6612017649 [1,1,0,0,0,0|2,0,0]=4 3558 B7R0.8 CC(C)(N)CCCN MCULE-2030762085 [1,1,0,0,0,0|2,0,0]=4 3559 B7R0.8 CC(C)(N)CCCO MCULE-7933621714 [1,1,0,0,0,0|2,0,0]=4 3560 B7R0.8 CC(C)(O)CCCBr MCULE-5479502475 [1,1,0,0,0,0|1,0,0]=3 3561 B7R0.8 CC(C)(O)CCCN MCULE-1661840780 [1,1,0,0,0,0|1,0,0]=3 3562 B7R0.8 CC(C)(O)CCCO MCULE-1879136086 [1,1,0,0,0,0|1,0,0]=3 3563 B7R0.8 CC(C)(O)CCNN MCULE-1931103100 [1,1,0,0,0,0|2,0,0]=4 3564 B7R0.8 CC(C)(O)CCNN MCULE-8954589001 [1,1,0,0,0,0|2,0,0]=4 3565 B7R0.8 CC(Cl)(Cl)CCCN MCULE-9158528568 [1,1,0,0,0,0|2,0,0]=4 3566 B7R0.8 CC(F)(F)CCCBr MCULE-7834124234 [1,1,0,0,0,0|2,0,0]=4 3567 B7R0.8 CC(F)(F)CCCCl MCULE-6343526687 [1,1,0,0,0,0|2,0,0]=4 3568 B7R0.8 CC(F)(F)CCCN MCULE-4069688794 [1,1,0,0,0,0|2,0,0]=4 3569 B7R0.8 CC(F)(F)CCCN MCULE-8715137669 [1,1,0,0,0,0|2,0,0]=4 3570 B7R0.8 CC(F)(F)CCCO MCULE-1590790031 [1,1,0,0,0,0|2,0,0]=4 3571 B7R0.8 CCC#CC(C)(C)O MCULE-2859176039 [1,1,0,0,0,0|0,0,2]=4 3572 B7R0.8 CCCCC(C)(C)C MCULE-4446772090 [1,1,0,0,0,0|1,0,0]=3 3573 B7R0.8 CCCCC(C)(C)O MCULE-6518378731 [1,1,0,0,0,0|0,0,0]=2 3574 B7R0.8 CCCCC(F)(F)F MCULE-6313392272 [1,1,0,0,0,0|2,0,0]=4 3575 B7R0.8 CCCCP(=O)(O)O MCULE-8779445551 [1,1,0,0,0,0|1,0,0]=3 3576 B7R0.8 CCCCS(=O)(=O)O MCULE-8566681643 [1,1,0,0,0,0|1,0,1]=4 3577 B7R0.8 CCCC[N+](C)(C)C MCULE-6094336787 [1,1,0,0,0,0|2,0,0]=4 3578 B7R0.8 CCCC[N+](C)(C)C MCULE-6922813961 [1,1,0,0,0,0|2,0,0]=4 3579 B7R0.8 CCCC[N+](C)(C)C MCULE-7733910392 [1,1,0,0,0,0|2,0,0]=4 3580 B7R0.8 CCCC[Si](C)(C)Cl MCULE-6810849853 [1,1,0,0,0,0|1,1,0]=4 3581 B7R0.8 CCCC[Si](C)(Cl)Cl MCULE-9750896400 [1,1,0,0,0,0|1,1,0]=4 3582 B7R0.8 CCCNC(C)(C)C MCULE-3688632776 [1,1,0,0,0,0|2,0,0]=4 3583 B7R0.8 CCCNC(C)(C)C MCULE-5354845024 [1,1,0,0,0,0|2,0,0]=4 3584 B7R0.8 CCCOC(C)(C)C MCULE-4291970439 [1,1,0,0,0,0|2,0,0]=4 3585 B7R0.8 CCCOP(=O)(C)O MCULE-3556230581 [1,1,0,0,0,0|2,0,0]=4 3586 B7R0.8 CCNCC(C)(C)C MCULE-2346291870 [1,1,0,0,0,0|2,0,0]=4 3587 B7R0.8 CCNCC(C)(C)C MCULE-8357884831 [1,1,0,0,0,0|2,0,0]=4 3588 B7R0.8 CCNCC(C)(C)N MCULE-4574020293 [1,1,0,0,0,0|2,0,0]=4 3589 B7R0.8 CCNCC(C)(C)N MCULE-7739987843 [1,1,0,0,0,0|2,0,0]=4 3590 B7R0.8 CCNCC(C)(C)O MCULE-7989635881 [1,1,0,0,0,0|1,0,0]=3 3591 B7R0.8 CCNCC(C)(C)O MCULE-8539687825 [1,1,0,0,0,0|1,0,0]=3 3592 B7R0.8 CCOCC(C)(C)N MCULE-6273123648 [1,1,0,0,0,0|2,0,0]=4 3593 B7R0.8 CCOCC(C)(C)N MCULE-8688436281 [1,1,0,0,0,0|2,0,0]=4 3594 B7R0.8 CNCCC(C)(C)C MCULE-4129415722 [1,1,0,0,0,0|2,0,0]=4 3595 B7R0.8 CNCCC(C)(C)C MCULE-8255669777 [1,1,0,0,0,0|2,0,0]=4 3596 B7R0.8 CNCCC(C)(C)N MCULE-2728169604 [1,1,0,0,0,0|2,0,0]=4 3597 B7R0.8 CNCCC(C)(C)N MCULE-3540926370 [1,1,0,0,0,0|2,0,0]=4 3598 B7R0.8 CNCCC(C)(C)O MCULE-6866727490 [1,1,0,0,0,0|1,0,0]=3 3599 B7R0.8 COCCC(C)(C)N MCULE-7159634596 [1,1,0,0,0,0|2,0,0]=4 3600 B7R0.8 CP(=O)(O)CCCN MCULE-1158131505 [1,1,0,0,0,0|2,0,0]=4 3601 B7R0.8 CP(=O)(O)CCCN MCULE-8748054523 [1,1,0,0,0,0|2,0,0]=4 3602 B7R0.8 CSCCC(C)(C)N MCULE-5957026834 [1,1,0,0,0,0|2,0,0]=4 3603 B7R0.8 NCCCP(=O)(O)O MCULE-7175026527 [1,1,0,0,0,0|2,0,0]=4 3604 B7R0.8 NCCC[Si](O)(O)O MCULE-9706812989 [1,1,0,0,0,0|1,1,0]=4 3605 B7R0.8 O=P(O)(O)CCCBr MCULE-8428985634 [1,1,0,0,0,0|2,0,0]=4 3606 B7R0.8 O=P(O)(O)CCCCl MCULE-9259107636 [1,1,0,0,0,0|2,0,0]=4 3607 B7R0.1 BrCCCCCCBr MCULE-5187406804 [1,1,0,0,0,0|1,0,0]=3 3608 B7R0.1 C#CCCCCCBr MCULE-1618292603 [1,1,0,0,0,0|1,0,1]=4 3609 B7R0.1 C#CCCCCCC MCULE-4406928583 [1,1,0,0,0,0|1,0,0]=3 3610 B7R0.1 C#CCCCCCCl MCULE-2788042800 [1,1,0,0,0,0|1,0,1]=4 3611 B7R0.1 C#CCCCCCN MCULE-3067915237 [1,1,0,0,0,0|1,0,1]=4 3612 B7R0.1 C#CCCCCCO MCULE-2909503471 [1,1,0,0,0,0|0,0,1]=3 3613 B7R0.1 C#CCNCCCC MCULE-4241072719 [1,1,0,0,0,0|1,0,1]=4 3614 B7R0.1 C#CCOCCCO MCULE-2600818859 [1,1,0,0,0,0|0,0,2]=4 3615 B7R0.1 C/C=C/CCCCC MCULE-6911363331 [1,1,0,0,0,0|1,0,1]=4 3616 B7R0.1 C/C=C\CCCCC MCULE-9470036254 [1,1,0,0,0,0|1,0,1]=4 3617 B7R0.1 C=CCCCCCBr MCULE-7782876660 [1,1,0,0,0,0|1,0,1]=4 3618 B7R0.1 C=CCCCCCC MCULE-6867393536 [1,1,0,0,0,0|1,0,0]=3 3619 B7R0.1 C=CCCCCCCl MCULE-2205880878 [1,1,0,0,0,0|1,0,1]=4 3620 B7R0.1 C=CCCCCCI MCULE-1823596954 [1,1,0,0,0,0|1,0,1]=4 3621 B7R0.1 C=CCCCCCN MCULE-2913783474 [1,1,0,0,0,0|1,0,1]=4 3622 B7R0.1 C=CCCCCCN MCULE-9545708862 [1,1,0,0,0,0|1,0,1]=4 3623 B7R0.1 C=CCCCCCO MCULE-1200112990 [1,1,0,0,0,0|0,0,1]=3 3624 B7R0.1 C=CCCCCNC MCULE-3676018759 [1,1,0,0,0,0|1,0,1]=4 3625 B7R0.1 C=CCCCCNC MCULE-9443600983 [1,1,0,0,0,0|1,0,1]=4 3626 B7R0.1 C=CCCCCON MCULE-1155744928 [1,1,0,0,0,0|0,0,2]=4 3627 B7R0.1 C=CCCCCON MCULE-1741904620 [1,1,0,0,0,0|0,0,2]=4 3628 B7R0.1 C=CCCCNCC MCULE-2141378110 [1,1,0,0,0,0|1,0,1]=4 3629 B7R0.1 C=CCCCNCC MCULE-4269657694 [1,1,0,0,0,0|1,0,1]=4 3630 B7R0.1 C=CCCNCCO MCULE-8357008337 [1,1,0,0,0,0|0,0,2]=4 3631 B7R0.1 C=CCCOCCO MCULE-5369849290 [1,1,0,0,0,0|0,0,2]=4 3632 B7R0.1 C=CCOCCCC MCULE-2214755289 [1,1,0,0,0,0|1,0,1]=4 3633 B7R0.1 C=CCSCCCC MCULE-4868736488 [1,1,0,0,0,0|1,0,1]=4 3634 B7R0.1 C=COCCCCC MCULE-4024159480 [1,1,0,0,0,0|1,0,1]=4 3635 B7R0.1 C=COCCCCO MCULE-3537265926 [1,1,0,0,0,0|0,0,2]=4 3636 B7R0.1 CC#CCCCCBr MCULE-3308414129 [1,1,0,0,0,0|1,0,1]=4 3637 B7R0.1 CC#CCCCCC MCULE-3651650902 [1,1,0,0,0,0|1,0,1]=4 3638 B7R0.1 CC#CCCCCO MCULE-8668355627 [1,1,0,0,0,0|0,0,1]=3 3639 B7R0.1 CC/C=C/CCCC MCULE-7439146649 [1,1,0,0,0,0|1,0,1]=4 3640 B7R0.1 CC/C=C\CCCO MCULE-7890119012 [1,1,0,0,0,0|0,0,1]=3 3641 B7R0.1 CC=CCCCCC MCULE-7111489659 [1,1,0,0,0,0|1,0,1]=4 3642 B7R0.1 CC=CCCCCO MCULE-8707373340 [1,1,0,0,0,0|0,0,1]=3 3643 B7R0.1 CCC#CCCCC MCULE-5815218275 [1,1,0,0,0,0|1,0,1]=4 3644 B7R0.1 CCC/C=C/CCC MCULE-4580411068 [1,1,0,0,0,0|1,0,1]=4 3645 B7R0.1 CCC/C=C\CCC MCULE-3832748741 [1,1,0,0,0,0|1,0,1]=4 3646 B7R0.1 CCC=CCCCC MCULE-9716720293 [1,1,0,0,0,0|1,0,1]=4 3647 B7R0.1 CCC=CCCCO MCULE-9620732691 [1,1,0,0,0,0|0,0,1]=3 3648 B7R0.1 CCCC#CCCC MCULE-7777692011 [1,1,0,0,0,0|1,0,1]=4 3649 B7R0.1 CCCC#CCCO MCULE-7581204382 [1,1,0,0,0,0|0,0,1]=3 3650 B7R0.1 CCCC/C=C/CO MCULE-5404793542 [1,1,0,0,0,0|0,0,1]=3 3651 B7R0.1 CCCC=CCCC MCULE-6897310592 [1,1,0,0,0,0|1,0,1]=4 3652 B7R0.1 CCCC=CCCCl MCULE-5580394901 [1,1,0,0,0,0|1,0,1]=4 3653 B7R0.1 CCCCC#CCO MCULE-9057096480 [1,1,0,0,0,0|0,0,1]=3 3654 B7R0.1 CCCCC=CCBr MCULE-2427659057 [1,1,0,0,0,0|1,0,1]=4 3655 B7R0.1 CCCCC=CCO MCULE-7891403223 [1,1,0,0,0,0|0,0,1]=3 3656 B7R0.1 CCCCCC=CI MCULE-9964634818 [1,1,0,0,0,0|1,0,1]=4 3657 B7R0.1 CCCCCCC#N MCULE-7652123212 [1,1,0,0,0,0|1,0,0]=3 3658 B7R0.1 CCCCCCC=O MCULE-5251820425 [1,1,0,0,0,0|0,0,1]=3 3659 B7R0.1 CCCCCCCBr MCULE-8042829299 [1,1,0,0,0,0|1,0,0]=3 3660 B7R0.1 CCCCCCCC MCULE-3248084959 [1,1,0,0,0,0|1,0,0]=3 3661 B7R0.1 CCCCCCCCl MCULE-6286146566 [1,1,0,0,0,0|1,0,0]=3 3662 B7R0.1 CCCCCCCF MCULE-9794868174 [1,1,0,0,0,0|1,0,0]=3 3663 B7R0.1 CCCCCCCI MCULE-2930393920 [1,1,0,0,0,0|1,0,0]=3 3664 B7R0.1 CCCCCCCN MCULE-1126747714 [1,1,0,0,0,0|1,0,0]=3 3665 B7R0.1 CCCCCCCO MCULE-5882959353 [1,1,0,0,0,0|0,0,0]=2 3666 B7R0.1 CCCCCCCS MCULE-3901364910 [1,1,0,0,0,0|0,1,0]=3 3667 B7R0.1 CCCCCCNC MCULE-1828296852 [1,1,0,0,0,0|1,0,0]=3 3668 B7R0.1 CCCCCCNN MCULE-5116098983 [1,1,0,0,0,0|1,0,0]=3 3669 B7R0.1 CCCCCCNO MCULE-4175875706 [1,1,0,0,0,0|0,0,0]=2 3670 B7R0.1 CCCCCCNO MCULE-8719557426 [1,1,0,0,0,0|0,0,0]=2 3671 B7R0.1 CCCCCCOC MCULE-7148964901 [1,1,0,0,0,0|0,0,0]=2 3672 B7R0.1 CCCCCCON MCULE-1836746134 [1,1,0,0,0,0|0,0,0]=2 3673 B7R0.1 CCCCCCON MCULE-9566158736 [1,1,0,0,0,0|0,0,0]=2 3674 B7R0.1 CCCCCN=C=O MCULE-6020523044 [1,1,0,0,0,0|0,0,2]=4 3675 B7R0.1 CCCCCN=C=S MCULE-3433224152 [1,1,0,0,0,0|0,1,1]=4 3676 B7R0.1 CCCCCN=N#N MCULE-3738662950 [1,1,0,0,0,0|2,0,0]=4 3677 B7R0.1 CCCCCOC=O MCULE-2718009140 [1,1,0,0,0,0|0,0,2]=4 3678 B7R0.1 CCCCCOCC MCULE-6346670527 [1,1,0,0,0,0|1,0,0]=3 3679 B7R0.1 CCCCCON=O MCULE-8065075083 [1,1,0,0,0,0|1,0,1]=4 3680 B7R0.1 CCCCCSC#N MCULE-8334022047 [1,1,0,0,0,0|1,0,1]=4 3681 B7R0.1 CCCCNCC#N MCULE-1687580908 [1,1,0,0,0,0|1,0,1]=4 3682 B7R0.1 CCCCNCCC MCULE-6342731867 [1,1,0,0,0,0|1,0,0]=3 3683 B7R0.1 CCCCNCCN MCULE-3865190511 [1,1,0,0,0,0|1,0,0]=3 3684 B7R0.1 CCCCNCCO MCULE-3582031814 [1,1,0,0,0,0|0,0,0]=2 3685 B7R0.1 CCCCNCCS MCULE-6926403617 [1,1,0,0,0,0|0,1,0]=3 3686 B7R0.1 CCCCOCCBr MCULE-5314812532 [1,1,0,0,0,0|1,0,0]=3 3687 B7R0.1 CCCCOCCCl MCULE-9147804479 [1,1,0,0,0,0|1,0,0]=3 3688 B7R0.1 CCCCOCCI MCULE-3571589392 [1,1,0,0,0,0|1,0,0]=3 3689 B7R0.1 CCCCOCCN MCULE-1817743996 [1,1,0,0,0,0|1,0,0]=3 3690 B7R0.1 CCCCOCCN MCULE-3658840205 [1,1,0,0,0,0|1,0,0]=3 3691 B7R0.1 CCCCOCCO MCULE-1727546427 [1,1,0,0,0,0|0,0,0]=2 3692 B7R0.1 CCCCOCCO MCULE-4417721312 [1,1,0,0,0,0|0,0,0]=2 3693 B7R0.1 CCCCOCCS MCULE-7419398753 [1,1,0,0,0,0|0,1,0]=3 3694 B7R0.1 CCCCSCC#N MCULE-9529960668 [1,1,0,0,0,0|1,0,1]=4 3695 B7R0.1 CCCCSCCC MCULE-3137952516 [1,1,0,0,0,0|1,0,0]=3 3696 B7R0.1 CCCCSCCN MCULE-3521818954 [1,1,0,0,0,0|1,0,0]=3 3697 B7R0.1 CCCCSCCN MCULE-5281011566 [1,1,0,0,0,0|1,0,0]=3 3698 B7R0.1 CCCCSCCO MCULE-8791357083 [1,1,0,0,0,0|0,0,0]=2 3699 B7R0.1 CCCCSCCS MCULE-4109311315 [1,1,0,0,0,0|0,1,0]=3 3700 B7R0.1 CCCNCCC#N MCULE-4350757262 [1,1,0,0,0,0|1,0,1]=4 3701 B7R0.1 CCCNCCCN MCULE-6668094176 [1,1,0,0,0,0|1,0,0]=3 3702 B7R0.1 CCCNCCCO MCULE-4366982860 [1,1,0,0,0,0|0,0,0]=2 3703 B7R0.1 CCCNCCNC MCULE-3857593384 [1,1,0,0,0,0|2,0,0]=4 3704 B7R0.1 CCCNCCOC MCULE-4425567647 [1,1,0,0,0,0|1,0,0]=3 3705 B7R0.1 CCCNNCCC MCULE-1099710970 [1,1,0,0,0,0|2,0,0]=4 3706 B7R0.1 CCCNNCCC MCULE-3763521244 [1,1,0,0,0,0|2,0,0]=4 3707 B7R0.1 CCCOCCCN MCULE-5875738973 [1,1,0,0,0,0|1,0,0]=3 3708 B7R0.1 CCCSCCCN MCULE-2911445961 [1,1,0,0,0,0|1,0,0]=3 3709 B7R0.1 CCCSSCCC MCULE-2667977107 [1,1,0,0,0,0|2,0,0]=4 3710 B7R0.1 CCNCCCCO MCULE-4851249509 [1,1,0,0,0,0|0,0,0]=2 3711 B7R0.1 CCNCCNCC MCULE-2663126630 [1,1,0,0,0,0|2,0,0]=4 3712 B7R0.1 CCNCCNCC MCULE-8627955138 [1,1,0,0,0,0|2,0,0]=4 3713 B7R0.1 CCNCCNCC MCULE-9858982602 [1,1,0,0,0,0|2,0,0]=4 3714 B7R0.1 CCNCCOCC MCULE-8895991816 [1,1,0,0,0,0|2,0,0]=4 3715 B7R0.1 CCOCCCC#N MCULE-6256619755 [1,1,0,0,0,0|1,0,1]=4 3716 B7R0.1 CCOCCCCN MCULE-6583734908 [1,1,0,0,0,0|1,0,0]=3 3717 B7R0.1 CCOCCCCO MCULE-9986213119 [1,1,0,0,0,0|0,0,0]=2 3718 B7R0.1 CCOCCOCC MCULE-5593873009 [1,1,0,0,0,0|2,0,0]=4 3719 B7R0.1 CCONCCOC MCULE-2883736672 [1,1,0,0,0,0|2,0,0]=4 3720 B7R0.1 CCONCCOC MCULE-8885999080 [1,1,0,0,0,0|2,0,0]=4 3721 B7R0.1 CCSCCCC#N MCULE-4186353737 [1,1,0,0,0,0|1,0,1]=4 3722 B7R0.1 CCSCCCCN MCULE-7961306984 [1,1,0,0,0,0|1,0,0]=3 3723 B7R0.1 CCSCCCCO MCULE-1712194349 [1,1,0,0,0,0|0,0,0]=2 3724 B7R0.1 CCSCCSCC MCULE-2178899960 [1,1,0,0,0,0|2,0,0]=4 3725 B7R0.1 CNCCCCCN MCULE-8023367999 [1,1,0,0,0,0|1,0,0]=3 3726 B7R0.1 CNCCCCCO MCULE-2988249730 [1,1,0,0,0,0|0,0,0]=2 3727 B7R0.1 CNCCCCCO MCULE-8033733525 [1,1,0,0,0,0|0,0,0]=2 3728 B7R0.1 CNCCCCNC MCULE-4466243376 [1,1,0,0,0,0|2,0,0]=4 3729 B7R0.1 CNCCCCOC MCULE-3203262011 [1,1,0,0,0,0|1,0,0]=3 3730 B7R0.1 CNCCNCCN MCULE-6347214757 [1,1,0,0,0,0|2,0,0]=4 3731 B7R0.1 CNCCNCCN MCULE-8600289461 [1,1,0,0,0,0|2,0,0]=4 3732 B7R0.1 CNCCOCCCl MCULE-4700720996 [1,1,0,0,0,0|2,0,0]=4 3733 B7R0.1 CNCCOCCCl MCULE-6741879544 [1,1,0,0,0,0|2,0,0]=4 3734 B7R0.1 CNCCOCCN MCULE-8077914280 [1,1,0,0,0,0|2,0,0]=4 3735 B7R0.1 CNCCOCCO MCULE-7869540361 [1,1,0,0,0,0|1,0,0]=3 3736 B7R0.1 COCCCCC#N MCULE-5969342869 [1,1,0,0,0,0|1,0,1]=4 3737 B7R0.1 COCCCCCBr MCULE-9843465236 [1,1,0,0,0,0|1,0,0]=3 3738 B7R0.1 COCCCCCCl MCULE-6956815361 [1,1,0,0,0,0|1,0,0]=3 3739 B7R0.1 COCCCCCN MCULE-2109050097 [1,1,0,0,0,0|1,0,0]=3 3740 B7R0.1 COCCCCCO MCULE-6003118644 [1,1,0,0,0,0|0,0,0]=2 3741 B7R0.1 COCCCCOC MCULE-3614881304 [1,1,0,0,0,0|1,0,0]=3 3742 B7R0.1 COCCNCCF MCULE-1482164073 [1,1,0,0,0,0|2,0,0]=4 3743 B7R0.1 COCCNCCF MCULE-4419696614 [1,1,0,0,0,0|2,0,0]=4 3744 B7R0.1 COCCNCCN MCULE-4860380919 [1,1,0,0,0,0|2,0,0]=4 3745 B7R0.1 COCCNCCN MCULE-8558629867 [1,1,0,0,0,0|2,0,0]=4 3746 B7R0.1 COCCNCCO MCULE-3082225541 [1,1,0,0,0,0|1,0,0]=3 3747 B7R0.1 COCCOCCBr MCULE-7766640443 [1,1,0,0,0,0|2,0,0]=4 3748 B7R0.1 COCCOCCCl MCULE-5502842762 [1,1,0,0,0,0|2,0,0]=4 3749 B7R0.1 COCCOCCI MCULE-4051748367 [1,1,0,0,0,0|2,0,0]=4 3750 B7R0.1 COCCOCCN MCULE-7016705271 [1,1,0,0,0,0|2,0,0]=4 3751 B7R0.1 COCCOCCO MCULE-4230242952 [1,1,0,0,0,0|1,0,0]=3 3752 B7R0.1 COCCOCCS MCULE-5015015605 [1,1,0,0,0,0|1,1,0]=4 3753 B7R0.1 COCCSCCO MCULE-5057235828 [1,1,0,0,0,0|1,0,0]=3 3754 B7R0.1 COCOCCCN MCULE-4340598730 [1,1,0,0,0,0|2,0,0]=4 3755 B7R0.1 CSCCCCC#N MCULE-5901122432 [1,1,0,0,0,0|1,0,1]=4 3756 B7R0.1 CSCCCCCN MCULE-8771942873 [1,1,0,0,0,0|1,0,0]=3 3757 B7R0.1 CSCCCCCO MCULE-3422729293 [1,1,0,0,0,0|0,0,0]=2 3758 B7R0.1 ClCCCCCCBr MCULE-7471712605 [1,1,0,0,0,0|1,0,0]=3 3759 B7R0.1 ClCCCCCCCl MCULE-2423183693 [1,1,0,0,0,0|1,0,0]=3 3760 B7R0.1 ClCCCCCCI MCULE-2662361744 [1,1,0,0,0,0|1,0,0]=3 3761 B7R0.1 ClCCCCOCCl MCULE-6534731124 [1,1,0,0,0,0|2,0,0]=4 3762 B7R0.1 ClCCCNCCCl MCULE-1885721760 [1,1,0,0,0,0|2,0,0]=4 3763 B7R0.1 ClCCCNCCCl MCULE-9511755738 [1,1,0,0,0,0|2,0,0]=4 3764 B7R0.1 FCCCCCCBr MCULE-9238324978 [1,1,0,0,0,0|1,0,0]=3 3765 B7R0.1 ICCCCCCI MCULE-1005202656 [1,1,0,0,0,0|1,0,0]=3 3766 B7R0.1 N#CCCCCCBr MCULE-2014100603 [1,1,0,0,0,0|1,0,1]=4 3767 B7R0.1 N#CCCCCCCl MCULE-1324928568 [1,1,0,0,0,0|1,0,1]=4 3768 B7R0.1 N#CCCCCCN MCULE-4837507252 [1,1,0,0,0,0|1,0,1]=4 3769 B7R0.1 N#CCCNCCO MCULE-4867229301 [1,1,0,0,0,0|1,0,1]=4 3770 B7R0.1 N#CCCNCCO MCULE-9947925933 [1,1,0,0,0,0|1,0,1]=4 3771 B7R0.1 N#CCCOCCO MCULE-4006569384 [1,1,0,0,0,0|1,0,1]=4 3772 B7R0.1 N#CCCSCCO MCULE-6168568089 [1,1,0,0,0,0|1,0,1]=4 3773 B7R0.1 N#CCOCCCO MCULE-3858235861 [1,1,0,0,0,0|1,0,1]=4 3774 B7R0.1 N#N=NCCCCO MCULE-2102116751 [1,1,0,0,0,0|2,0,0]=4 3775 B7R0.1 NCCCCCCBr MCULE-4017495581 [1,1,0,0,0,0|1,0,0]=3 3776 B7R0.1 NCCCCCCBr MCULE-4048883510 [1,1,0,0,0,0|1,0,0]=3 3777 B7R0.1 NCCCCCCN MCULE-1038764376 [1,1,0,0,0,0|1,0,0]=3 3778 B7R0.1 NCCCCCCN MCULE-3766020930 [1,1,0,0,0,0|1,0,0]=3 3779 B7R0.1 NCCCCCCN MCULE-9535729200 [1,1,0,0,0,0|1,0,0]=3 3780 B7R0.1 NCCCCCCO MCULE-2264326846 [1,1,0,0,0,0|0,0,0]=2 3781 B7R0.1 NCCCCCCS MCULE-3764839885 [1,1,0,0,0,0|0,1,0]=3 3782 B7R0.1 NCCCCCCS MCULE-5822376723 [1,1,0,0,0,0|0,1,0]=3 3783 B7R0.1 NCCCNCCBr MCULE-3804557930 [1,1,0,0,0,0|2,0,0]=4 3784 B7R0.1 NCCCNCCBr MCULE-7533614613 [1,1,0,0,0,0|2,0,0]=4 3785 B7R0.1 NCCCNCCBr MCULE-9607733996 [1,1,0,0,0,0|2,0,0]=4 3786 B7R0.1 NCCCNCCN MCULE-4817006723 [1,1,0,0,0,0|2,0,0]=4 3787 B7R0.1 NCCCNCCO MCULE-1084481336 [1,1,0,0,0,0|1,0,0]=3 3788 B7R0.1 NCCCNCCS MCULE-2204209594 [1,1,0,0,0,0|1,1,0]=4 3789 B7R0.1 NCCCNCCS MCULE-8506055366 [1,1,0,0,0,0|1,1,0]=4 3790 B7R0.1 NCCCOCCO MCULE-7244821044 [1,1,0,0,0,0|1,0,0]=3 3791 B7R0.1 NCCNCCCO MCULE-6476789217 [1,1,0,0,0,0|1,0,0]=3 3792 B7R0.1 NCCOCCCO MCULE-2435588099 [1,1,0,0,0,0|1,0,0]=3 3793 B7R0.1 NCCOCCCO MCULE-9188421727 [1,1,0,0,0,0|1,0,0]=3 3794 B7R0.1 NCCSCCCO MCULE-1578023056 [1,1,0,0,0,0|1,0,0]=3 3795 B7R0.1 NCCSSCCO MCULE-1512873976 [1,1,0,0,0,0|2,0,0]=4 3796 B7R0.1 NOCCOCCO MCULE-7815173940 [1,1,0,0,0,0|2,0,0]=4 3797 B7R0.1 O=CCCCCCBr MCULE-7014516847 [1,1,0,0,0,0|0,0,2]=4 3798 B7R0.1 O=CCCCCCCl MCULE-8269912560 [1,1,0,0,0,0|0,0,2]=4 3799 B7R0.1 O=CCCCCCF MCULE-8174281286 [1,1,0,0,0,0|0,0,2]=4 3800 B7R0.1 O=CCCCCCO MCULE-3978349845 [1,1,0,0,0,0|0,0,1]=3 3801 B7R0.1 O=CCCCCCO MCULE-4997016680 [1,1,0,0,0,0|0,0,1]=3 3802 B7R0.1 OCCC=CCCO MCULE-7933051592 [1,1,0,0,0,0|0,0,2]=4 3803 B7R0.1 OCCCCCCBr MCULE-3500356936 [1,1,0,0,0,0|0,0,0]=2 3804 B7R0.1 OCCCCCCCl MCULE-4507452440 [1,1,0,0,0,0|0,0,0]=2 3805 B7R0.1 OCCCCCCF MCULE-7082491218 [1,1,0,0,0,0|0,0,0]=2 3806 B7R0.1 OCCCCCCI MCULE-3710706648 [1,1,0,0,0,0|0,0,0]=2 3807 B7R0.1 OCCCCCCO MCULE-8817570517 [1,1,0,0,0,0|0,0,0]=2 3808 B7R0.1 OCCCCCCS MCULE-9135853131 [1,1,0,0,0,0|0,0,0]=2 3809 B7R0.1 OCCCNCCO MCULE-1959450493 [1,1,0,0,0,0|1,0,0]=3 3810 B7R0.1 OCCCOCCCl MCULE-9172390990 [1,1,0,0,0,0|1,0,0]=3 3811 B7R0.1 OCCNNCCO MCULE-5335815164 [1,1,0,0,0,0|2,0,0]=4 3812 B7R0.1 OCCOCCCBr MCULE-3397483886 [1,1,0,0,0,0|1,0,0]=3 3813 B7R0.1 OCCSSCCO MCULE-9443383082 [1,1,0,0,0,0|2,0,0]=4 3814 B7R0.1 SCCCCCCS MCULE-2873828857 [1,1,0,0,0,0|0,1,0]=3 3815 B7R0.1 [NH3+]CCCCCC[NH3+] MCULE-2211304471 [1,1,0,0,0,0|1,0,0]=3 3816 B7R0.1 [NH3+]CCC[NH2+]CCS MCULE-5394269788 [1,1,0,0,0,0|1,1,0]=4 3817 B9R0.4 CCCCC(C)CC(=O)O MCULE-1674327007 [0,2,0,0,0,0|1,0,0]=3 3818 B9R0.4 CCCCC(C)CC(C)C MCULE-5058808542 [0,2,0,0,0,0|2,0,0]=4 3819 B9R0.4 CCCCC(N)CC(=O)O MCULE-4002800812 [0,2,0,0,0,0|1,0,0]=3 3820 B9R0.4 CCCCC(N)CC(=O)O MCULE-8705314129 [0,2,0,0,0,0|1,0,0]=3 3821 B9R0.4 CCCCC(O)CC(=O)O MCULE-6348296633 [0,2,0,0,0,0|0,0,0]=2 3822 B9R0.4 CCCC[C@@H](N)CC(=O)O MCULE-8271790861 [0,2,0,0,0,0|1,0,0]=3 3823 B9R0.4 CCCC[C@H](C)CC(=O)O MCULE-2048808547 [0,2,0,0,0,0|1,0,0]=3 3824 B9R0.4 CCCC[C@H](N)CC(=O)O MCULE-1387096023 [0,2,0,0,0,0|1,0,0]=3 3825 B9R0.4 CSCCC(N)CC(=O)O MCULE-1046928513 [0,2,0,0,0,0|2,0,0]=4 3826 B9R0.4 CSCCC(N)CC(=O)O MCULE-8979030814 [0,2,0,0,0,0|2,0,0]=4 3827 B9R0.4 CSCCC(O)CC(=O)O MCULE-8328222292 [0,2,0,0,0,0|1,0,0]=3 3828 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-2765615228 [0,2,0,0,0,0|2,0,0]=4 3829 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-5262188114 [0,2,0,0,0,0|2,0,0]=4 3830 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-7951099593 [0,2,0,0,0,0|2,0,0]=4 3831 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-9117868798 [0,2,0,0,0,0|2,0,0]=4 3832 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-1875547228 [0,2,0,0,0,0|2,0,0]=4 3833 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-2149586027 [0,2,0,0,0,0|2,0,0]=4 3834 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-2492945888 [0,2,0,0,0,0|2,0,0]=4 3835 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-3229832789 [0,2,0,0,0,0|2,0,0]=4 3836 B9R0.4 NCCCC(N)CC(=O)O MCULE-3705980324 [0,2,0,0,0,0|2,0,0]=4 3837 B9R0.4 NCCCC(N)CC(=O)O MCULE-5566899547 [0,2,0,0,0,0|2,0,0]=4 3838 B9R0.4 NCCC[C@@H](N)CC(=O)O MCULE-3425525065 [0,2,0,0,0,0|2,0,0]=4 3839 B9R0.4 NCCC[C@H](N)CC(=O)O MCULE-2321041121 [0,2,0,0,0,0|2,0,0]=4 3840 B9R0.4 NCCC[C@H](N)CC(=O)O MCULE-6552199637 [0,2,0,0,0,0|2,0,0]=4 3841 B9R0.5 C=CCC(C)CCCCC MCULE-2730037142 [0,2,0,0,0,0|2,0,0]=4 3842 B9R0.5 C=CCC(O)CCCCC MCULE-6811117459 [0,2,0,0,0,0|1,0,0]=3 3843 B9R0.5 CCCCCC(C)CC=O MCULE-4528527314 [0,2,0,0,0,0|1,0,1]=4 3844 B9R0.5 CCCCCC(C)CCBr MCULE-7502279942 [0,2,0,0,0,0|2,0,0]=4 3845 B9R0.5 CCCCCC(C)CCC MCULE-5749911992 [0,2,0,0,0,0|2,0,0]=4 3846 B9R0.5 CCCCCC(C)CCO MCULE-6787638248 [0,2,0,0,0,0|1,0,0]=3 3847 B9R0.5 CCCCCC(O)CCC MCULE-8117002289 [0,2,0,0,0,0|1,0,0]=3 3848 B9R0.5 CCCCCC(O)CCO MCULE-7307683143 [0,2,0,0,0,0|0,0,0]=2 3849 B9R0.5 CCCCOC(=O)CON MCULE-1664882724 [0,2,0,0,0,0|0,0,2]=4 3850 B9R0.5 CCCCOC(C)OCC MCULE-5544493274 [0,2,0,0,0,0|2,0,0]=4 3851 B9R0.5 CCCCSC(C)CCN MCULE-2976322552 [0,2,0,0,0,0|2,0,0]=4 3852 B9R0.5 COCCNC(C)COC MCULE-5142553741 [0,2,0,0,0,0|2,0,0]=4 3853 B9R0.8 CCCCC(=O)C(C)CC MCULE-4208435581 [0,2,0,0,0,0|2,0,0]=4 3854 B9R0.8 CCCCC(Br)C(=O)OC MCULE-4103872528 [0,2,0,0,0,0|1,0,1]=4 3855 B9R0.8 CCCCC(C)C(C)CC MCULE-4441142939 [0,2,0,0,0,0|2,0,0]=4 3856 B9R0.8 CCCCC(N)C(=O)OC MCULE-1230899944 [0,2,0,0,0,0|1,0,1]=4 3857 B9R0.8 CCCCC(N)C(=O)OC MCULE-8455548704 [0,2,0,0,0,0|1,0,1]=4 3858 B9R0.8 CCCCC(S)C(=O)OC MCULE-3094220494 [0,2,0,0,0,0|0,1,1]=4 3859 B9R0.8 CCCC[C@@H](N)C(=O)OC MCULE-3834316771 [0,2,0,0,0,0|1,0,1]=4 3860 B9R0.8 CCCC[C@@H](N)C(=O)OC MCULE-4089310144 [0,2,0,0,0,0|1,0,1]=4 3861 B9R0.8 CCCC[C@@H](N)C(=O)OC MCULE-8244695684 [0,2,0,0,0,0|1,0,1]=4 3862 B9R0.8 CCCC[C@@H](N)C(=O)OC MCULE-8512513571 [0,2,0,0,0,0|1,0,1]=4 3863 B9R0.8 CCCC[C@H](N)C(=O)OC MCULE-1675626630 [0,2,0,0,0,0|1,0,1]=4 3864 B9R0.8 CCCC[C@H](N)C(=O)OC MCULE-3850807479 [0,2,0,0,0,0|1,0,1]=4 3865 B9R0.8 CCCC[C@H](N)C(=O)OC MCULE-6677668966 [0,2,0,0,0,0|1,0,1]=4 3866 B9R0.8 CCCC[C@H](N)C(=O)OC MCULE-9798725861 [0,2,0,0,0,0|1,0,1]=4 3867 B9R0.8 CCCOC(=O)C(O)CO MCULE-8417972941 [0,2,0,0,0,0|0,0,1]=3 3868 B9R0.8 COC(=O)C(O)CCCBr MCULE-5891554758 [0,2,0,0,0,0|1,0,1]=4 3869 B9R0.8 COC(=O)C(O)CCSC MCULE-3114435129 [0,2,0,0,0,0|1,0,1]=4 3870 B9R0.8 COCCC(O)C(O)CO MCULE-8755237951 [0,2,0,0,0,0|0,0,0]=2 3871 B9R0.8 COCC[C@H](O)[C@H](O)CO MCULE-6552589711 [0,2,0,0,0,0|0,0,0]=2 3872 B9R0.18 CCCCC(C)CCCC MCULE-8127947187 [0,2,0,0,0,0|2,0,0]=4 3873 B9R0.18 CCCCC(N)CCCC MCULE-6345811578 [0,2,0,0,0,0|2,0,0]=4 3874 B9R0.18 CCCCC(O)CCCC MCULE-4443702940 [0,2,0,0,0,0|1,0,0]=3 3875 B9R0.18 CCCCC(O)CCCO MCULE-8337847504 [0,2,0,0,0,0|0,0,0]=2 3876 B9R0.18 CCOCC(N)COCC MCULE-3300220264 [0,2,0,0,0,0|2,0,0]=4 3877 B9R0.18 CCOCC(O)COCC MCULE-1541596863 [0,2,0,0,0,0|1,0,0]=3 3878 B9R0.34 CCCC(C)CC(C)CC MCULE-6332739976 [0,2,0,0,0,0|2,0,0]=4 3879 B9R0.34 CCOC(=O)CC(N)CO MCULE-1698986423 [0,2,0,0,0,0|1,0,1]=4 3880 B9R0.34 CCOC(=O)CC(N)CO MCULE-3133814849 [0,2,0,0,0,0|1,0,1]=4 3881 B9R0.34 CCOC(=O)CC(O)CC MCULE-1917822917 [0,2,0,0,0,0|1,0,1]=4 3882 B9R0.34 CCOC(=O)CC(O)CCl MCULE-2262718063 [0,2,0,0,0,0|1,0,1]=4 3883 B9R0.34 CCOC(=O)CC(O)CCl MCULE-5360276844 [0,2,0,0,0,0|1,0,1]=4 3884 B9R0.34 CCOC(=O)CC(O)CI MCULE-6198631807 [0,2,0,0,0,0|1,0,1]=4 3885 B9R0.34 CCOC(=O)CC(O)CO MCULE-8896194093 [0,2,0,0,0,0|0,0,1]=3 3886 B9R0.34 CCOC(=O)C[C@@H](O)CBr MCULE-5715312033 [0,2,0,0,0,0|1,0,1]=4 3887 B9R0.34 CCOC(=O)C[C@@H](O)CBr MCULE-5871241096 [0,2,0,0,0,0|1,0,1]=4 3888 B9R0.34 CCOC(=O)C[C@@H](O)CCl MCULE-7631433830 [0,2,0,0,0,0|1,0,1]=4 3889 B9R0.34 CCOC(=O)C[C@@H](O)CCl MCULE-9413705440 [0,2,0,0,0,0|1,0,1]=4 3890 B9R0.34 CCOC(=O)C[C@H](O)CBr MCULE-3856953058 [0,2,0,0,0,0|1,0,1]=4 3891 B9R0.34 CCOC(=O)C[C@H](O)CBr MCULE-8467993550 [0,2,0,0,0,0|1,0,1]=4 3892 B9R0.34 CCOC(=O)C[C@H](O)CCl MCULE-2512912579 [0,2,0,0,0,0|1,0,1]=4 3893 B9R0.34 CCOC(=O)C[C@H](O)CCl MCULE-4665153523 [0,2,0,0,0,0|1,0,1]=4 3894 B9R0.34 CCOC(=O)C[C@H](O)CI MCULE-7954654327 [0,2,0,0,0,0|1,0,1]=4 3895 B9R0.34 [C@@H](C)(CO)OC(C)OCC MCULE-1195285206 [0,2,0,0,0,0|2,0,0]=4 3896 B9R0.35 CCCC(=O)C(O)CCC MCULE-8800884172 [0,2,0,0,0,0|1,0,1]=4 3897 B9R0.35 CCCC(C)C(C)CCC MCULE-6352331898 [0,2,0,0,0,0|2,0,0]=4 3898 B9R0.35 CCCC(C)C(C)NCC MCULE-2966995580 [0,2,0,0,0,0|2,0,0]=4 3899 B9R0.35 CCCC(C)C(C)NCC MCULE-8532267003 [0,2,0,0,0,0|2,0,0]=4 3900 B9R0.35 CCCC(C)C(O)CCC MCULE-9443004795 [0,2,0,0,0,0|1,0,0]=3 3901 B9R0.35 CCOC(=O)C(O)COC MCULE-5467138480 [0,2,0,0,0,0|1,0,1]=4 3902 B9R0.35 COC[C@H](O)[C@@H](O)COC MCULE-8381238593 [0,2,0,0,0,0|1,0,0]=3 3903 B9R0.40 C=CCC(CC)CCCC MCULE-5009662741 [0,2,0,0,0,0|2,0,0]=4 3904 B9R0.40 CCCCC(C=O)CCC MCULE-8456289921 [0,2,0,0,0,0|1,0,1]=4 3905 B9R0.40 CCCCC(CC)CC=O MCULE-4596828512 [0,2,0,0,0,0|1,0,1]=4 3906 B9R0.40 CCCCC(CC)CCO MCULE-8613992811 [0,2,0,0,0,0|1,0,0]=3 3907 B9R0.40 CCCCC(CC)CNC MCULE-8166308391 [0,2,0,0,0,0|2,0,0]=4 3908 B9R0.40 CCCCC(CN)CCC MCULE-6624177155 [0,2,0,0,0,0|2,0,0]=4 3909 B9R0.40 CCOCC(CO)N=N#N MCULE-2488817055 [0,2,0,0,0,0|2,0,0]=4 3910 B9R0.48 COCC(C)OCC(C)O MCULE-1172706932 [0,2,0,0,0,0|2,0,0]=4 3911 B9R0.66 C#CCC(C)(O)CCCC MCULE-9817745412 [0,2,0,0,0,0|1,0,0]=3 3912 B9R0.66 C=CCC(C)(C)CCCC MCULE-5116572666 [0,2,0,0,0,0|2,0,0]=4 3913 B9R0.66 CC#CC(C)(O)CCCC MCULE-1354361871 [0,2,0,0,0,0|1,0,1]=4 3914 B9R0.66 CCCCC(C)(C)CCC MCULE-2470156995 [0,2,0,0,0,0|2,0,0]=4 3915 B9R0.66 CCCCS(=O)(=O)CCO MCULE-4005200632 [0,2,0,0,0,0|1,0,1]=4 3916 B9R0.66 COCC(C)(C)CCCN MCULE-3595015367 [0,2,0,0,0,0|2,0,0]=4 3917 B9R0.6 CCCC(C)C(N)C(=O)O MCULE-3481285649 [0,2,0,0,0,0|1,0,1]=4 3918 B9R0.6 CCCC(C)C(O)C(C)C MCULE-8969797324 [0,2,0,0,0,0|1,0,0]=3 3919 B9R0.6 CCCC(N)C(O)C(=O)N MCULE-3877102152 [0,2,0,0,0,0|0,0,2]=4 3920 B9R0.6 CCCC(N)C(O)C(=O)N MCULE-5998533545 [0,2,0,0,0,0|0,0,2]=4 3921 B9R0.6 CCCC(O)C(C)C(C)O MCULE-2897758601 [0,2,0,0,0,0|1,0,0]=3 3922 B9R0.6 CCCC(O)C(N)C(=O)O MCULE-5391337444 [0,2,0,0,0,0|1,0,1]=4 3923 B9R0.6 CCC[C@@H](N)C(O)C(=O)N MCULE-1873801018 [0,2,0,0,0,0|0,0,2]=4 3924 B9R0.6 CCC[C@@H](N)C(O)C(=O)N MCULE-5086135715 [0,2,0,0,0,0|0,0,2]=4 3925 B9R0.6 CCC[C@@H](N)[C@@H](O)C(=O)O MCULE-2918610954 [0,2,0,0,0,0|0,0,1]=3 3926 B9R0.6 CCC[C@@H](N)[C@H](O)C(=O)O MCULE-1958502407 [0,2,0,0,0,0|0,0,1]=3 3927 B9R0.6 CCC[C@H](N)C(O)C(=O)O MCULE-8649182139 [0,2,0,0,0,0|0,0,1]=3 3928 B9R0.6 C[C@H](O)[C@@H](O)[C@@H](O)CC=O MCULE-2872306796 [0,2,0,0,0,0|1,0,1]=4 3929 B9R0.6 C[C@H](O)[C@H](O)[C@@H](N)CC=O MCULE-2681463079 [0,2,0,0,0,0|1,0,1]=4 3930 B9R0.6 C[C@H](O)[C@H](O)[C@@H](N)CC=O MCULE-3703407559 [0,2,0,0,0,0|1,0,1]=4 3931 B9R0.19 CCCC(O)C(C)(C)CO MCULE-6796111058 [0,2,0,0,0,0|1,0,0]=3 3932 B9R0.19 CCOC(=O)C(C)(O)CO MCULE-2282982715 [0,2,0,0,0,0|1,0,1]=4 3933 B9R0.23 CC(O)CN(C)C(C)CO MCULE-4772326357 [0,2,0,0,0,0|2,0,0]=4 3934 B9R0.23 O=C(O)C[C@@H](O)[C@@H](O)CO MCULE-5394522095 [0,2,0,0,0,0|1,0,1]=4 3935 B9R0.23 O=C(O)C[C@H](O)[C@H](O)CO MCULE-2704229472 [0,2,0,0,0,0|1,0,1]=4 3936 B9R0.27 O=C(CO)C(O)C(O)CO MCULE-8935556784 [0,2,0,0,0,0|1,0,1]=4 3937 B9R0.27 O=C(CO)[C@@H](O)[C@@H](O)CO MCULE-2725905076 [0,2,0,0,0,0|1,0,1]=4 3938 B9R0.27 O=C(CO)[C@@H](O)[C@@H](O)CO MCULE-9876605173 [0,2,0,0,0,0|1,0,1]=4 3939 B9R0.27 O=C(CO)[C@@H](O)[C@H](O)CO MCULE-7865729102 [0,2,0,0,0,0|1,0,1]=4 3940 B9R0.27 O=C(CO)[C@@H](O)[C@H](O)CO MCULE-9552269577 [0,2,0,0,0,0|1,0,1]=4 3941 B9R0.27 O=C(CO)[C@H](O)[C@@H](O)CO MCULE-2032052659 [0,2,0,0,0,0|1,0,1]=4 3942 B9R0.27 O=C(CO)[C@H](O)[C@H](O)CO MCULE-5136624528 [0,2,0,0,0,0|1,0,1]=4 3943 B9R0.27 O=CC(O)C(O)C(O)CO MCULE-9562771067 [0,2,0,0,0,0|1,0,1]=4 3944 B9R0.27 O=C[C@@H](O)[C@@H](O)[C@@H](O)CO MCULE-1120126008 [0,2,0,0,0,0|1,0,1]=4 3945 B9R0.27 O=C[C@@H](O)[C@@H](O)[C@@H](O)CO MCULE-2723797968 [0,2,0,0,0,0|1,0,1]=4 3946 B9R0.27 O=C[C@@H](O)[C@@H](O)[C@H](O)CO MCULE-1190384749 [0,2,0,0,0,0|1,0,1]=4 3947 B9R0.27 O=C[C@@H](O)[C@@H](O)[C@H](O)CO MCULE-2266732421 [0,2,0,0,0,0|1,0,1]=4 3948 B9R0.27 O=C[C@@H](O)[C@H](O)[C@@H](O)CO MCULE-1097497548 [0,2,0,0,0,0|1,0,1]=4 3949 B9R0.27 O=C[C@@H](O)[C@H](O)[C@@H](O)CO MCULE-7909984167 [0,2,0,0,0,0|1,0,1]=4 3950 B9R0.27 O=C[C@@H](O)[C@H](O)[C@H](O)CO MCULE-1895838145 [0,2,0,0,0,0|1,0,1]=4 3951 B9R0.27 O=C[C@@H](O)[C@H](O)[C@H](O)CO MCULE-7112552451 [0,2,0,0,0,0|1,0,1]=4 3952 B9R0.27 O=C[C@H](O)[C@@H](F)[C@H](O)CO MCULE-6533146203 [0,2,0,0,0,0|1,0,1]=4 3953 B9R0.27 O=C[C@H](O)[C@@H](O)[C@@H](O)CO MCULE-2590073916 [0,2,0,0,0,0|1,0,1]=4 3954 B9R0.27 O=C[C@H](O)[C@@H](O)[C@@H](O)CO MCULE-9133960721 [0,2,0,0,0,0|1,0,1]=4 3955 B9R0.27 O=C[C@H](O)[C@@H](O)[C@H](O)CO MCULE-2277980048 [0,2,0,0,0,0|1,0,1]=4 3956 B9R0.27 O=C[C@H](O)[C@@H](O)[C@H](O)CO MCULE-2928575905 [0,2,0,0,0,0|1,0,1]=4 3957 B9R0.27 O=C[C@H](O)[C@H](O)[C@@H](O)CO MCULE-4972279660 [0,2,0,0,0,0|1,0,1]=4 3958 B9R0.27 O=C[C@H](O)[C@H](O)[C@@H](O)CO MCULE-6692095263 [0,2,0,0,0,0|1,0,1]=4 3959 B9R0.27 O=C[C@H](O)[C@H](O)[C@H](O)CO MCULE-7503149757 [0,2,0,0,0,0|1,0,1]=4 3960 B9R0.27 O=C[C@H](O)[C@H](O)[C@H](O)CO MCULE-9189507099 [0,2,0,0,0,0|1,0,1]=4 3961 B9R0.27 O=C[C@H](O)[C@H](O)[C@H](O)CO MCULE-9734013313 [0,2,0,0,0,0|1,0,1]=4 3962 B9R0.27 OCC(O)C(O)C(O)CO MCULE-9129572486 [0,2,0,0,0,0|1,0,0]=3 3963 B9R0.27 OC[C@@H](O)C(O)[C@H](O)CO MCULE-8306941933 [0,2,0,0,0,0|1,0,0]=3 3964 B9R0.27 OC[C@@H](O)C(O)[C@H](O)CO MCULE-9668936414 [0,2,0,0,0,0|1,0,0]=3 3965 B9R0.27 OC[C@H](O)C(O)[C@@H](O)CO MCULE-6137228639 [0,2,0,0,0,0|1,0,0]=3 3966 B9R0.27 OC[C@H](O)C(O)[C@@H](O)CO MCULE-9731864914 [0,2,0,0,0,0|1,0,0]=3 3967 B9R0.27 OC[C@H](O)[C@@H](O)[C@H](O)CO MCULE-6476329373 [0,2,0,0,0,0|1,0,0]=3 3968 B9R0.27 OC[C@H](O)[C@H](O)[C@H](O)CO MCULE-5168116503 [0,2,0,0,0,0|1,0,0]=3 3969 B9R0.37 CCCC(O)C(CC)CO MCULE-4462593004 [0,2,0,0,0,0|1,0,0]=3 3970 B9R0.37 CCOC(=O)C(CO)CO MCULE-6705009475 [0,2,0,0,0,0|1,0,1]=4 3971 B9R0.60 CCOC(C)(C)C(O)CBr MCULE-5830085250 [0,2,0,0,0,0|2,0,0]=4 3972 B9R0.1 CC(C)CCCC(C)CO MCULE-8737374566 [0,2,0,0,0,0|1,0,0]=3 3973 B9R0.1 CC(C)CNCC(Br)CBr MCULE-6255376245 [0,2,0,0,0,0|2,0,0]=4 3974 B9R0.1 CC(C)COCC(O)CN MCULE-5255759665 [0,2,0,0,0,0|1,0,0]=3 3975 B9R0.1 CC(C)COCC(O)CO MCULE-6665926443 [0,2,0,0,0,0|0,0,0]=2 3976 B9R0.1 CCC(C)CCCC(C)C MCULE-1067814067 [0,2,0,0,0,0|2,0,0]=4 3977 B9R0.1 C[C@@H](N)COC[C@H](O)CCl MCULE-1215329842 [0,2,0,0,0,0|1,0,0]=3 3978 B9R0.1 C[C@@H](N)COC[C@H](O)CCl MCULE-1680848350 [0,2,0,0,0,0|1,0,0]=3 3979 B9R0.1 O=C(O)CCCC(O)CO MCULE-8338266320 [0,2,0,0,0,0|0,0,1]=3 3980 B9R0.20 CCCCCC(C)(C)CC MCULE-1624392380 [0,2,0,0,0,0|2,0,0]=4 3981 B9R0.20 CCCCCC(C)(C)CN MCULE-5282463066 [0,2,0,0,0,0|2,0,0]=4 3982 B9R0.20 CCCCCC(C)(O)CC MCULE-1815029739 [0,2,0,0,0,0|1,0,0]=3 3983 B9R0.24 BrCC(Br)CCC(Br)CBr MCULE-6348087119 [0,2,0,0,0,0|2,0,0]=4 3984 B9R0.24 CCC(C)CCC(C)CO MCULE-2874782306 [0,2,0,0,0,0|1,0,0]=3 3985 B9R0.24 CCC(O)CCC(O)CC MCULE-1642680986 [0,2,0,0,0,0|1,0,0]=3 3986 B9R0.24 CC[C@@H](O)CC[C@H](O)CC MCULE-1865073881 [0,2,0,0,0,0|1,0,0]=3 3987 B9R0.24 CC[C@@H](O)CC[C@H](O)CC MCULE-3722023249 [0,2,0,0,0,0|1,0,0]=3 3988 B9R0.24 CC[C@H](O)CC[C@@H](O)CC MCULE-2960364022 [0,2,0,0,0,0|1,0,0]=3 3989 B9R0.24 CC[C@H](O)CC[C@@H](O)CC MCULE-6575186172 [0,2,0,0,0,0|1,0,0]=3 3990 B9R0.24 COC(C)COC(C)CO MCULE-2586481016 [0,2,0,0,0,0|2,0,0]=4 3991 B9R0.24 O=C(CCl)NCC(O)CO MCULE-8204242344 [0,2,0,0,0,0|1,0,1]=4 3992 B9R0.24 O=C(CS)OCC(O)CO MCULE-2071903342 [0,2,0,0,0,0|1,0,1]=4 3993 B9R0.46 C#CC(O)CCCCCBr MCULE-4507050415 [0,2,0,0,0,0|1,0,1]=4 3994 B9R0.46 C#CC(O)CCCCCC MCULE-7473928469 [0,2,0,0,0,0|1,0,1]=4 3995 B9R0.46 C=CC(O)CCCCCC MCULE-8553741195 [0,2,0,0,0,0|1,0,1]=4 3996 B9R0.46 C=CCCCCC(O)CN MCULE-2170358695 [0,2,0,0,0,0|1,0,0]=3 3997 B9R0.46 C=CCCCCC(O)CO MCULE-9731075660 [0,2,0,0,0,0|0,0,0]=2 3998 B9R0.46 CCC(C)CCCCCO MCULE-2502680966 [0,2,0,0,0,0|2,0,0]=4 3999 B9R0.46 CCC(C)NCCCNC MCULE-3630027564 [0,2,0,0,0,0|2,0,0]=4 4000 B9R0.46 CCCCCCC(Br)CBr MCULE-3379995276 [0,2,0,0,0,0|2,0,0]=4 4001 B9R0.46 CCCCCCC(C)CBr MCULE-4123455914 [0,2,0,0,0,0|2,0,0]=4 4002 B9R0.46 CCCCCCC(C)CC MCULE-3624776298 [0,2,0,0,0,0|2,0,0]=4 4003 B9R0.46 CCCCCCC(C)CO MCULE-7202468291 [0,2,0,0,0,0|1,0,0]=3 4004 B9R0.46 CCCCCCC(Cl)CCl MCULE-7909703582 [0,2,0,0,0,0|2,0,0]=4 4005 B9R0.46 CCCCCCC(O)CBr MCULE-4248488641 [0,2,0,0,0,0|1,0,0]=3 4006 B9R0.46 CCCCCCC(O)CC MCULE-7543978401 [0,2,0,0,0,0|1,0,0]=3 4007 B9R0.46 CCCCCCC(O)CO MCULE-7396593748 [0,2,0,0,0,0|0,0,0]=2 4008 B9R0.46 CCCCCC[C@@H](O)CO MCULE-9540453574 [0,2,0,0,0,0|0,0,0]=2 4009 B9R0.46 CCCCCC[C@H](O)CO MCULE-8481484883 [0,2,0,0,0,0|0,0,0]=2 4010 B9R0.46 CCCCOCC(O)CC MCULE-2411357752 [0,2,0,0,0,0|1,0,0]=3 4011 B9R0.46 CCCCOCC(O)CCl MCULE-6855689044 [0,2,0,0,0,0|1,0,0]=3 4012 B9R0.46 CCCCOCC(O)CN MCULE-1971283908 [0,2,0,0,0,0|1,0,0]=3 4013 B9R0.46 CCCCOCC(O)CO MCULE-8662748140 [0,2,0,0,0,0|0,0,0]=2 4014 B9R0.46 CCCCSCC(O)CO MCULE-8665487683 [0,2,0,0,0,0|0,0,0]=2 4015 B9R0.46 CC[C@H](C)CCCCCO MCULE-2345749211 [0,2,0,0,0,0|2,0,0]=4 4016 B9R0.46 CC[C@H](C)CCCCCO MCULE-9450083737 [0,2,0,0,0,0|2,0,0]=4 4017 B9R0.46 COCCOCC(O)CCl MCULE-7963737892 [0,2,0,0,0,0|1,0,0]=3 4018 B9R0.46 OCCCCCC(O)CO MCULE-1241763539 [0,2,0,0,0,0|0,0,0]=2 4019 B9R0.47 C(N)(CCCCN)C(=O)O MCULE-7060791798 [0,2,0,0,0,0|1,0,1]=4 4020 B9R0.47 CCCC=CC(O)C(=O)O MCULE-9096490162 [0,2,0,0,0,0|0,0,2]=4 4021 B9R0.47 CCCCCC(C)C(=O)O MCULE-3831811055 [0,2,0,0,0,0|1,0,1]=4 4022 B9R0.47 CCCCCC(C)C(C)C MCULE-2636833283 [0,2,0,0,0,0|2,0,0]=4 4023 B9R0.47 CCCCCC(Cl)C(C)Cl MCULE-3130271642 [0,2,0,0,0,0|2,0,0]=4 4024 B9R0.47 CCCCCC(N)C(=O)O MCULE-5558679374 [0,2,0,0,0,0|1,0,1]=4 4025 B9R0.47 CCCCCC(N)C(=O)O MCULE-8607576790 [0,2,0,0,0,0|1,0,1]=4 4026 B9R0.47 CCCCCC(O)C(=O)O MCULE-4151749430 [0,2,0,0,0,0|0,0,1]=3 4027 B9R0.47 CCCCCC(O)C(C)C MCULE-1365333754 [0,2,0,0,0,0|1,0,0]=3 4028 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-3981603450 [0,2,0,0,0,0|1,0,1]=4 4029 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-6090735433 [0,2,0,0,0,0|1,0,1]=4 4030 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-8108024359 [0,2,0,0,0,0|1,0,1]=4 4031 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-9961773652 [0,2,0,0,0,0|1,0,1]=4 4032 B9R0.47 CCCCOC(=O)C(C)O MCULE-5462693192 [0,2,0,0,0,0|0,0,2]=4 4033 B9R0.47 CCCCOC(=O)C(O)O MCULE-4196473277 [0,2,0,0,0,0|0,0,2]=4 4034 B9R0.47 CCCCOC(=O)[C@H](C)O MCULE-5423028657 [0,2,0,0,0,0|0,0,2]=4 4035 B9R0.47 CCCCOC(=O)[C@H](C)O MCULE-8076552166 [0,2,0,0,0,0|0,0,2]=4 4036 B9R0.47 CCCCOC(C)C(=O)O MCULE-2711768240 [0,2,0,0,0,0|1,0,1]=4 4037 B9R0.47 CCCCSC(C)C(=O)O MCULE-1538375330 [0,2,0,0,0,0|1,0,1]=4 4038 B9R0.47 CCCOCC(N)C(C)C MCULE-6320176513 [0,2,0,0,0,0|2,0,0]=4 4039 B9R0.47 CCCOCC(N)C(C)C MCULE-7805441914 [0,2,0,0,0,0|2,0,0]=4 4040 B9R0.47 CCCSCC(N)C(=O)O MCULE-1465196294 [0,2,0,0,0,0|1,0,1]=4 4041 B9R0.47 CCCSCC(N)C(=O)O MCULE-2196835186 [0,2,0,0,0,0|1,0,1]=4 4042 B9R0.47 CCCSC[C@H](N)C(=O)O MCULE-2274873569 [0,2,0,0,0,0|1,0,1]=4 4043 B9R0.47 CCNCCC(N)C(=O)O MCULE-8873123795 [0,2,0,0,0,0|1,0,1]=4 4044 B9R0.47 CCSCCC(N)C(=O)O MCULE-8503033566 [0,2,0,0,0,0|1,0,1]=4 4045 B9R0.47 CCSCCC(N)C(=O)O MCULE-9465623190 [0,2,0,0,0,0|1,0,1]=4 4046 B9R0.47 CCSCC[C@@H](N)C(=O)O MCULE-2836325620 [0,2,0,0,0,0|1,0,1]=4 4047 B9R0.47 CCSCC[C@H](N)C(=O)O MCULE-6614300528 [0,2,0,0,0,0|1,0,1]=4 4048 B9R0.47 CC[Se]CCC(N)C(=O)O MCULE-7426703933 [0,2,0,0,0,0|1,0,1]=4 4049 B9R0.47 COCCCC(C)C(=O)O MCULE-7159772792 [0,2,0,0,0,0|1,0,1]=4 4050 B9R0.47 NC(CCCCO)C(=O)O MCULE-7372730935 [0,2,0,0,0,0|1,0,1]=4 4051 B9R0.47 NCCCCC(N)C(=O)O MCULE-1411873021 [0,2,0,0,0,0|1,0,1]=4 4052 B9R0.47 NCCCCC(N)C(=O)O MCULE-1436032977 [0,2,0,0,0,0|1,0,1]=4 4053 B9R0.47 NCCCCC(N)C(=O)O MCULE-5737537430 [0,2,0,0,0,0|1,0,1]=4 4054 B9R0.47 NCCCCC(N)C(=O)O MCULE-6537319758 [0,2,0,0,0,0|1,0,1]=4 4055 B9R0.47 NCCCCC(N)C(=O)O MCULE-9665753367 [0,2,0,0,0,0|1,0,1]=4 4056 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2051883110 [0,2,0,0,0,0|1,0,1]=4 4057 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2174845427 [0,2,0,0,0,0|1,0,1]=4 4058 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7229907816 [0,2,0,0,0,0|1,0,1]=4 4059 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7646209988 [0,2,0,0,0,0|1,0,1]=4 4060 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-1814780282 [0,2,0,0,0,0|1,0,1]=4 4061 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2585671029 [0,2,0,0,0,0|1,0,1]=4 4062 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2735109468 [0,2,0,0,0,0|1,0,1]=4 4063 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-3226089160 [0,2,0,0,0,0|1,0,1]=4 4064 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-4736099943 [0,2,0,0,0,0|1,0,1]=4 4065 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5602916309 [0,2,0,0,0,0|1,0,1]=4 4066 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5669080418 [0,2,0,0,0,0|1,0,1]=4 4067 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5771120494 [0,2,0,0,0,0|1,0,1]=4 4068 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-6467055628 [0,2,0,0,0,0|1,0,1]=4 4069 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7268734331 [0,2,0,0,0,0|1,0,1]=4 4070 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7702716758 [0,2,0,0,0,0|1,0,1]=4 4071 B9R0.47 NCCCC[C@H]([NH3+])C(=O)O MCULE-1421201563 [0,2,0,0,0,0|1,0,1]=4 4072 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-1855458643 [0,2,0,0,0,0|1,0,1]=4 4073 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-3280637244 [0,2,0,0,0,0|1,0,1]=4 4074 B9R0.47 O=C(O)C(Br)CCCCBr MCULE-9265332965 [0,2,0,0,0,0|1,0,1]=4 4075 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-2676284364 [0,2,0,0,0,0|1,0,1]=4 4076 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-3536027321 [0,2,0,0,0,0|1,0,1]=4 4077 B9R0.47 [C@H](N)(CCNCC)C(=O)O MCULE-8327043663 [0,2,0,0,0,0|1,0,1]=4 4078 B9R0.50 CCC(CC)CCCNC MCULE-5807279832 [0,2,0,0,0,0|2,0,0]=4 4079 B9R0.50 CCC(CC)CCCNC MCULE-6064247246 [0,2,0,0,0,0|2,0,0]=4 4080 B9R0.50 CCCCCC(C=O)CC MCULE-2036961521 [0,2,0,0,0,0|1,0,1]=4 4081 B9R0.50 CCCCCC(CC)CC MCULE-6306174845 [0,2,0,0,0,0|2,0,0]=4 4082 B9R0.50 CCCCCC(CO)CO MCULE-5254181477 [0,2,0,0,0,0|0,0,0]=2 4083 B9R0.50 CCCCCC(OC)OC MCULE-8808414526 [0,2,0,0,0,0|2,0,0]=4 4084 B9R0.50 COC(CCCCN)OC MCULE-2878649881 [0,2,0,0,0,0|2,0,0]=4 4085 B9R0.50 NCCCCC(CO)CO MCULE-9856529758 [0,2,0,0,0,0|0,0,0]=2 4086 B9R0.3 C(N)(CCSC)C(C)(C)O MCULE-7544508587 [0,2,0,0,0,0|2,0,0]=4 4087 B9R0.3 C(N)(CCSC)C(C)(C)O MCULE-8202006517 [0,2,0,0,0,0|2,0,0]=4 4088 B9R0.3 CCCCC(Br)C(F)(F)F MCULE-2824502322 [0,2,0,0,0,0|2,0,0]=4 4089 B9R0.3 CCCCC(N)C(F)(F)F MCULE-4772682374 [0,2,0,0,0,0|2,0,0]=4 4090 B9R0.3 CCCCC(N)P(=O)(O)O MCULE-6746003648 [0,2,0,0,0,0|2,0,0]=4 4091 B9R0.3 CCCCC(O)C(C)(C)C MCULE-4746639726 [0,2,0,0,0,0|1,0,0]=3 4092 B9R0.3 CCCC[C@@H](N)C(F)(F)F MCULE-5519593858 [0,2,0,0,0,0|2,0,0]=4 4093 B9R0.3 CCCC[C@@H](N)C(F)(F)F MCULE-7026955079 [0,2,0,0,0,0|2,0,0]=4 4094 B9R0.3 CCCC[C@@H](N)C(F)(F)F MCULE-8152799040 [0,2,0,0,0,0|2,0,0]=4 4095 B9R0.3 CCCC[C@H](N)C(F)(F)F MCULE-5692883882 [0,2,0,0,0,0|2,0,0]=4 4096 B9R0.3 CCCC[C@H](N)C(F)(F)F MCULE-6815873903 [0,2,0,0,0,0|2,0,0]=4 4097 B9R0.3 CCCC[C@H](N)C(F)(F)F MCULE-9790815885 [0,2,0,0,0,0|2,0,0]=4 4098 B9R0.3 CCCC[C@H](O)C(F)(F)F MCULE-7202569729 [0,2,0,0,0,0|1,0,0]=3 4099 B9R0.3 COCCC(O)C(C)(C)C MCULE-5489491260 [0,2,0,0,0,0|2,0,0]=4 4100 B9R0.3 CSCCC(N)C(C)(C)O MCULE-3424813820 [0,2,0,0,0,0|2,0,0]=4 4101 B9R0.3 CSCCC(N)C(C)(C)O MCULE-8866627958 [0,2,0,0,0,0|2,0,0]=4 4102 B9R0.3 CSCC[C@@H](N)C(C)(C)O MCULE-1314538644 [0,2,0,0,0,0|2,0,0]=4 4103 B9R0.3 CSCC[C@@H](N)C(C)(C)O MCULE-6475773659 [0,2,0,0,0,0|2,0,0]=4 4104 B9R0.3 CSCC[C@@H](N)C(C)(C)O MCULE-7880752352 [0,2,0,0,0,0|2,0,0]=4 4105 B9R0.3 CSCC[C@@H](N)C(C)(C)O MCULE-9319403199 [0,2,0,0,0,0|2,0,0]=4 4106 B9R0.3 CSCC[C@H](N)C(C)(C)O MCULE-3286830056 [0,2,0,0,0,0|2,0,0]=4 4107 B9R0.3 CSCC[C@H](N)C(C)(C)O MCULE-4360953563 [0,2,0,0,0,0|2,0,0]=4 4108 B9R0.7 CC(C)CCC(C)C(=O)O MCULE-8295273403 [0,2,0,0,0,0|1,0,1]=4 4109 B9R0.7 CC(C)CCC(C)C(C)O MCULE-8246604586 [0,2,0,0,0,0|1,0,0]=3 4110 B9R0.7 CC(C)CCC(F)C(=O)O MCULE-1179378327 [0,2,0,0,0,0|1,0,1]=4 4111 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-1719574078 [0,2,0,0,0,0|1,0,1]=4 4112 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-7494642848 [0,2,0,0,0,0|1,0,1]=4 4113 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-7934601656 [0,2,0,0,0,0|1,0,1]=4 4114 B9R0.7 CC(C)CC[C@@H](N)C(=O)O MCULE-3738071496 [0,2,0,0,0,0|1,0,1]=4 4115 B9R0.7 CC(C)CC[C@@H](N)C(=O)O MCULE-6646418122 [0,2,0,0,0,0|1,0,1]=4 4116 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-1152840736 [0,2,0,0,0,0|1,0,1]=4 4117 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-2931632246 [0,2,0,0,0,0|1,0,1]=4 4118 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-6463365282 [0,2,0,0,0,0|1,0,1]=4 4119 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-7649870164 [0,2,0,0,0,0|1,0,1]=4 4120 B9R0.7 CN(C)CCC(O)C(=O)O MCULE-7034022816 [0,2,0,0,0,0|1,0,1]=4 4121 B9R0.13 CCC(CCOC)C(=O)O MCULE-9329790915 [0,2,0,0,0,0|2,0,0]=4 4122 B9R0.13 CCCCC(CC)C(=O)C MCULE-6594996935 [0,2,0,0,0,0|1,0,1]=4 4123 B9R0.13 CCCCC(CC)C(=O)Cl MCULE-5129133966 [0,2,0,0,0,0|1,0,1]=4 4124 B9R0.13 CCCCC(CC)C(=O)N MCULE-6741704780 [0,2,0,0,0,0|1,0,1]=4 4125 B9R0.13 CCCCC(CC)C(=O)O MCULE-5686478683 [0,2,0,0,0,0|1,0,0]=3 4126 B9R0.13 CCCCC(CC)C(=O)[O-] MCULE-6405828438 [0,2,0,0,0,0|1,0,1]=4 4127 B9R0.13 CCCCC(CC)C(=O)[O-] MCULE-6841285360 [0,2,0,0,0,0|1,0,1]=4 4128 B9R0.13 CCCCC(CC)C(=O)[O-] MCULE-9345456808 [0,2,0,0,0,0|1,0,1]=4 4129 B9R0.13 CCCCC(CC)C(C)O MCULE-1362746509 [0,2,0,0,0,0|1,0,0]=3 4130 B9R0.13 CCCCC(CN)C(=O)O MCULE-6509321720 [0,2,0,0,0,0|1,0,0]=3 4131 B9R0.13 CCCCC(CO)C(=O)C MCULE-8991511326 [0,2,0,0,0,0|0,0,1]=3 4132 B9R0.13 CCCCC(CO)C(=O)O MCULE-7586035948 [0,2,0,0,0,0|0,0,0]=2 4133 B9R0.13 CCCCC(CO)N(C)C MCULE-2872029159 [0,2,0,0,0,0|1,0,0]=3 4134 B9R0.13 CCCCC(NC)C(=O)O MCULE-1290797295 [0,2,0,0,0,0|1,0,1]=4 4135 B9R0.13 CCCCC(OC)C(=O)O MCULE-4251070702 [0,2,0,0,0,0|0,0,1]=3 4136 B9R0.13 CCCC[C@@H](CC)C(=O)O MCULE-3017621334 [0,2,0,0,0,0|1,0,0]=3 4137 B9R0.13 CCCC[C@@H](CC)C(=O)O MCULE-9782965208 [0,2,0,0,0,0|1,0,0]=3 4138 B9R0.13 CCCC[C@@H](CN)C(=O)O MCULE-8769717308 [0,2,0,0,0,0|1,0,0]=3 4139 B9R0.13 CCCC[C@@H](CO)C(=O)O MCULE-4035754044 [0,2,0,0,0,0|0,0,0]=2 4140 B9R0.13 CCCC[C@H](CC)C(=O)O MCULE-7435371149 [0,2,0,0,0,0|1,0,0]=3 4141 B9R0.13 CCCC[C@H](CN)C(=O)O MCULE-3507398764 [0,2,0,0,0,0|1,0,0]=3 4142 B9R0.13 CCCC[C@H](CO)C(=O)O MCULE-1956509117 [0,2,0,0,0,0|0,0,0]=2 4143 B9R0.13 CCCC[C@H](CO)C(=O)O MCULE-3776577040 [0,2,0,0,0,0|0,0,0]=2 4144 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-2734051077 [0,2,0,0,0,0|1,0,1]=4 4145 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-3251368399 [0,2,0,0,0,0|1,0,1]=4 4146 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-5821422660 [0,2,0,0,0,0|1,0,1]=4 4147 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-6933942099 [0,2,0,0,0,0|1,0,1]=4 4148 B9R0.13 COC(CCSC)C(=O)O MCULE-2968161259 [0,2,0,0,0,0|1,0,1]=4 4149 B9R0.42 CCC(C)CC(C)C(=O)O MCULE-6856405301 [0,2,0,0,0,0|1,0,1]=4 4150 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-1321158720 [0,2,0,0,0,0|1,0,1]=4 4151 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-9833457318 [0,2,0,0,0,0|1,0,1]=4 4152 B9R0.42 C[C@@H](O)[C@@H](O)C[C@H](O)C=O MCULE-5279849864 [0,2,0,0,0,0|0,0,2]=4 4153 B9R0.42 C[C@@H](O)[C@H](O)C[C@H](O)C=O MCULE-8179219296 [0,2,0,0,0,0|0,0,2]=4 4154 B9R0.51 CCCCC(C)(C)C(=O)O MCULE-6533628152 [0,2,0,0,0,0|1,0,1]=4 4155 B9R0.51 CCCCC(C)(F)C(=O)O MCULE-3264455202 [0,2,0,0,0,0|1,0,1]=4 4156 B9R0.51 CCCCC(C)(O)C(=O)O MCULE-4036610380 [0,2,0,0,0,0|0,0,1]=3 4157 B9R0.51 CCCCC(C)(O)C(C)C MCULE-4297356515 [0,2,0,0,0,0|1,0,0]=3 4158 B9R0.51 CCCCC(F)(F)C(=O)O MCULE-3383573238 [0,2,0,0,0,0|1,0,1]=4 4159 B9R0.21 C(O)(CO)CNC(C)(C)C MCULE-9700754351 [0,2,0,0,0,0|1,0,0]=3 4160 B9R0.21 CC(C)(C)CCC(N)CO MCULE-1507788372 [0,2,0,0,0,0|1,0,0]=3 4161 B9R0.21 CC(C)(C)CCC(N)CO MCULE-9142703528 [0,2,0,0,0,0|1,0,0]=3 4162 B9R0.21 CC(C)(C)NCC(O)CCl MCULE-7725971425 [0,2,0,0,0,0|2,0,0]=4 4163 B9R0.21 CC(C)(C)NCC(O)CCl MCULE-9636152377 [0,2,0,0,0,0|2,0,0]=4 4164 B9R0.21 CC(C)(C)NCC(O)CO MCULE-7781129065 [0,2,0,0,0,0|1,0,0]=3 4165 B9R0.21 CC(C)(C)NC[C@@H](O)CO MCULE-4279212857 [0,2,0,0,0,0|1,0,0]=3 4166 B9R0.21 CC(C)(C)NC[C@H](O)CO MCULE-6845542780 [0,2,0,0,0,0|1,0,0]=3 4167 B9R0.21 CC(C)(C)OCC(N)CO MCULE-6617875163 [0,2,0,0,0,0|2,0,0]=4 4168 B9R0.21 CC(C)(C)OCC(O)CN MCULE-9563883705 [0,2,0,0,0,0|2,0,0]=4 4169 B9R0.21 CC(C)(C)OCC(O)CO MCULE-1874240697 [0,2,0,0,0,0|1,0,0]=3 4170 B9R0.21 [C@@H](O)(CO)CNC(C)(C)C MCULE-1430136501 [0,2,0,0,0,0|1,0,0]=3 4171 B9R0.21 [C@H](O)(CO)CNC(C)(C)C MCULE-8453735998 [0,2,0,0,0,0|1,0,0]=3 4172 B9R0.43 CC(=CCC(CO)CO)C MCULE-5299024294 [0,2,0,0,0,0|0,0,2]=4 4173 B9R0.43 CCC(CC)CCC(C)O MCULE-8617358020 [0,2,0,0,0,0|2,0,0]=4 4174 B9R0.43 CCC(CO)CCC(=O)C MCULE-7352596779 [0,2,0,0,0,0|1,0,1]=4 4175 B9R0.43 CCC(CO)CCC(C)O MCULE-3799427279 [0,2,0,0,0,0|1,0,0]=3 4176 B9R0.43 CNC(CO)COC(C)C MCULE-6090466804 [0,2,0,0,0,0|2,0,0]=4 4177 B9R0.43 CNC(CO)COC(C)C MCULE-7756381716 [0,2,0,0,0,0|2,0,0]=4 4178 B9R0.64 C#CC(C)(O)CCC(C)C MCULE-4122988785 [0,2,0,0,0,0|1,0,1]=4 4179 B9R0.64 CC(C)CCC(C)(O)CN MCULE-2111563354 [0,2,0,0,0,0|1,0,0]=3 4180 B9R0.64 CC(O)CNC(C)(C)CO MCULE-9233392952 [0,2,0,0,0,0|2,0,0]=4 4181 B9R0.64 CCC(C)(O)CCC(C)C MCULE-8172479496 [0,2,0,0,0,0|1,0,0]=3 4182 B9R0.64 CN(C)CCC(C)(O)CN MCULE-3953490763 [0,2,0,0,0,0|2,0,0]=4 4183 B9R0.64 CN(C)CCC(C)(O)CN MCULE-6318060047 [0,2,0,0,0,0|2,0,0]=4 4184 B9R0.26 CCC(O)CN(CC)CC MCULE-2420595706 [0,2,0,0,0,0|2,0,0]=4 4185 B9R0.26 CCN(CC)CC(C)CO MCULE-5104369830 [0,2,0,0,0,0|2,0,0]=4 4186 B9R0.26 CCN(CC)CC(N)CO MCULE-1161110905 [0,2,0,0,0,0|2,0,0]=4 4187 B9R0.26 CCN(CC)CC(O)CCl MCULE-7082119748 [0,2,0,0,0,0|2,0,0]=4 4188 B9R0.26 CCN(CC)CC(O)CN MCULE-3910430481 [0,2,0,0,0,0|2,0,0]=4 4189 B9R0.26 CCN(CC)CC(O)CO MCULE-1860703650 [0,2,0,0,0,0|1,0,0]=3 4190 B9R0.67 C#CC(O)(CC)CCCC MCULE-7912049261 [0,2,0,0,0,0|1,0,0]=3 4191 B9R0.67 C=CC(C)(CO)CCOC MCULE-3414006165 [0,2,0,0,0,0|2,0,0]=4 4192 B9R0.67 CCC(O)(CN)CCCO MCULE-2321305458 [0,2,0,0,0,0|2,0,0]=4 4193 B9R0.67 CCC(O)(CN)CCCO MCULE-8592504917 [0,2,0,0,0,0|2,0,0]=4 4194 B9R0.67 CCCCC(C)(CC)CC MCULE-3244116618 [0,2,0,0,0,0|2,0,0]=4 4195 B9R0.22 CCC(=O)CC(C)(O)CC MCULE-6647150636 [0,2,0,0,0,0|1,0,1]=4 4196 B9R0.22 CCC(C)CC(C)(O)CC MCULE-1418889839 [0,2,0,0,0,0|1,0,0]=3 4197 B9R0.22 COC(C)(C)CC(N)CO MCULE-2178344283 [0,2,0,0,0,0|2,0,0]=4 4198 B9R0.22 COC(C)(C)CC(O)CN MCULE-1794152445 [0,2,0,0,0,0|2,0,0]=4 4199 B7R1.1 BrCC1CCCC1 MCULE-2472505847 [1,0,0,1,0,0|2,0,0]=4 4200 B7R1.1 BrCC1CCCN1 MCULE-2152950124 [1,0,0,1,0,0|2,0,0]=4 4201 B7R1.1 BrCC1CCCN1 MCULE-6083580584 [1,0,0,1,0,0|2,0,0]=4 4202 B7R1.1 BrCC1CCCN1 MCULE-8116807965 [1,0,0,1,0,0|2,0,0]=4 4203 B7R1.1 BrCC1CCCO1 MCULE-6801721633 [1,0,0,1,0,0|1,0,0]=3 4204 B7R1.1 BrCC1OCCO1 MCULE-4843503125 [1,0,0,1,0,0|2,0,0]=4 4205 B7R1.1 BrC[C@@H]1CCCN1 MCULE-2609238545 [1,0,0,1,0,0|2,0,0]=4 4206 B7R1.1 BrC[C@@H]1CCCN1 MCULE-4300877722 [1,0,0,1,0,0|2,0,0]=4 4207 B7R1.1 BrC[C@@H]1CCCN1 MCULE-7501559292 [1,0,0,1,0,0|2,0,0]=4 4208 B7R1.1 BrC[C@@H]1CCCN1 MCULE-9528927495 [1,0,0,1,0,0|2,0,0]=4 4209 B7R1.1 BrC[C@H]1CCCO1 MCULE-3468061610 [1,0,0,1,0,0|1,0,0]=3 4210 B7R1.1 BrC[C@H]1CCCO1 MCULE-9305844681 [1,0,0,1,0,0|1,0,0]=3 4211 B7R1.1 C#CC1CCCO1 MCULE-5501627253 [1,0,0,1,0,0|1,0,1]=4 4212 B7R1.1 C1(CCCN1)CF MCULE-2705678622 [1,0,0,1,0,0|2,0,0]=4 4213 B7R1.1 C1(CCCN1)CF MCULE-3175080744 [1,0,0,1,0,0|2,0,0]=4 4214 B7R1.1 C1(CCCN1)CN MCULE-3568349121 [1,0,0,1,0,0|2,0,0]=4 4215 B7R1.1 C1(CCCN1)CN MCULE-9944820727 [1,0,0,1,0,0|2,0,0]=4 4216 B7R1.1 C1(CCCN1)CO MCULE-7277085817 [1,0,0,1,0,0|1,0,0]=3 4217 B7R1.1 C1(CCNC1)CO MCULE-7897000858 [1,0,0,1,0,0|2,0,0]=4 4218 B7R1.1 C1(CCNC1)CO MCULE-9939548436 [1,0,0,1,0,0|2,0,0]=4 4219 B7R1.1 C1(CCOC1)CO MCULE-2350780678 [1,0,0,1,0,0|2,0,0]=4 4220 B7R1.1 CCC1CCCC1 MCULE-1974854934 [1,0,0,1,0,0|2,0,0]=4 4221 B7R1.1 CCC1CCCN1 MCULE-1775351089 [1,0,0,1,0,0|2,0,0]=4 4222 B7R1.1 CCC1CCCN1 MCULE-2065682250 [1,0,0,1,0,0|2,0,0]=4 4223 B7R1.1 CCC1CCCN1 MCULE-8326168982 [1,0,0,1,0,0|2,0,0]=4 4224 B7R1.1 CCC1CCCN1 MCULE-9831560442 [1,0,0,1,0,0|2,0,0]=4 4225 B7R1.1 CCC1OCCO1 MCULE-3434568584 [1,0,0,1,0,0|2,0,0]=4 4226 B7R1.1 CC[C@@H]1CCCN1 MCULE-1829706908 [1,0,0,1,0,0|2,0,0]=4 4227 B7R1.1 CC[C@@H]1CCCN1 MCULE-6310895621 [1,0,0,1,0,0|2,0,0]=4 4228 B7R1.1 CC[C@@H]1CCCN1 MCULE-6770634475 [1,0,0,1,0,0|2,0,0]=4 4229 B7R1.1 CC[C@@H]1CCCN1 MCULE-9259891597 [1,0,0,1,0,0|2,0,0]=4 4230 B7R1.1 CC[C@H]1CCCN1 MCULE-2347458277 [1,0,0,1,0,0|2,0,0]=4 4231 B7R1.1 CC[C@H]1CCCN1 MCULE-3796565634 [1,0,0,1,0,0|2,0,0]=4 4232 B7R1.1 CC[C@H]1CCCN1 MCULE-6193768639 [1,0,0,1,0,0|2,0,0]=4 4233 B7R1.1 CC[C@H]1CCCN1 MCULE-9679619003 [1,0,0,1,0,0|2,0,0]=4 4234 B7R1.1 COC1CCCO1 MCULE-8363423240 [1,0,0,1,0,0|2,0,0]=4 4235 B7R1.1 ClCC1CCCC1 MCULE-7652893931 [1,0,0,1,0,0|2,0,0]=4 4236 B7R1.1 ClCC1CCCN1 MCULE-3656101962 [1,0,0,1,0,0|2,0,0]=4 4237 B7R1.1 ClCC1CCCN1 MCULE-9792407426 [1,0,0,1,0,0|2,0,0]=4 4238 B7R1.1 ClCC1CCCO1 MCULE-9816764842 [1,0,0,1,0,0|1,0,0]=3 4239 B7R1.1 ClCC1OCCO1 MCULE-2722734837 [1,0,0,1,0,0|2,0,0]=4 4240 B7R1.1 ClC[C@@H]1CCCN1 MCULE-1712418178 [1,0,0,1,0,0|2,0,0]=4 4241 B7R1.1 ClC[C@@H]1CCCN1 MCULE-2092217865 [1,0,0,1,0,0|2,0,0]=4 4242 B7R1.1 ClC[C@@H]1CCCN1 MCULE-4473753787 [1,0,0,1,0,0|2,0,0]=4 4243 B7R1.1 ClC[C@@H]1CCCN1 MCULE-9545872560 [1,0,0,1,0,0|2,0,0]=4 4244 B7R1.1 ClC[C@H]1CCCN1 MCULE-1186865731 [1,0,0,1,0,0|2,0,0]=4 4245 B7R1.1 ClC[C@H]1CCCN1 MCULE-3107383611 [1,0,0,1,0,0|2,0,0]=4 4246 B7R1.1 FCC1CCCN1 MCULE-3216030316 [1,0,0,1,0,0|2,0,0]=4 4247 B7R1.1 FCC1CCCN1 MCULE-4540803550 [1,0,0,1,0,0|2,0,0]=4 4248 B7R1.1 FC[C@@H]1CCCN1 MCULE-2463314208 [1,0,0,1,0,0|2,0,0]=4 4249 B7R1.1 FC[C@@H]1CCCN1 MCULE-3740139569 [1,0,0,1,0,0|2,0,0]=4 4250 B7R1.1 FC[C@@H]1CCCN1 MCULE-6899304468 [1,0,0,1,0,0|2,0,0]=4 4251 B7R1.1 FC[C@@H]1CCCN1 MCULE-9916936373 [1,0,0,1,0,0|2,0,0]=4 4252 B7R1.1 FC[C@H]1CCCN1 MCULE-1380365453 [1,0,0,1,0,0|2,0,0]=4 4253 B7R1.1 FC[C@H]1CCCN1 MCULE-1512160666 [1,0,0,1,0,0|2,0,0]=4 4254 B7R1.1 FC[C@H]1CCCN1 MCULE-2904385734 [1,0,0,1,0,0|2,0,0]=4 4255 B7R1.1 FC[C@H]1CCCN1 MCULE-9837641384 [1,0,0,1,0,0|2,0,0]=4 4256 B7R1.1 ICC1CCCC1 MCULE-5940886897 [1,0,0,1,0,0|2,0,0]=4 4257 B7R1.1 ICC1CCCN1 MCULE-3467617934 [1,0,0,1,0,0|2,0,0]=4 4258 B7R1.1 ICC1CCCN1 MCULE-7784862806 [1,0,0,1,0,0|2,0,0]=4 4259 B7R1.1 ICC1CCCO1 MCULE-3981288245 [1,0,0,1,0,0|1,0,0]=3 4260 B7R1.1 IC[C@@H]1CCCN1 MCULE-4843756038 [1,0,0,1,0,0|2,0,0]=4 4261 B7R1.1 IC[C@@H]1CCCN1 MCULE-8213667136 [1,0,0,1,0,0|2,0,0]=4 4262 B7R1.1 N#CC1CCCO1 MCULE-6657753631 [1,0,0,1,0,0|1,0,1]=4 4263 B7R1.1 NCC1CCCC1 MCULE-3629796849 [1,0,0,1,0,0|2,0,0]=4 4264 B7R1.1 NCC1CCCC1 MCULE-8453900433 [1,0,0,1,0,0|2,0,0]=4 4265 B7R1.1 NCC1CCCN1 MCULE-4764684364 [1,0,0,1,0,0|2,0,0]=4 4266 B7R1.1 NCC1CCCN1 MCULE-8971980286 [1,0,0,1,0,0|2,0,0]=4 4267 B7R1.1 NCC1CCCO1 MCULE-2797516262 [1,0,0,1,0,0|1,0,0]=3 4268 B7R1.1 NCC1CCCO1 MCULE-5970677903 [1,0,0,1,0,0|1,0,0]=3 4269 B7R1.1 NCC1CCCO1 MCULE-6166235034 [1,0,0,1,0,0|1,0,0]=3 4270 B7R1.1 NCC1CCCS1 MCULE-5278325816 [1,0,0,1,0,0|1,1,0]=4 4271 B7R1.1 NCC1COCO1 MCULE-1657884847 [1,0,0,1,0,0|2,0,0]=4 4272 B7R1.1 NCC1COCO1 MCULE-9310217083 [1,0,0,1,0,0|2,0,0]=4 4273 B7R1.1 NCC1OCCO1 MCULE-4813269641 [1,0,0,1,0,0|2,0,0]=4 4274 B7R1.1 NC[C@@H]1CCCN1 MCULE-4726727563 [1,0,0,1,0,0|2,0,0]=4 4275 B7R1.1 NC[C@@H]1CCCN1 MCULE-7513400460 [1,0,0,1,0,0|2,0,0]=4 4276 B7R1.1 NC[C@@H]1CCCN1 MCULE-7622329174 [1,0,0,1,0,0|2,0,0]=4 4277 B7R1.1 NC[C@@H]1CCCN1 MCULE-8573395464 [1,0,0,1,0,0|2,0,0]=4 4278 B7R1.1 NC[C@@H]1CCCO1 MCULE-1103643839 [1,0,0,1,0,0|1,0,0]=3 4279 B7R1.1 NC[C@@H]1CCCO1 MCULE-1402571993 [1,0,0,1,0,0|1,0,0]=3 4280 B7R1.1 NC[C@@H]1CCCO1 MCULE-1448381041 [1,0,0,1,0,0|1,0,0]=3 4281 B7R1.1 NC[C@@H]1CCCO1 MCULE-6664501749 [1,0,0,1,0,0|1,0,0]=3 4282 B7R1.1 NC[C@H]1CCCN1 MCULE-2813912286 [1,0,0,1,0,0|2,0,0]=4 4283 B7R1.1 NC[C@H]1CCCN1 MCULE-5505144820 [1,0,0,1,0,0|2,0,0]=4 4284 B7R1.1 NC[C@H]1CCCN1 MCULE-7325312327 [1,0,0,1,0,0|2,0,0]=4 4285 B7R1.1 NC[C@H]1CCCN1 MCULE-7708925831 [1,0,0,1,0,0|2,0,0]=4 4286 B7R1.1 NC[C@H]1CCCO1 MCULE-1196018690 [1,0,0,1,0,0|1,0,0]=3 4287 B7R1.1 NC[C@H]1CCCO1 MCULE-2037746017 [1,0,0,1,0,0|1,0,0]=3 4288 B7R1.1 NC[C@H]1CCCO1 MCULE-3470426685 [1,0,0,1,0,0|1,0,0]=3 4289 B7R1.1 NC[C@H]1CCCO1 MCULE-9918683284 [1,0,0,1,0,0|1,0,0]=3 4290 B7R1.1 O=CC1CCCO1 MCULE-4587605451 [1,0,0,1,0,0|0,0,2]=4 4291 B7R1.1 OCC1=CCCC1 MCULE-8850570361 [1,0,0,1,0,0|1,0,1]=4 4292 B7R1.1 OCC1=NCCO1 MCULE-9432593363 [1,0,0,1,0,0|1,0,1]=4 4293 B7R1.1 OCC1C=CCC1 MCULE-1237002603 [1,0,0,1,0,0|1,0,1]=4 4294 B7R1.1 OCC1CCCC1 MCULE-2985338933 [1,0,0,1,0,0|1,0,0]=3 4295 B7R1.1 OCC1CCCN1 MCULE-1016922679 [1,0,0,1,0,0|1,0,0]=3 4296 B7R1.1 OCC1CCCN1 MCULE-8224535891 [1,0,0,1,0,0|1,0,0]=3 4297 B7R1.1 OCC1CCCO1 MCULE-5877114547 [1,0,0,1,0,0|0,0,0]=2 4298 B7R1.1 OCC1CCCO1 MCULE-5884880244 [1,0,0,1,0,0|0,0,0]=2 4299 B7R1.1 OCC1CCCS1 MCULE-6106081414 [1,0,0,1,0,0|0,1,0]=3 4300 B7R1.1 OCC1CCNC1 MCULE-7883947611 [1,0,0,1,0,0|2,0,0]=4 4301 B7R1.1 OCC1CCNC1 MCULE-9689521155 [1,0,0,1,0,0|2,0,0]=4 4302 B7R1.1 OCC1CCOC1 MCULE-8926405046 [1,0,0,1,0,0|2,0,0]=4 4303 B7R1.1 OCC1CCON1 MCULE-1199975481 [1,0,0,1,0,0|2,0,0]=4 4304 B7R1.1 OCC1CCON1 MCULE-4772487016 [1,0,0,1,0,0|2,0,0]=4 4305 B7R1.1 OCC1CCSC1 MCULE-2226132734 [1,0,0,1,0,0|2,0,0]=4 4306 B7R1.1 OCC1COCO1 MCULE-3470022742 [1,0,0,1,0,0|1,0,0]=3 4307 B7R1.1 OCC1OCCO1 MCULE-8334027179 [1,0,0,1,0,0|1,0,0]=3 4308 B7R1.1 OC[C@@H]1CCCN1 MCULE-1791547752 [1,0,0,1,0,0|1,0,0]=3 4309 B7R1.1 OC[C@@H]1CCCN1 MCULE-6448856585 [1,0,0,1,0,0|1,0,0]=3 4310 B7R1.1 OC[C@@H]1CCCN1 MCULE-7214801659 [1,0,0,1,0,0|1,0,0]=3 4311 B7R1.1 OC[C@@H]1CCCN1 MCULE-7248451975 [1,0,0,1,0,0|1,0,0]=3 4312 B7R1.1 OC[C@@H]1CCCO1 MCULE-1788377708 [1,0,0,1,0,0|0,0,0]=2 4313 B7R1.1 OC[C@@H]1CCCO1 MCULE-3533553137 [1,0,0,1,0,0|0,0,0]=2 4314 B7R1.1 OC[C@@H]1CCNC1 MCULE-3126404140 [1,0,0,1,0,0|2,0,0]=4 4315 B7R1.1 OC[C@@H]1CCNC1 MCULE-4876549629 [1,0,0,1,0,0|2,0,0]=4 4316 B7R1.1 OC[C@@H]1CCNC1 MCULE-7050415145 [1,0,0,1,0,0|2,0,0]=4 4317 B7R1.1 OC[C@@H]1CCNC1 MCULE-8785146407 [1,0,0,1,0,0|2,0,0]=4 4318 B7R1.1 OC[C@@H]1CCOC1 MCULE-2004616524 [1,0,0,1,0,0|2,0,0]=4 4319 B7R1.1 OC[C@@H]1CCOC1 MCULE-3801423698 [1,0,0,1,0,0|2,0,0]=4 4320 B7R1.1 OC[C@H]1CCCN1 MCULE-1266532697 [1,0,0,1,0,0|1,0,0]=3 4321 B7R1.1 OC[C@H]1CCCN1 MCULE-1724166794 [1,0,0,1,0,0|1,0,0]=3 4322 B7R1.1 OC[C@H]1CCCN1 MCULE-7513431964 [1,0,0,1,0,0|1,0,0]=3 4323 B7R1.1 OC[C@H]1CCCN1 MCULE-8398083695 [1,0,0,1,0,0|1,0,0]=3 4324 B7R1.1 OC[C@H]1CCCO1 MCULE-3501680239 [1,0,0,1,0,0|0,0,0]=2 4325 B7R1.1 OC[C@H]1CCCO1 MCULE-4925106568 [1,0,0,1,0,0|0,0,0]=2 4326 B7R1.1 OC[C@H]1CCNC1 MCULE-3909770597 [1,0,0,1,0,0|2,0,0]=4 4327 B7R1.1 OC[C@H]1CCNC1 MCULE-5006682123 [1,0,0,1,0,0|2,0,0]=4 4328 B7R1.1 OC[C@H]1CCNC1 MCULE-8265382423 [1,0,0,1,0,0|2,0,0]=4 4329 B7R1.1 OC[C@H]1CCNC1 MCULE-8371969680 [1,0,0,1,0,0|2,0,0]=4 4330 B7R1.1 OC[C@H]1CCOC1 MCULE-4226412289 [1,0,0,1,0,0|2,0,0]=4 4331 B7R1.1 OC[C@H]1CCOC1 MCULE-9076004118 [1,0,0,1,0,0|2,0,0]=4 4332 B7R1.1 ONC1CCCC1 MCULE-1143510043 [1,0,0,1,0,0|2,0,0]=4 4333 B7R1.1 ONC1CCCC1 MCULE-7548854169 [1,0,0,1,0,0|2,0,0]=4 4334 B7R1.1 SCC1CCCC1 MCULE-7973872166 [1,0,0,1,0,0|1,1,0]=4 4335 B7R1.1 SCC1CCCO1 MCULE-5962232488 [1,0,0,1,0,0|0,1,0]=3 4336 B7R1.2 C1(CCN(C1)C)O MCULE-5142099784 [1,0,0,1,0,0|2,0,0]=4 4337 B7R1.2 CC1CC(=O)CO1 MCULE-7022597277 [1,0,0,1,0,0|0,0,2]=4 4338 B7R1.2 CC1CC(CN1)F MCULE-5211772527 [1,0,0,1,0,0|2,0,0]=4 4339 B7R1.2 CC1CC(CN1)F MCULE-6845898511 [1,0,0,1,0,0|2,0,0]=4 4340 B7R1.2 CC1CC(CN1)O MCULE-5630063862 [1,0,0,1,0,0|1,0,0]=3 4341 B7R1.2 CC1CC(CN1)O MCULE-7427731937 [1,0,0,1,0,0|1,0,0]=3 4342 B7R1.2 CC1CC(CO1)N MCULE-5031195609 [1,0,0,1,0,0|1,0,0]=3 4343 B7R1.2 CC1CC(CO1)N MCULE-6627149239 [1,0,0,1,0,0|1,0,0]=3 4344 B7R1.2 CC1CC(CO1)O MCULE-1304022283 [1,0,0,1,0,0|0,0,0]=2 4345 B7R1.2 CC1CC(CS1)N MCULE-2886562999 [1,0,0,1,0,0|1,1,0]=4 4346 B7R1.2 CC1CCC(C1)Br MCULE-3834311364 [1,0,0,1,0,0|2,0,0]=4 4347 B7R1.2 CC1CCC(C1)Cl MCULE-7669391571 [1,0,0,1,0,0|2,0,0]=4 4348 B7R1.2 CC1CCC(C1)N MCULE-3681457592 [1,0,0,1,0,0|2,0,0]=4 4349 B7R1.2 CC1CCC(C1)N MCULE-8238390084 [1,0,0,1,0,0|2,0,0]=4 4350 B7R1.2 CC1CCC(C1)O MCULE-7892602703 [1,0,0,1,0,0|1,0,0]=3 4351 B7R1.2 CC1CNC(C1)C MCULE-3051496448 [1,0,0,1,0,0|2,0,0]=4 4352 B7R1.2 CC1CNC(C1)C MCULE-9324057254 [1,0,0,1,0,0|2,0,0]=4 4353 B7R1.2 CC1COC(O1)C MCULE-5670718739 [1,0,0,1,0,0|2,0,0]=4 4354 B7R1.2 CN1CCC(C1)O MCULE-7899934177 [1,0,0,1,0,0|2,0,0]=4 4355 B7R1.2 CN1CC[C@@H](C1)O MCULE-1236945758 [1,0,0,1,0,0|2,0,0]=4 4356 B7R1.2 CN1CC[C@@H](C1)O MCULE-4275527304 [1,0,0,1,0,0|2,0,0]=4 4357 B7R1.2 CN1CC[C@H](C1)O MCULE-6665002754 [1,0,0,1,0,0|2,0,0]=4 4358 B7R1.2 CN1CC[C@H](C1)O MCULE-8080661086 [1,0,0,1,0,0|2,0,0]=4 4359 B7R1.2 C[C@@H]1CC[C@@H](C1)N MCULE-9471729241 [1,0,0,1,0,0|2,0,0]=4 4360 B7R1.2 C[C@@H]1CC[C@H](C1)N MCULE-5368765184 [1,0,0,1,0,0|2,0,0]=4 4361 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-1790804170 [1,0,0,1,0,0|2,0,0]=4 4362 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-2224321786 [1,0,0,1,0,0|2,0,0]=4 4363 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6164070045 [1,0,0,1,0,0|2,0,0]=4 4364 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6870592338 [1,0,0,1,0,0|2,0,0]=4 4365 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-1211015225 [1,0,0,1,0,0|1,0,0]=3 4366 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8025231795 [1,0,0,1,0,0|1,0,0]=3 4367 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8074184383 [1,0,0,1,0,0|1,0,0]=3 4368 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8403784233 [1,0,0,1,0,0|1,0,0]=3 4369 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-1165785658 [1,0,0,1,0,0|2,0,0]=4 4370 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-2237025386 [1,0,0,1,0,0|2,0,0]=4 4371 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-4695463101 [1,0,0,1,0,0|2,0,0]=4 4372 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-9859386988 [1,0,0,1,0,0|2,0,0]=4 4373 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-4359200896 [1,0,0,1,0,0|1,0,0]=3 4374 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-5029850022 [1,0,0,1,0,0|1,0,0]=3 4375 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8880723450 [1,0,0,1,0,0|1,0,0]=3 4376 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8966000465 [1,0,0,1,0,0|1,0,0]=3 4377 B7R1.2 C[C@H]1CC[C@@H](C1)N MCULE-1080493056 [1,0,0,1,0,0|2,0,0]=4 4378 B7R1.2 C[C@H]1CC[C@H](C1)C MCULE-8059507758 [1,0,0,1,0,0|2,0,0]=4 4379 B7R1.2 C[C@H]1CC[C@H](C1)N MCULE-7070775136 [1,0,0,1,0,0|2,0,0]=4 4380 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-1742492020 [1,0,0,1,0,0|2,0,0]=4 4381 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-4690497151 [1,0,0,1,0,0|2,0,0]=4 4382 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-7372620241 [1,0,0,1,0,0|2,0,0]=4 4383 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-8319027426 [1,0,0,1,0,0|2,0,0]=4 4384 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-1346257695 [1,0,0,1,0,0|1,0,0]=3 4385 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-3035291598 [1,0,0,1,0,0|1,0,0]=3 4386 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-8611352921 [1,0,0,1,0,0|1,0,0]=3 4387 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-9413190353 [1,0,0,1,0,0|1,0,0]=3 4388 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-1099206732 [1,0,0,1,0,0|2,0,0]=4 4389 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8257992498 [1,0,0,1,0,0|2,0,0]=4 4390 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8335445065 [1,0,0,1,0,0|2,0,0]=4 4391 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-9395416229 [1,0,0,1,0,0|2,0,0]=4 4392 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-3188785695 [1,0,0,1,0,0|1,0,0]=3 4393 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-4518572489 [1,0,0,1,0,0|1,0,0]=3 4394 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-5322353871 [1,0,0,1,0,0|1,0,0]=3 4395 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-9693826142 [1,0,0,1,0,0|1,0,0]=3 4396 B7R1.2 NC1CCC(C1)O MCULE-5821071286 [1,0,0,1,0,0|2,0,0]=4 4397 B7R1.2 NC1CCC(C1)O MCULE-9391783901 [1,0,0,1,0,0|2,0,0]=4 4398 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-2973461190 [1,0,0,1,0,0|2,0,0]=4 4399 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-5462229704 [1,0,0,1,0,0|2,0,0]=4 4400 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-6746606174 [1,0,0,1,0,0|2,0,0]=4 4401 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7196403409 [1,0,0,1,0,0|2,0,0]=4 4402 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7511735313 [1,0,0,1,0,0|2,0,0]=4 4403 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-9023897758 [1,0,0,1,0,0|2,0,0]=4 4404 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-3286276562 [1,0,0,1,0,0|2,0,0]=4 4405 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-5345953109 [1,0,0,1,0,0|2,0,0]=4 4406 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-6442703385 [1,0,0,1,0,0|2,0,0]=4 4407 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-7457197538 [1,0,0,1,0,0|2,0,0]=4 4408 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-2764158583 [1,0,0,1,0,0|2,0,0]=4 4409 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-5047569623 [1,0,0,1,0,0|2,0,0]=4 4410 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-7674066148 [1,0,0,1,0,0|2,0,0]=4 4411 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-8478778872 [1,0,0,1,0,0|2,0,0]=4 4412 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-3786824722 [1,0,0,1,0,0|2,0,0]=4 4413 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-4140170961 [1,0,0,1,0,0|2,0,0]=4 4414 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5760466174 [1,0,0,1,0,0|2,0,0]=4 4415 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5995468864 [1,0,0,1,0,0|2,0,0]=4 4416 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-6230469368 [1,0,0,1,0,0|2,0,0]=4 4417 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-9622062244 [1,0,0,1,0,0|2,0,0]=4 4418 B7R1.2 O=C1CC(CO1)O MCULE-3779919332 [1,0,0,1,0,0|1,0,1]=4 4419 B7R1.2 O=C1CC(CO1)O MCULE-5609071664 [1,0,0,1,0,0|1,0,1]=4 4420 B7R1.2 O=C1C[C@@H](CO1)O MCULE-1467506377 [1,0,0,1,0,0|1,0,1]=4 4421 B7R1.2 O=C1C[C@@H](CO1)O MCULE-3668466479 [1,0,0,1,0,0|1,0,1]=4 4422 B7R1.2 O=C1C[C@H](CO1)O MCULE-5756899897 [1,0,0,1,0,0|1,0,1]=4 4423 B7R1.2 O=C1C[C@H](CO1)O MCULE-6247095672 [1,0,0,1,0,0|1,0,1]=4 4424 B7R1.2 OC1CCC(C1)O MCULE-2799846813 [1,0,0,1,0,0|2,0,0]=4 4425 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-4481324218 [1,0,0,1,0,0|2,0,0]=4 4426 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-6560672131 [1,0,0,1,0,0|2,0,0]=4 4427 B7R1.2 O[C@H]1CC[C@H](C1)O MCULE-4640874873 [1,0,0,1,0,0|2,0,0]=4 4428 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-3137346382 [1,0,0,1,0,0|2,0,0]=4 4429 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-9954737796 [1,0,0,1,0,0|2,0,0]=4 4430 B7R1.2 [C@H]1(CC[C@H](C1)O)O MCULE-4834858159 [1,0,0,1,0,0|2,0,0]=4 4431 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-1916837136 [1,0,0,1,0,0|1,0,0]=3 4432 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-8263093896 [1,0,0,1,0,0|1,0,0]=3 4433 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9065610836 [1,0,0,1,0,0|1,0,0]=3 4434 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9910248291 [1,0,0,1,0,0|1,0,0]=3 4435 B7R1.3 BrC1CCCCC1 MCULE-7879113781 [1,0,0,1,0,0|2,0,0]=4 4436 B7R1.3 BrC1CCCNC1 MCULE-5734359694 [1,0,0,1,0,0|2,0,0]=4 4437 B7R1.3 BrC1CCCNC1 MCULE-8772964999 [1,0,0,1,0,0|2,0,0]=4 4438 B7R1.3 BrC1CCCNC1 MCULE-9975168983 [1,0,0,1,0,0|2,0,0]=4 4439 B7R1.3 BrC1CCCOC1 MCULE-5781416415 [1,0,0,1,0,0|1,0,0]=3 4440 B7R1.3 C1(CCCNC1)F MCULE-2873742972 [1,0,0,1,0,0|2,0,0]=4 4441 B7R1.3 C1(CCCNC1)F MCULE-8247715411 [1,0,0,1,0,0|2,0,0]=4 4442 B7R1.3 C1(CCCNC1)N MCULE-2184623611 [1,0,0,1,0,0|2,0,0]=4 4443 B7R1.3 C1(CCCNC1)N MCULE-6177601832 [1,0,0,1,0,0|2,0,0]=4 4444 B7R1.3 C1(CCCNC1)O MCULE-5944071030 [1,0,0,1,0,0|1,0,0]=3 4445 B7R1.3 C1(CCCNC1)O MCULE-9769032939 [1,0,0,1,0,0|1,0,0]=3 4446 B7R1.3 C1(CCCOC1)N MCULE-7160456966 [1,0,0,1,0,0|1,0,0]=3 4447 B7R1.3 C1(CCCOC1)N MCULE-9418657332 [1,0,0,1,0,0|1,0,0]=3 4448 B7R1.3 C=C1CCCOC1 MCULE-5236529273 [1,0,0,1,0,0|1,0,1]=4 4449 B7R1.3 CC1CCCCC1 MCULE-3843525768 [1,0,0,1,0,0|2,0,0]=4 4450 B7R1.3 CC1CCCNC1 MCULE-3344207132 [1,0,0,1,0,0|2,0,0]=4 4451 B7R1.3 CC1CCCNC1 MCULE-5707832183 [1,0,0,1,0,0|2,0,0]=4 4452 B7R1.3 CC1CCCNC1 MCULE-7033850891 [1,0,0,1,0,0|2,0,0]=4 4453 B7R1.3 CC1CCCNC1 MCULE-7153943487 [1,0,0,1,0,0|2,0,0]=4 4454 B7R1.3 CC1COCCN1 MCULE-1305824409 [1,0,0,1,0,0|2,0,0]=4 4455 B7R1.3 CC1COCCN1 MCULE-4570632464 [1,0,0,1,0,0|2,0,0]=4 4456 B7R1.3 CC1COCCN1 MCULE-6275555682 [1,0,0,1,0,0|2,0,0]=4 4457 B7R1.3 CC1COCCN1 MCULE-8711024794 [1,0,0,1,0,0|2,0,0]=4 4458 B7R1.3 C[C@@H]1CCCNC1 MCULE-1079173995 [1,0,0,1,0,0|2,0,0]=4 4459 B7R1.3 C[C@@H]1CCCNC1 MCULE-1230145662 [1,0,0,1,0,0|2,0,0]=4 4460 B7R1.3 C[C@@H]1CCCNC1 MCULE-3423787676 [1,0,0,1,0,0|2,0,0]=4 4461 B7R1.3 C[C@@H]1CCCNC1 MCULE-9303264483 [1,0,0,1,0,0|2,0,0]=4 4462 B7R1.3 C[C@@H]1COCCN1 MCULE-2750151013 [1,0,0,1,0,0|2,0,0]=4 4463 B7R1.3 C[C@@H]1COCCN1 MCULE-4003273424 [1,0,0,1,0,0|2,0,0]=4 4464 B7R1.3 C[C@@H]1COCCN1 MCULE-4627627990 [1,0,0,1,0,0|2,0,0]=4 4465 B7R1.3 C[C@@H]1COCCN1 MCULE-8600287111 [1,0,0,1,0,0|2,0,0]=4 4466 B7R1.3 C[C@H]1CCCNC1 MCULE-3372852932 [1,0,0,1,0,0|2,0,0]=4 4467 B7R1.3 C[C@H]1CCCNC1 MCULE-5146147676 [1,0,0,1,0,0|2,0,0]=4 4468 B7R1.3 C[C@H]1CCCNC1 MCULE-7894943546 [1,0,0,1,0,0|2,0,0]=4 4469 B7R1.3 C[C@H]1CCCNC1 MCULE-8016414984 [1,0,0,1,0,0|2,0,0]=4 4470 B7R1.3 C[C@H]1COCCN1 MCULE-1467834624 [1,0,0,1,0,0|2,0,0]=4 4471 B7R1.3 C[C@H]1COCCN1 MCULE-3486079226 [1,0,0,1,0,0|2,0,0]=4 4472 B7R1.3 C[C@H]1COCCN1 MCULE-5726525044 [1,0,0,1,0,0|2,0,0]=4 4473 B7R1.3 C[C@H]1COCCN1 MCULE-9977133603 [1,0,0,1,0,0|2,0,0]=4 4474 B7R1.3 ClC1CCCCC1 MCULE-9519865350 [1,0,0,1,0,0|2,0,0]=4 4475 B7R1.3 ClC1CCCNC1 MCULE-3870722463 [1,0,0,1,0,0|2,0,0]=4 4476 B7R1.3 ClC1CCCNC1 MCULE-8461718443 [1,0,0,1,0,0|2,0,0]=4 4477 B7R1.3 ClC1CCCOC1 MCULE-5733907796 [1,0,0,1,0,0|1,0,0]=3 4478 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-1513190720 [1,0,0,1,0,0|2,0,0]=4 4479 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-4702442384 [1,0,0,1,0,0|2,0,0]=4 4480 B7R1.3 Cl[C@H]1CCCNC1 MCULE-1906196638 [1,0,0,1,0,0|2,0,0]=4 4481 B7R1.3 Cl[C@H]1CCCNC1 MCULE-5435721723 [1,0,0,1,0,0|2,0,0]=4 4482 B7R1.3 FC1CCCCC1 MCULE-4555555520 [1,0,0,1,0,0|2,0,0]=4 4483 B7R1.3 FC1CCCNC1 MCULE-1207637035 [1,0,0,1,0,0|2,0,0]=4 4484 B7R1.3 FC1CCCNC1 MCULE-8874983109 [1,0,0,1,0,0|2,0,0]=4 4485 B7R1.3 FC1CCCOC1 MCULE-9003204358 [1,0,0,1,0,0|1,0,0]=3 4486 B7R1.3 F[C@@H]1CCCNC1 MCULE-1015853975 [1,0,0,1,0,0|2,0,0]=4 4487 B7R1.3 F[C@@H]1CCCNC1 MCULE-2442101978 [1,0,0,1,0,0|2,0,0]=4 4488 B7R1.3 F[C@@H]1CCCNC1 MCULE-3088687742 [1,0,0,1,0,0|2,0,0]=4 4489 B7R1.3 F[C@@H]1CCCNC1 MCULE-3298158493 [1,0,0,1,0,0|2,0,0]=4 4490 B7R1.3 F[C@H]1CCCNC1 MCULE-5863769143 [1,0,0,1,0,0|2,0,0]=4 4491 B7R1.3 F[C@H]1CCCNC1 MCULE-9142728260 [1,0,0,1,0,0|2,0,0]=4 4492 B7R1.3 F[C@H]1CCCNC1 MCULE-9496728832 [1,0,0,1,0,0|2,0,0]=4 4493 B7R1.3 F[C@H]1CCCNC1 MCULE-9795686850 [1,0,0,1,0,0|2,0,0]=4 4494 B7R1.3 IC1CCCCC1 MCULE-4499971048 [1,0,0,1,0,0|2,0,0]=4 4495 B7R1.3 NC1CCCCC1 MCULE-1274688385 [1,0,0,1,0,0|2,0,0]=4 4496 B7R1.3 NC1CCCCC1 MCULE-6218418825 [1,0,0,1,0,0|2,0,0]=4 4497 B7R1.3 NC1CCCCC1 MCULE-7654331405 [1,0,0,1,0,0|2,0,0]=4 4498 B7R1.3 NC1CCCCC1 MCULE-9211684304 [1,0,0,1,0,0|2,0,0]=4 4499 B7R1.3 NC1CCCNC1 MCULE-2846077424 [1,0,0,1,0,0|2,0,0]=4 4500 B7R1.3 NC1CCCNC1 MCULE-6762552983 [1,0,0,1,0,0|2,0,0]=4 4501 B7R1.3 NC1CCCNC1 MCULE-8978449052 [1,0,0,1,0,0|2,0,0]=4 4502 B7R1.3 NC1CCCOC1 MCULE-3002610862 [1,0,0,1,0,0|1,0,0]=3 4503 B7R1.3 NC1CCCOC1 MCULE-8678558313 [1,0,0,1,0,0|1,0,0]=3 4504 B7R1.3 NC1CCCSC1 MCULE-5361360271 [1,0,0,1,0,0|1,1,0]=4 4505 B7R1.3 NC1CCCSC1 MCULE-5652416535 [1,0,0,1,0,0|1,1,0]=4 4506 B7R1.3 N[C@@H]1CCCNC1 MCULE-1539406556 [1,0,0,1,0,0|2,0,0]=4 4507 B7R1.3 N[C@@H]1CCCNC1 MCULE-3403472114 [1,0,0,1,0,0|2,0,0]=4 4508 B7R1.3 N[C@@H]1CCCNC1 MCULE-6313396868 [1,0,0,1,0,0|2,0,0]=4 4509 B7R1.3 N[C@@H]1CCCNC1 MCULE-8281902784 [1,0,0,1,0,0|2,0,0]=4 4510 B7R1.3 N[C@@H]1CCCOC1 MCULE-3329999118 [1,0,0,1,0,0|1,0,0]=3 4511 B7R1.3 N[C@@H]1CCCOC1 MCULE-5434456311 [1,0,0,1,0,0|1,0,0]=3 4512 B7R1.3 N[C@@H]1CCCOC1 MCULE-8416525332 [1,0,0,1,0,0|1,0,0]=3 4513 B7R1.3 N[C@@H]1CCCOC1 MCULE-9941756618 [1,0,0,1,0,0|1,0,0]=3 4514 B7R1.3 N[C@H]1CCCNC1 MCULE-1133561466 [1,0,0,1,0,0|2,0,0]=4 4515 B7R1.3 N[C@H]1CCCNC1 MCULE-3601314617 [1,0,0,1,0,0|2,0,0]=4 4516 B7R1.3 N[C@H]1CCCNC1 MCULE-4741120465 [1,0,0,1,0,0|2,0,0]=4 4517 B7R1.3 N[C@H]1CCCNC1 MCULE-5291619589 [1,0,0,1,0,0|2,0,0]=4 4518 B7R1.3 N[C@H]1CCCNC1 MCULE-8831721515 [1,0,0,1,0,0|2,0,0]=4 4519 B7R1.3 N[C@H]1CCCOC1 MCULE-1619050625 [1,0,0,1,0,0|1,0,0]=3 4520 B7R1.3 N[C@H]1CCCOC1 MCULE-4275969826 [1,0,0,1,0,0|1,0,0]=3 4521 B7R1.3 N[C@H]1CCCOC1 MCULE-4421099383 [1,0,0,1,0,0|1,0,0]=3 4522 B7R1.3 N[C@H]1CCCOC1 MCULE-9281030983 [1,0,0,1,0,0|1,0,0]=3 4523 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [1,0,0,1,0,0|0,0,2]=4 4524 B7R1.3 OC1C=CCCC1 MCULE-3255466542 [1,0,0,1,0,0|1,0,1]=4 4525 B7R1.3 OC1C=CCOC1 MCULE-7810293257 [1,0,0,1,0,0|0,0,2]=4 4526 B7R1.3 OC1CC=CCC1 MCULE-9472259407 [1,0,0,1,0,0|1,0,1]=4 4527 B7R1.3 OC1CCCCC1 MCULE-8217921343 [1,0,0,1,0,0|1,0,0]=3 4528 B7R1.3 OC1CCCCN1 MCULE-7168605870 [1,0,0,1,0,0|2,0,0]=4 4529 B7R1.3 OC1CCCCN1 MCULE-9833825308 [1,0,0,1,0,0|2,0,0]=4 4530 B7R1.3 OC1CCCCO1 MCULE-1415784498 [1,0,0,1,0,0|2,0,0]=4 4531 B7R1.3 OC1CCCNC1 MCULE-4557845355 [1,0,0,1,0,0|1,0,0]=3 4532 B7R1.3 OC1CCCNC1 MCULE-6040312691 [1,0,0,1,0,0|1,0,0]=3 4533 B7R1.3 OC1CCCOC1 MCULE-3820663957 [1,0,0,1,0,0|0,0,0]=2 4534 B7R1.3 OC1CCCOC1 MCULE-4349250540 [1,0,0,1,0,0|0,0,0]=2 4535 B7R1.3 OC1CCCSC1 MCULE-1448781710 [1,0,0,1,0,0|0,1,0]=3 4536 B7R1.3 OC1CCNCC1 MCULE-3572807775 [1,0,0,1,0,0|2,0,0]=4 4537 B7R1.3 OC1CCNCC1 MCULE-4216905638 [1,0,0,1,0,0|2,0,0]=4 4538 B7R1.3 OC1CCNCC1 MCULE-8298401309 [1,0,0,1,0,0|2,0,0]=4 4539 B7R1.3 OC1CCOCC1 MCULE-3789534226 [1,0,0,1,0,0|2,0,0]=4 4540 B7R1.3 OC1CCSCC1 MCULE-6056663037 [1,0,0,1,0,0|2,0,0]=4 4541 B7R1.3 OC1CNCCO1 MCULE-7048275202 [1,0,0,1,0,0|2,0,0]=4 4542 B7R1.3 OC1CNCCO1 MCULE-9716087824 [1,0,0,1,0,0|2,0,0]=4 4543 B7R1.3 OC1COCOC1 MCULE-1056094446 [1,0,0,1,0,0|1,0,0]=3 4544 B7R1.3 ON1CCCCC1 MCULE-5529301217 [1,0,0,1,0,0|2,0,0]=4 4545 B7R1.3 O[C@@H]1CCCNC1 MCULE-3395625072 [1,0,0,1,0,0|1,0,0]=3 4546 B7R1.3 O[C@@H]1CCCNC1 MCULE-5041834047 [1,0,0,1,0,0|1,0,0]=3 4547 B7R1.3 O[C@@H]1CCCNC1 MCULE-5939951996 [1,0,0,1,0,0|1,0,0]=3 4548 B7R1.3 O[C@@H]1CCCNC1 MCULE-8822637089 [1,0,0,1,0,0|1,0,0]=3 4549 B7R1.3 O[C@@H]1CCCOC1 MCULE-1439860824 [1,0,0,1,0,0|0,0,0]=2 4550 B7R1.3 O[C@@H]1CCCOC1 MCULE-5515107963 [1,0,0,1,0,0|0,0,0]=2 4551 B7R1.3 O[C@H]1C=CCCC1 MCULE-5543899109 [1,0,0,1,0,0|1,0,1]=4 4552 B7R1.3 O[C@H]1CCCNC1 MCULE-3813591488 [1,0,0,1,0,0|1,0,0]=3 4553 B7R1.3 O[C@H]1CCCNC1 MCULE-5223055424 [1,0,0,1,0,0|1,0,0]=3 4554 B7R1.3 O[C@H]1CCCNC1 MCULE-7646198322 [1,0,0,1,0,0|1,0,0]=3 4555 B7R1.3 O[C@H]1CCCNC1 MCULE-7875547684 [1,0,0,1,0,0|1,0,0]=3 4556 B7R1.3 O[C@H]1CCCOC1 MCULE-2228949296 [1,0,0,1,0,0|0,0,0]=2 4557 B7R1.3 O[C@H]1CCCOC1 MCULE-6500179909 [1,0,0,1,0,0|0,0,0]=2 4558 B7R1.3 SC1CCCCC1 MCULE-2644288416 [1,0,0,1,0,0|1,1,0]=4 4559 B7R1.3 SC1CCCNC1 MCULE-4464031027 [1,0,0,1,0,0|1,1,0]=4 4560 B7R1.3 SC1CCCNC1 MCULE-5566651293 [1,0,0,1,0,0|1,1,0]=4 4561 B7R1.3 SC1CCCOC1 MCULE-9540212924 [1,0,0,1,0,0|0,1,0]=3 4562 B7R1.3 S[C@H]1CCCNC1 MCULE-5377455102 [1,0,0,1,0,0|1,1,0]=4 4563 B7R1.3 S[C@H]1CCCNC1 MCULE-9668422285 [1,0,0,1,0,0|1,1,0]=4 4564 B7R1.3 [NH3+]C1CCCCC1 MCULE-7876724648 [1,0,0,1,0,0|2,0,0]=4 4565 B7R1.4 BrC1CCCC1Br MCULE-9172342979 [1,0,0,1,0,0|2,0,0]=4 4566 B7R1.4 Br[C@@H]1CCC[C@H]1Br MCULE-5523481790 [1,0,0,1,0,0|2,0,0]=4 4567 B7R1.4 C=C1CCCC1O MCULE-3026250203 [1,0,0,1,0,0|1,0,1]=4 4568 B7R1.4 CC1CCCC1Br MCULE-7816907673 [1,0,0,1,0,0|2,0,0]=4 4569 B7R1.4 CC1CCCC1N MCULE-4318156403 [1,0,0,1,0,0|2,0,0]=4 4570 B7R1.4 CC1CCCC1N MCULE-4434172193 [1,0,0,1,0,0|2,0,0]=4 4571 B7R1.4 CC1CCCC1O MCULE-1288711765 [1,0,0,1,0,0|1,0,0]=3 4572 B7R1.4 CC1CNCC1O MCULE-3308447861 [1,0,0,1,0,0|2,0,0]=4 4573 B7R1.4 CC1CNCC1O MCULE-8526879323 [1,0,0,1,0,0|2,0,0]=4 4574 B7R1.4 CC1COCC1O MCULE-5925280081 [1,0,0,1,0,0|2,0,0]=4 4575 B7R1.4 CC1NCCC1O MCULE-7936666458 [1,0,0,1,0,0|2,0,0]=4 4576 B7R1.4 CC1NCCC1O MCULE-8369948926 [1,0,0,1,0,0|2,0,0]=4 4577 B7R1.4 CC1OCCC1O MCULE-6904695721 [1,0,0,1,0,0|2,0,0]=4 4578 B7R1.4 CC1SCCC1O MCULE-4342593310 [1,0,0,1,0,0|2,0,0]=4 4579 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-6206070680 [1,0,0,1,0,0|2,0,0]=4 4580 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-9964938082 [1,0,0,1,0,0|2,0,0]=4 4581 B7R1.4 C[C@@H]1CCC[C@@H]1O MCULE-2617120620 [1,0,0,1,0,0|1,0,0]=3 4582 B7R1.4 C[C@@H]1CCC[C@H]1N MCULE-8385969474 [1,0,0,1,0,0|2,0,0]=4 4583 B7R1.4 C[C@@H]1CCC[C@H]1O MCULE-3398682980 [1,0,0,1,0,0|1,0,0]=3 4584 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-2015388080 [1,0,0,1,0,0|2,0,0]=4 4585 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-3625149028 [1,0,0,1,0,0|2,0,0]=4 4586 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-5773404554 [1,0,0,1,0,0|2,0,0]=4 4587 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6014391902 [1,0,0,1,0,0|2,0,0]=4 4588 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6476104556 [1,0,0,1,0,0|2,0,0]=4 4589 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6537028059 [1,0,0,1,0,0|2,0,0]=4 4590 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-4207581523 [1,0,0,1,0,0|2,0,0]=4 4591 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-6158474994 [1,0,0,1,0,0|2,0,0]=4 4592 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7380960276 [1,0,0,1,0,0|2,0,0]=4 4593 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7589629864 [1,0,0,1,0,0|2,0,0]=4 4594 B7R1.4 C[C@@H]1COC[C@@H]1O MCULE-3198029643 [1,0,0,1,0,0|2,0,0]=4 4595 B7R1.4 C[C@@H]1COC[C@H]1O MCULE-1967963278 [1,0,0,1,0,0|2,0,0]=4 4596 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-1705265213 [1,0,0,1,0,0|2,0,0]=4 4597 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-3395898129 [1,0,0,1,0,0|2,0,0]=4 4598 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-5909894286 [1,0,0,1,0,0|2,0,0]=4 4599 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-9998480727 [1,0,0,1,0,0|2,0,0]=4 4600 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-1101330824 [1,0,0,1,0,0|2,0,0]=4 4601 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3326131093 [1,0,0,1,0,0|2,0,0]=4 4602 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3941456644 [1,0,0,1,0,0|2,0,0]=4 4603 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-8944150043 [1,0,0,1,0,0|2,0,0]=4 4604 B7R1.4 C[C@H]1CCC[C@@H]1N MCULE-4150988023 [1,0,0,1,0,0|2,0,0]=4 4605 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-5212653059 [1,0,0,1,0,0|1,0,0]=3 4606 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-7997646273 [1,0,0,1,0,0|1,0,0]=3 4607 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-3329868072 [1,0,0,1,0,0|2,0,0]=4 4608 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-4186145172 [1,0,0,1,0,0|2,0,0]=4 4609 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-3291842365 [1,0,0,1,0,0|1,0,0]=3 4610 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-7570125274 [1,0,0,1,0,0|1,0,0]=3 4611 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2282810666 [1,0,0,1,0,0|2,0,0]=4 4612 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2772361871 [1,0,0,1,0,0|2,0,0]=4 4613 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3274154422 [1,0,0,1,0,0|2,0,0]=4 4614 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3608199633 [1,0,0,1,0,0|2,0,0]=4 4615 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-1988679936 [1,0,0,1,0,0|2,0,0]=4 4616 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-3451477960 [1,0,0,1,0,0|2,0,0]=4 4617 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-4396463600 [1,0,0,1,0,0|2,0,0]=4 4618 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-7975653844 [1,0,0,1,0,0|2,0,0]=4 4619 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-3765921602 [1,0,0,1,0,0|2,0,0]=4 4620 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-5201903195 [1,0,0,1,0,0|2,0,0]=4 4621 B7R1.4 C[C@H]1COC[C@H]1O MCULE-2974083166 [1,0,0,1,0,0|2,0,0]=4 4622 B7R1.4 C[C@H]1COC[C@H]1O MCULE-6725207001 [1,0,0,1,0,0|2,0,0]=4 4623 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-5499798144 [1,0,0,1,0,0|2,0,0]=4 4624 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-7401004387 [1,0,0,1,0,0|2,0,0]=4 4625 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-7469942077 [1,0,0,1,0,0|2,0,0]=4 4626 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-9976903585 [1,0,0,1,0,0|2,0,0]=4 4627 B7R1.4 ClC1CCCC1Cl MCULE-1176916477 [1,0,0,1,0,0|2,0,0]=4 4628 B7R1.4 NC1CCCC1F MCULE-2221939717 [1,0,0,1,0,0|2,0,0]=4 4629 B7R1.4 NC1CCCC1F MCULE-7473190715 [1,0,0,1,0,0|2,0,0]=4 4630 B7R1.4 NC1CCCC1N MCULE-5161769230 [1,0,0,1,0,0|2,0,0]=4 4631 B7R1.4 NC1CCCC1N MCULE-7834445190 [1,0,0,1,0,0|2,0,0]=4 4632 B7R1.4 NC1CCCC1O MCULE-1657591641 [1,0,0,1,0,0|1,0,0]=3 4633 B7R1.4 NC1CCCC1O MCULE-6248992494 [1,0,0,1,0,0|1,0,0]=3 4634 B7R1.4 NC1COCC1O MCULE-3115911209 [1,0,0,1,0,0|2,0,0]=4 4635 B7R1.4 NC1COCC1O MCULE-9837103399 [1,0,0,1,0,0|2,0,0]=4 4636 B7R1.4 NC1CSCC1O MCULE-4474934833 [1,0,0,1,0,0|2,0,0]=4 4637 B7R1.4 NC1CSCC1O MCULE-5059305463 [1,0,0,1,0,0|2,0,0]=4 4638 B7R1.4 NC1CSCC1O MCULE-8633680588 [1,0,0,1,0,0|2,0,0]=4 4639 B7R1.4 N[C@@H]1CCC[C@@H]1F MCULE-5918995947 [1,0,0,1,0,0|2,0,0]=4 4640 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-3619202671 [1,0,0,1,0,0|1,0,0]=3 4641 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-5588562063 [1,0,0,1,0,0|1,0,0]=3 4642 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-8937650915 [1,0,0,1,0,0|1,0,0]=3 4643 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9550479411 [1,0,0,1,0,0|1,0,0]=3 4644 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9908988904 [1,0,0,1,0,0|1,0,0]=3 4645 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-1389039924 [1,0,0,1,0,0|2,0,0]=4 4646 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-2197861570 [1,0,0,1,0,0|2,0,0]=4 4647 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-3318849776 [1,0,0,1,0,0|2,0,0]=4 4648 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-5395257521 [1,0,0,1,0,0|2,0,0]=4 4649 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-8318262942 [1,0,0,1,0,0|2,0,0]=4 4650 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-9877401480 [1,0,0,1,0,0|2,0,0]=4 4651 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-1630250066 [1,0,0,1,0,0|2,0,0]=4 4652 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5738867214 [1,0,0,1,0,0|2,0,0]=4 4653 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5794367720 [1,0,0,1,0,0|2,0,0]=4 4654 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-6079002018 [1,0,0,1,0,0|2,0,0]=4 4655 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7332231839 [1,0,0,1,0,0|2,0,0]=4 4656 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7604406385 [1,0,0,1,0,0|2,0,0]=4 4657 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-2283352070 [1,0,0,1,0,0|1,0,0]=3 4658 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-3279782742 [1,0,0,1,0,0|1,0,0]=3 4659 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-6823698796 [1,0,0,1,0,0|1,0,0]=3 4660 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-7752087047 [1,0,0,1,0,0|1,0,0]=3 4661 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-8823714511 [1,0,0,1,0,0|1,0,0]=3 4662 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-9789739251 [1,0,0,1,0,0|1,0,0]=3 4663 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-2891920420 [1,0,0,1,0,0|2,0,0]=4 4664 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-5764643856 [1,0,0,1,0,0|2,0,0]=4 4665 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-1399984261 [1,0,0,1,0,0|2,0,0]=4 4666 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-2321912677 [1,0,0,1,0,0|2,0,0]=4 4667 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-4422404071 [1,0,0,1,0,0|2,0,0]=4 4668 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-7801515292 [1,0,0,1,0,0|2,0,0]=4 4669 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9112718041 [1,0,0,1,0,0|2,0,0]=4 4670 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9447703783 [1,0,0,1,0,0|2,0,0]=4 4671 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-4507133192 [1,0,0,1,0,0|2,0,0]=4 4672 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-9327920188 [1,0,0,1,0,0|2,0,0]=4 4673 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-5323319055 [1,0,0,1,0,0|2,0,0]=4 4674 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-8008053411 [1,0,0,1,0,0|2,0,0]=4 4675 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-6629056296 [1,0,0,1,0,0|1,0,0]=3 4676 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-7682114350 [1,0,0,1,0,0|1,0,0]=3 4677 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-8554796061 [1,0,0,1,0,0|1,0,0]=3 4678 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-9329258920 [1,0,0,1,0,0|1,0,0]=3 4679 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-1361897949 [1,0,0,1,0,0|2,0,0]=4 4680 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-4545374374 [1,0,0,1,0,0|2,0,0]=4 4681 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-1156997833 [1,0,0,1,0,0|1,0,0]=3 4682 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-2524879699 [1,0,0,1,0,0|1,0,0]=3 4683 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-7034968971 [1,0,0,1,0,0|1,0,0]=3 4684 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9262461574 [1,0,0,1,0,0|1,0,0]=3 4685 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9904485750 [1,0,0,1,0,0|1,0,0]=3 4686 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-1604156911 [1,0,0,1,0,0|2,0,0]=4 4687 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-3157811195 [1,0,0,1,0,0|2,0,0]=4 4688 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-4377495223 [1,0,0,1,0,0|2,0,0]=4 4689 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-8412403655 [1,0,0,1,0,0|2,0,0]=4 4690 B7R1.4 N[C@H]1COC[C@H]1O MCULE-5907972681 [1,0,0,1,0,0|2,0,0]=4 4691 B7R1.4 N[C@H]1COC[C@H]1O MCULE-7502895716 [1,0,0,1,0,0|2,0,0]=4 4692 B7R1.4 N[C@H]1COC[C@H]1O MCULE-8985833831 [1,0,0,1,0,0|2,0,0]=4 4693 B7R1.4 N[C@H]1COC[C@H]1O MCULE-9971794275 [1,0,0,1,0,0|2,0,0]=4 4694 B7R1.4 O=C1CCCC1O MCULE-6795188798 [1,0,0,1,0,0|0,0,2]=4 4695 B7R1.4 OC1CCCC1Br MCULE-9027030471 [1,0,0,1,0,0|1,0,0]=3 4696 B7R1.4 OC1CCCC1Cl MCULE-5561130140 [1,0,0,1,0,0|1,0,0]=3 4697 B7R1.4 OC1CCCC1F MCULE-9111039481 [1,0,0,1,0,0|1,0,0]=3 4698 B7R1.4 OC1CCCC1O MCULE-2003945768 [1,0,0,1,0,0|0,0,0]=2 4699 B7R1.4 OC1CNCC1Br MCULE-1241091506 [1,0,0,1,0,0|2,0,0]=4 4700 B7R1.4 OC1CNCC1Br MCULE-4889737174 [1,0,0,1,0,0|2,0,0]=4 4701 B7R1.4 OC1CNCC1F MCULE-3412240528 [1,0,0,1,0,0|2,0,0]=4 4702 B7R1.4 OC1CNCC1F MCULE-7214807363 [1,0,0,1,0,0|2,0,0]=4 4703 B7R1.4 OC1CNCC1O MCULE-4416566731 [1,0,0,1,0,0|1,0,0]=3 4704 B7R1.4 OC1CNCC1O MCULE-7287658845 [1,0,0,1,0,0|1,0,0]=3 4705 B7R1.4 OC1COCC1Br MCULE-8642236751 [1,0,0,1,0,0|2,0,0]=4 4706 B7R1.4 OC1COCC1F MCULE-3255803142 [1,0,0,1,0,0|2,0,0]=4 4707 B7R1.4 OC1COCC1O MCULE-2982401803 [1,0,0,1,0,0|1,0,0]=3 4708 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-5851051143 [1,0,0,1,0,0|1,0,0]=3 4709 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-6816188915 [1,0,0,1,0,0|1,0,0]=3 4710 B7R1.4 O[C@@H]1CCC[C@H]1F MCULE-6825738824 [1,0,0,1,0,0|1,0,0]=3 4711 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-3171045763 [1,0,0,1,0,0|0,0,0]=2 4712 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-4369287998 [1,0,0,1,0,0|0,0,0]=2 4713 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-4544085940 [1,0,0,1,0,0|2,0,0]=4 4714 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-6356393045 [1,0,0,1,0,0|2,0,0]=4 4715 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-7332143154 [1,0,0,1,0,0|2,0,0]=4 4716 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8032995983 [1,0,0,1,0,0|2,0,0]=4 4717 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8052505932 [1,0,0,1,0,0|2,0,0]=4 4718 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8564653401 [1,0,0,1,0,0|2,0,0]=4 4719 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-2691246784 [1,0,0,1,0,0|2,0,0]=4 4720 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-7250968554 [1,0,0,1,0,0|2,0,0]=4 4721 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8439784112 [1,0,0,1,0,0|2,0,0]=4 4722 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8682802807 [1,0,0,1,0,0|2,0,0]=4 4723 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-2199886254 [1,0,0,1,0,0|1,0,0]=3 4724 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-3341203076 [1,0,0,1,0,0|1,0,0]=3 4725 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-5521619072 [1,0,0,1,0,0|1,0,0]=3 4726 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-2460253154 [1,0,0,1,0,0|2,0,0]=4 4727 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-3624406213 [1,0,0,1,0,0|2,0,0]=4 4728 B7R1.4 O[C@@H]1COC[C@H]1O MCULE-5846282762 [1,0,0,1,0,0|1,0,0]=3 4729 B7R1.4 O[C@H]1CCC[C@@H]1F MCULE-5487297072 [1,0,0,1,0,0|1,0,0]=3 4730 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4051443060 [1,0,0,1,0,0|0,0,0]=2 4731 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4644231649 [1,0,0,1,0,0|0,0,0]=2 4732 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-6847877597 [1,0,0,1,0,0|0,0,0]=2 4733 B7R1.4 O[C@H]1CCC[C@H]1Br MCULE-2758354858 [1,0,0,1,0,0|1,0,0]=3 4734 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-6157730443 [1,0,0,1,0,0|1,0,0]=3 4735 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-8785327416 [1,0,0,1,0,0|1,0,0]=3 4736 B7R1.4 O[C@H]1CCC[C@H]1O MCULE-7305350842 [1,0,0,1,0,0|0,0,0]=2 4737 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-3839318633 [1,0,0,1,0,0|2,0,0]=4 4738 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-4218821429 [1,0,0,1,0,0|2,0,0]=4 4739 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-7845583982 [1,0,0,1,0,0|2,0,0]=4 4740 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-9325791348 [1,0,0,1,0,0|2,0,0]=4 4741 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-5585016580 [1,0,0,1,0,0|1,0,0]=3 4742 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-6252837981 [1,0,0,1,0,0|1,0,0]=3 4743 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-7474807017 [1,0,0,1,0,0|1,0,0]=3 4744 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-8814174366 [1,0,0,1,0,0|1,0,0]=3 4745 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-9936814184 [1,0,0,1,0,0|1,0,0]=3 4746 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-2104048645 [1,0,0,1,0,0|2,0,0]=4 4747 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5086480017 [1,0,0,1,0,0|2,0,0]=4 4748 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5328004683 [1,0,0,1,0,0|2,0,0]=4 4749 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5990996560 [1,0,0,1,0,0|2,0,0]=4 4750 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-8087937166 [1,0,0,1,0,0|1,0,0]=3 4751 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-9522092804 [1,0,0,1,0,0|1,0,0]=3 4752 B7R1.4 O[C@H]1COC[C@@H]1F MCULE-7724910066 [1,0,0,1,0,0|2,0,0]=4 4753 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-2140544466 [1,0,0,1,0,0|1,0,0]=3 4754 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-9526811966 [1,0,0,1,0,0|1,0,0]=3 4755 B7R1.4 O[C@H]1COC[C@H]1O MCULE-2862505352 [1,0,0,1,0,0|1,0,0]=3 4756 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-2430440513 [1,0,0,1,0,0|2,0,0]=4 4757 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-8503171996 [1,0,0,1,0,0|2,0,0]=4 4758 B7R1.4 [C@@H]1(CCC[C@H]1N)F MCULE-5545998720 [1,0,0,1,0,0|2,0,0]=4 4759 B7R1.4 [C@@H]1(CNC[C@@H]1O)O MCULE-2661544949 [1,0,0,1,0,0|1,0,0]=3 4760 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-1484680203 [1,0,0,1,0,0|2,0,0]=4 4761 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-7754900549 [1,0,0,1,0,0|2,0,0]=4 4762 B7R1.4 [NH3+][C@@H]1CSC[C@@H]1O MCULE-5747970201 [1,0,0,1,0,0|2,0,0]=4 4763 B7R1.4 [NH3+][C@@H]1CSC[C@H]1O MCULE-4897701746 [1,0,0,1,0,0|2,0,0]=4 4764 B7R1.5 CCCC1CC1N MCULE-6204339829 [1,0,0,1,0,0|2,0,0]=4 4765 B7R1.5 CCCC1ON1C MCULE-8959342998 [1,0,0,1,0,0|2,0,0]=4 4766 B7R1.6 BrCCC1CCO1 MCULE-2777479085 [1,0,0,1,0,0|2,0,0]=4 4767 B7R1.6 BrCCC1COC1 MCULE-8858681111 [1,0,0,1,0,0|2,0,0]=4 4768 B7R1.6 CCCC1CCN1 MCULE-7330412999 [1,0,0,1,0,0|2,0,0]=4 4769 B7R1.6 CCCC1CNC1 MCULE-4374477641 [1,0,0,1,0,0|2,0,0]=4 4770 B7R1.6 CCCC1CNC1 MCULE-8036298863 [1,0,0,1,0,0|2,0,0]=4 4771 B7R1.6 CCNC1COC1 MCULE-6357248771 [1,0,0,1,0,0|2,0,0]=4 4772 B7R1.6 CCNC1COC1 MCULE-8144856469 [1,0,0,1,0,0|2,0,0]=4 4773 B7R1.6 CNCC1CCO1 MCULE-5990606434 [1,0,0,1,0,0|2,0,0]=4 4774 B7R1.6 CNCC1COC1 MCULE-9048388624 [1,0,0,1,0,0|2,0,0]=4 4775 B7R1.6 ICCC1CCO1 MCULE-3778448773 [1,0,0,1,0,0|2,0,0]=4 4776 B7R1.6 ICCC1COC1 MCULE-6063305860 [1,0,0,1,0,0|2,0,0]=4 4777 B7R1.6 NCCC1CCO1 MCULE-3619983020 [1,0,0,1,0,0|2,0,0]=4 4778 B7R1.6 NCCC1COC1 MCULE-6363254952 [1,0,0,1,0,0|2,0,0]=4 4779 B7R1.6 NCCC1COC1 MCULE-6907504739 [1,0,0,1,0,0|2,0,0]=4 4780 B7R1.6 NCC[C@@H]1CCO1 MCULE-5442768835 [1,0,0,1,0,0|2,0,0]=4 4781 B7R1.6 OCCC1CCO1 MCULE-3323265996 [1,0,0,1,0,0|2,0,0]=4 4782 B7R1.6 OCCC1COC1 MCULE-2515762048 [1,0,0,1,0,0|2,0,0]=4 4783 B7R1.6 OCC[C@@H]1CCO1 MCULE-6606073727 [1,0,0,1,0,0|2,0,0]=4 4784 B7R1.6 OCC[C@H]1CCO1 MCULE-4848994972 [1,0,0,1,0,0|2,0,0]=4 4785 B7R1.6 OCC[C@H]1CCO1 MCULE-9787306242 [1,0,0,1,0,0|2,0,0]=4 4786 B7R1.8 CN[C@H]1CC[C@@H]1O MCULE-4638367588 [1,0,0,1,0,0|2,0,0]=4 4787 B7R1.8 OCC1CCC1O MCULE-9764745395 [1,0,0,1,0,0|2,0,0]=4 4788 B7R1.8 OC[C@@H]1CC[C@H]1O MCULE-5043281368 [1,0,0,1,0,0|2,0,0]=4 4789 B7R1.8 OC[C@H]1CC[C@H]1O MCULE-1536326248 [1,0,0,1,0,0|2,0,0]=4 4790 B7R1.9 CCC1CC1CN MCULE-6264158284 [1,0,0,1,0,0|2,0,0]=4 4791 B7R1.9 CCC1CC1CN MCULE-7047201371 [1,0,0,1,0,0|2,0,0]=4 4792 B7R1.9 CCC1CC1CO MCULE-3342087238 [1,0,0,1,0,0|1,0,0]=3 4793 B7R1.9 NCC1CC1CO MCULE-2679526126 [1,0,0,1,0,0|2,0,0]=4 4794 B7R1.9 NC[C@H]1C[C@@H]1CO MCULE-4100547975 [1,0,0,1,0,0|2,0,0]=4 4795 B7R1.9 NC[C@H]1C[C@H]1CO MCULE-4756509186 [1,0,0,1,0,0|2,0,0]=4 4796 B7R1.9 OCC1CC1CO MCULE-5153064657 [1,0,0,1,0,0|2,0,0]=4 4797 B7R1.9 OC[C@H]1C[C@H]1CO MCULE-9036138013 [1,0,0,1,0,0|2,0,0]=4 4798 B7R1.10 CC1CC(C1)CBr MCULE-3814375250 [1,0,0,1,0,0|2,0,0]=4 4799 B7R1.10 CC1CC(C1)CN MCULE-4821587591 [1,0,0,1,0,0|2,0,0]=4 4800 B7R1.10 CC1CC(C1)CN MCULE-8372628495 [1,0,0,1,0,0|2,0,0]=4 4801 B7R1.10 CC1CC(C1)CO MCULE-5730978355 [1,0,0,1,0,0|1,0,0]=3 4802 B7R1.10 CN1CC(C1)CO MCULE-7263385340 [1,0,0,1,0,0|2,0,0]=4 4803 B7R1.10 CN1CC(C1)CO MCULE-8892079014 [1,0,0,1,0,0|2,0,0]=4 4804 B7R1.10 NC1CC(C1)CO MCULE-4549811698 [1,0,0,1,0,0|2,0,0]=4 4805 B7R1.10 NC1CC(C1)CO MCULE-9310533439 [1,0,0,1,0,0|2,0,0]=4 4806 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-1976271596 [1,0,0,1,0,0|2,0,0]=4 4807 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-2004610084 [1,0,0,1,0,0|2,0,0]=4 4808 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-3406959231 [1,0,0,1,0,0|2,0,0]=4 4809 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-9771399616 [1,0,0,1,0,0|2,0,0]=4 4810 B7R1.10 OCC1CC(C1)Br MCULE-6426656913 [1,0,0,1,0,0|2,0,0]=4 4811 B7R1.10 OCC1CC(C1)Cl MCULE-8102550006 [1,0,0,1,0,0|2,0,0]=4 4812 B7R1.10 OCC1CC(C1)F MCULE-8343173774 [1,0,0,1,0,0|2,0,0]=4 4813 B7R1.10 OCC1CC(C1)O MCULE-3885216336 [1,0,0,1,0,0|2,0,0]=4 4814 B7R1.10 OC[C@H]1C[C@H](C1)O MCULE-2350233032 [1,0,0,1,0,0|2,0,0]=4 4815 B7R1.21 CCCC1(CC1)N MCULE-2015286161 [1,0,0,1,0,0|2,0,0]=4 4816 B7R1.21 CCCC1(CC1)N MCULE-9864007655 [1,0,0,1,0,0|2,0,0]=4 4817 B7R1.21 CCOC1(CC1)O MCULE-9629273021 [1,0,0,1,0,0|2,0,0]=4 4818 B7R1.21 CNCC1(CC1)O MCULE-3223715599 [1,0,0,1,0,0|2,0,0]=4 4819 B7R1.21 CNCC1(CC1)O MCULE-4292226298 [1,0,0,1,0,0|2,0,0]=4 4820 B7R1.21 COCC1(CO1)C MCULE-8694642597 [1,0,0,1,0,0|2,0,0]=4 4821 B7R1.21 NCCC1(CC1)O MCULE-7254265215 [1,0,0,1,0,0|2,0,0]=4 4822 B7R1.21 NCCC1(CC1)O MCULE-9873887297 [1,0,0,1,0,0|2,0,0]=4 4823 B7R1.21 OC1(CC1)CCBr MCULE-4785989916 [1,0,0,1,0,0|2,0,0]=4 4824 B7R1.21 OCCC1(CC1)O MCULE-9575986419 [1,0,0,1,0,0|2,0,0]=4 4825 B7R1.22 C#CC(O)C1CC1 MCULE-2821595189 [1,0,0,1,0,0|1,0,1]=4 4826 B7R1.22 C=CC(O)C1CC1 MCULE-5079761130 [1,0,0,1,0,0|1,0,1]=4 4827 B7R1.22 CC(CBr)C1CC1 MCULE-6817011252 [1,0,0,1,0,0|2,0,0]=4 4828 B7R1.22 CC(CN)C1CC1 MCULE-8672047249 [1,0,0,1,0,0|2,0,0]=4 4829 B7R1.22 CC(CN)C1CC1 MCULE-9115092780 [1,0,0,1,0,0|2,0,0]=4 4830 B7R1.22 CC(CO)C1CC1 MCULE-8325587009 [1,0,0,1,0,0|1,0,0]=3 4831 B7R1.22 CCC(N)C1CC1 MCULE-2935155085 [1,0,0,1,0,0|2,0,0]=4 4832 B7R1.22 CCC(N)C1CC1 MCULE-7295156418 [1,0,0,1,0,0|2,0,0]=4 4833 B7R1.22 CCC(O)C1CC1 MCULE-5753196768 [1,0,0,1,0,0|1,0,0]=3 4834 B7R1.22 CC[C@@H](N)C1CC1 MCULE-8184175332 [1,0,0,1,0,0|2,0,0]=4 4835 B7R1.22 CC[C@H](N)C1CC1 MCULE-5395953598 [1,0,0,1,0,0|2,0,0]=4 4836 B7R1.22 CC[C@H](N)C1CC1 MCULE-6843001585 [1,0,0,1,0,0|2,0,0]=4 4837 B7R1.22 CC[C@H](N)C1CC1 MCULE-8773009184 [1,0,0,1,0,0|2,0,0]=4 4838 B7R1.22 N#CC(O)C1CC1 MCULE-8814691593 [1,0,0,1,0,0|1,0,1]=4 4839 B7R1.22 NC(CO)C1CC1 MCULE-5154854421 [1,0,0,1,0,0|1,0,0]=3 4840 B7R1.22 NC(CO)C1CC1 MCULE-8775546228 [1,0,0,1,0,0|1,0,0]=3 4841 B7R1.22 NCC(N)C1CC1 MCULE-9464810605 [1,0,0,1,0,0|2,0,0]=4 4842 B7R1.22 NCC(O)C1CC1 MCULE-4953920778 [1,0,0,1,0,0|1,0,0]=3 4843 B7R1.22 NCC(O)C1CC1 MCULE-5905916662 [1,0,0,1,0,0|1,0,0]=3 4844 B7R1.22 NC[C@@H](N)C1CC1 MCULE-3450570705 [1,0,0,1,0,0|2,0,0]=4 4845 B7R1.22 NC[C@@H](N)C1CC1 MCULE-4753758413 [1,0,0,1,0,0|2,0,0]=4 4846 B7R1.22 NC[C@@H](N)C1CC1 MCULE-4823446729 [1,0,0,1,0,0|2,0,0]=4 4847 B7R1.22 NC[C@@H](N)C1CC1 MCULE-7123860849 [1,0,0,1,0,0|2,0,0]=4 4848 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5231249344 [1,0,0,1,0,0|1,0,0]=3 4849 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5233980282 [1,0,0,1,0,0|1,0,0]=3 4850 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9664157108 [1,0,0,1,0,0|1,0,0]=3 4851 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9941605288 [1,0,0,1,0,0|1,0,0]=3 4852 B7R1.22 N[C@H](CO)C1CC1 MCULE-3523450080 [1,0,0,1,0,0|1,0,0]=3 4853 B7R1.22 N[C@H](CO)C1CC1 MCULE-6097147899 [1,0,0,1,0,0|1,0,0]=3 4854 B7R1.22 N[C@H](CO)C1CC1 MCULE-9050007019 [1,0,0,1,0,0|1,0,0]=3 4855 B7R1.22 N[C@H](CO)C1CC1 MCULE-9945100855 [1,0,0,1,0,0|1,0,0]=3 4856 B7R1.22 O=C(CO)C1CC1 MCULE-4276266642 [1,0,0,1,0,0|0,0,2]=4 4857 B7R1.22 OC(CBr)C1CC1 MCULE-1163924206 [1,0,0,1,0,0|1,0,0]=3 4858 B7R1.22 OCC(O)C1CC1 MCULE-9694056700 [1,0,0,1,0,0|0,0,0]=2 4859 B7R1.25 C#CC1(CCC1)O MCULE-2183185313 [1,0,0,1,0,0|1,0,1]=4 4860 B7R1.25 CC1(CCC1)CBr MCULE-8887285694 [1,0,0,1,0,0|2,0,0]=4 4861 B7R1.25 CC1(CCC1)CN MCULE-2351992333 [1,0,0,1,0,0|2,0,0]=4 4862 B7R1.25 CC1(CCC1)CN MCULE-4768166684 [1,0,0,1,0,0|2,0,0]=4 4863 B7R1.25 CC1(CCC1)CO MCULE-9646690839 [1,0,0,1,0,0|1,0,0]=3 4864 B7R1.25 CC1(CCC1)CS MCULE-2920048402 [1,0,0,1,0,0|1,1,0]=4 4865 B7R1.25 CC1(CCN1)CO MCULE-2134260042 [1,0,0,1,0,0|2,0,0]=4 4866 B7R1.25 CC1(CCN1)CO MCULE-3210259937 [1,0,0,1,0,0|2,0,0]=4 4867 B7R1.25 CC1(CCO1)CO MCULE-6424264752 [1,0,0,1,0,0|2,0,0]=4 4868 B7R1.25 CC1(CNC1)CO MCULE-4856424189 [1,0,0,1,0,0|2,0,0]=4 4869 B7R1.25 CC1(CNC1)CO MCULE-7118798664 [1,0,0,1,0,0|2,0,0]=4 4870 B7R1.25 CC1(COC1)CO MCULE-5859568263 [1,0,0,1,0,0|2,0,0]=4 4871 B7R1.25 CC1(CSC1)CO MCULE-2267957602 [1,0,0,1,0,0|2,0,0]=4 4872 B7R1.25 CCC1(CCC1)N MCULE-5053916607 [1,0,0,1,0,0|2,0,0]=4 4873 B7R1.25 CCC1(CCC1)N MCULE-5413278315 [1,0,0,1,0,0|2,0,0]=4 4874 B7R1.25 CCC1(CNC1)O MCULE-5663327812 [1,0,0,1,0,0|2,0,0]=4 4875 B7R1.25 CCC1(CNC1)O MCULE-5973200057 [1,0,0,1,0,0|2,0,0]=4 4876 B7R1.25 CCC1(CNC1)O MCULE-7770950299 [1,0,0,1,0,0|2,0,0]=4 4877 B7R1.25 CCC1(COC1)O MCULE-7543171366 [1,0,0,1,0,0|2,0,0]=4 4878 B7R1.25 C[C@@]1(CCO1)CO MCULE-4685471926 [1,0,0,1,0,0|2,0,0]=4 4879 B7R1.25 C[C@@]1(CCO1)CO MCULE-5799098537 [1,0,0,1,0,0|2,0,0]=4 4880 B7R1.25 C[C@]1(CCO1)CO MCULE-5749345841 [1,0,0,1,0,0|2,0,0]=4 4881 B7R1.25 FC1(CCC1)CBr MCULE-3319458488 [1,0,0,1,0,0|2,0,0]=4 4882 B7R1.25 N#CC1(CCC1)O MCULE-8825556606 [1,0,0,1,0,0|1,0,1]=4 4883 B7R1.25 NC1(CCC1)CF MCULE-1820863854 [1,0,0,1,0,0|2,0,0]=4 4884 B7R1.25 NC1(CCC1)CF MCULE-4073039809 [1,0,0,1,0,0|2,0,0]=4 4885 B7R1.25 NC1(CCC1)CO MCULE-3303213714 [1,0,0,1,0,0|1,0,0]=3 4886 B7R1.25 NC1(CCC1)CO MCULE-7230626576 [1,0,0,1,0,0|1,0,0]=3 4887 B7R1.25 NC1(COC1)CO MCULE-5347414182 [1,0,0,1,0,0|2,0,0]=4 4888 B7R1.25 NCC1(CCC1)F MCULE-4269584193 [1,0,0,1,0,0|2,0,0]=4 4889 B7R1.25 NCC1(CCC1)F MCULE-8050912377 [1,0,0,1,0,0|2,0,0]=4 4890 B7R1.25 NCC1(CCC1)N MCULE-4976713787 [1,0,0,1,0,0|2,0,0]=4 4891 B7R1.25 NCC1(CCC1)N MCULE-8019875303 [1,0,0,1,0,0|2,0,0]=4 4892 B7R1.25 NCC1(CCC1)O MCULE-1242555690 [1,0,0,1,0,0|1,0,0]=3 4893 B7R1.25 NCC1(COC1)O MCULE-6677052127 [1,0,0,1,0,0|2,0,0]=4 4894 B7R1.25 OC1(CCC1)CBr MCULE-7282991867 [1,0,0,1,0,0|1,0,0]=3 4895 B7R1.25 OC1(CNC1)CF MCULE-2176182716 [1,0,0,1,0,0|2,0,0]=4 4896 B7R1.25 OC1(CNC1)CF MCULE-4315199916 [1,0,0,1,0,0|2,0,0]=4 4897 B7R1.25 OC1(COC1)CF MCULE-1428128025 [1,0,0,1,0,0|2,0,0]=4 4898 B7R1.25 OCC1(CCC1)F MCULE-5944864184 [1,0,0,1,0,0|1,0,0]=3 4899 B7R1.25 OCC1(CCC1)O MCULE-2830358505 [1,0,0,1,0,0|0,0,0]=2 4900 B7R1.25 OCC1(CNC1)F MCULE-7526502512 [1,0,0,1,0,0|2,0,0]=4 4901 B7R1.25 OCC1(CNC1)F MCULE-7804174908 [1,0,0,1,0,0|2,0,0]=4 4902 B7R1.25 OCC1(CNC1)O MCULE-1089145184 [1,0,0,1,0,0|1,0,0]=3 4903 B7R1.25 OCC1(CNC1)O MCULE-8217738451 [1,0,0,1,0,0|1,0,0]=3 4904 B7R1.25 OCC1(CNC1)O MCULE-9215525935 [1,0,0,1,0,0|1,0,0]=3 4905 B7R1.25 OCC1(CNC1)O MCULE-9389454165 [1,0,0,1,0,0|1,0,0]=3 4906 B7R1.25 OCC1(COC1)F MCULE-9098723776 [1,0,0,1,0,0|2,0,0]=4 4907 B7R1.25 OCC1(COC1)O MCULE-4207928663 [1,0,0,1,0,0|1,0,0]=3 4908 B7R1.27 CC1(CC1Br)CO MCULE-5286402958 [1,0,0,1,0,0|2,0,0]=4 4909 B7R1.27 CC1(CC1F)CO MCULE-9626513813 [1,0,0,1,0,0|2,0,0]=4 4910 B7R1.7 BrCCCC1CC1 MCULE-1359115765 [1,0,0,1,0,0|2,0,0]=4 4911 B7R1.7 C#CCCC1CO1 MCULE-8252140231 [1,0,0,1,0,0|0,0,2]=4 4912 B7R1.7 C=CCCC1CO1 MCULE-2331378134 [1,0,0,1,0,0|0,0,2]=4 4913 B7R1.7 C=CCC[C@H]1CO1 MCULE-4953904401 [1,0,0,1,0,0|0,0,2]=4 4914 B7R1.7 C=CCC[C@H]1CO1 MCULE-7730579466 [1,0,0,1,0,0|0,0,2]=4 4915 B7R1.7 CC/C=C/[C@H]1CO1 MCULE-2083815927 [1,0,0,1,0,0|0,0,2]=4 4916 B7R1.7 CCCCC1CO1 MCULE-8403189539 [1,0,0,1,0,0|0,0,0]=2 4917 B7R1.7 CCCNC1CC1 MCULE-7033521193 [1,0,0,1,0,0|2,0,0]=4 4918 B7R1.7 CCCNC1CC1 MCULE-8227176324 [1,0,0,1,0,0|2,0,0]=4 4919 B7R1.7 CCNCC1CC1 MCULE-3070053773 [1,0,0,1,0,0|2,0,0]=4 4920 B7R1.7 CCNCC1CC1 MCULE-5997221486 [1,0,0,1,0,0|2,0,0]=4 4921 B7R1.7 CCOCC1CO1 MCULE-2647353662 [1,0,0,1,0,0|1,0,0]=3 4922 B7R1.7 CNCCC1CC1 MCULE-2375777124 [1,0,0,1,0,0|2,0,0]=4 4923 B7R1.7 CNCCC1CC1 MCULE-9913761675 [1,0,0,1,0,0|2,0,0]=4 4924 B7R1.7 COCCC1CO1 MCULE-9068008411 [1,0,0,1,0,0|1,0,0]=3 4925 B7R1.7 NCCCC1CC1 MCULE-1579218471 [1,0,0,1,0,0|2,0,0]=4 4926 B7R1.7 NCCCC1CC1 MCULE-8160460213 [1,0,0,1,0,0|2,0,0]=4 4927 B7R1.7 OCCCC1CC1 MCULE-5336501479 [1,0,0,1,0,0|2,0,0]=4 4928 B7R1.12 CC(=O)C1CC1C MCULE-5857709747 [1,0,0,1,0,0|0,0,2]=4 4929 B7R1.12 CC(=O)[C@@H]1C[C@H]1C MCULE-4367650211 [1,0,0,1,0,0|0,0,2]=4 4930 B7R1.12 CC(C)[C@@H]1C[C@H]1N MCULE-1713655941 [1,0,0,1,0,0|2,0,0]=4 4931 B7R1.12 CC(C)[C@@H]1C[C@H]1N MCULE-5926317826 [1,0,0,1,0,0|2,0,0]=4 4932 B7R1.12 CC1CC1C(=O)O MCULE-1757330006 [1,0,0,1,0,0|0,0,2]=4 4933 B7R1.12 C[C@@H]1C[C@@H]1B(O)O MCULE-4091409950 [1,0,0,1,0,0|1,0,0]=3 4934 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-1245851874 [1,0,0,1,0,0|0,0,2]=4 4935 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-9582782871 [1,0,0,1,0,0|0,0,2]=4 4936 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-2621918749 [1,0,0,1,0,0|0,0,2]=4 4937 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-7347988261 [1,0,0,1,0,0|0,0,2]=4 4938 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-4499487863 [1,0,0,1,0,0|0,0,2]=4 4939 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-9300153165 [1,0,0,1,0,0|0,0,2]=4 4940 B7R1.12 C[C@H]1C[C@H]1B(O)O MCULE-9584013970 [1,0,0,1,0,0|1,0,0]=3 4941 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-4410115478 [1,0,0,1,0,0|0,0,2]=4 4942 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-6590525761 [1,0,0,1,0,0|0,0,2]=4 4943 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-8070492716 [1,0,0,1,0,0|0,0,2]=4 4944 B7R1.12 [C@H]1(C[C@H]1C(=O)O)C MCULE-9539625763 [1,0,0,1,0,0|0,0,2]=4 4945 B7R1.14 CC1(CCCC1)Br MCULE-8706490914 [1,0,0,1,0,0|1,0,0]=3 4946 B7R1.14 CC1(CCCC1)N MCULE-1696024032 [1,0,0,1,0,0|1,0,0]=3 4947 B7R1.14 CC1(CCCC1)N MCULE-7897960444 [1,0,0,1,0,0|1,0,0]=3 4948 B7R1.14 CC1(CCCC1)O MCULE-1425529053 [1,0,0,1,0,0|0,0,0]=2 4949 B7R1.14 CC1(CCCN1)C MCULE-3172250386 [1,0,0,1,0,0|2,0,0]=4 4950 B7R1.14 CC1(CCCN1)C MCULE-6227706175 [1,0,0,1,0,0|2,0,0]=4 4951 B7R1.14 CC1(CCNC1)C MCULE-3460660754 [1,0,0,1,0,0|2,0,0]=4 4952 B7R1.14 CC1(CCNC1)C MCULE-7874744806 [1,0,0,1,0,0|2,0,0]=4 4953 B7R1.14 CC1(CCNC1)C MCULE-9717378283 [1,0,0,1,0,0|2,0,0]=4 4954 B7R1.14 CC1(CCNC1)F MCULE-1205333206 [1,0,0,1,0,0|2,0,0]=4 4955 B7R1.14 CC1(CCNC1)F MCULE-8512729081 [1,0,0,1,0,0|2,0,0]=4 4956 B7R1.14 CC1(CCNC1)N MCULE-9317786482 [1,0,0,1,0,0|2,0,0]=4 4957 B7R1.14 CC1(CCNC1)N MCULE-9638120938 [1,0,0,1,0,0|2,0,0]=4 4958 B7R1.14 CC1(CCNC1)O MCULE-1812572207 [1,0,0,1,0,0|1,0,0]=3 4959 B7R1.14 CC1(CCNC1)O MCULE-3978790995 [1,0,0,1,0,0|1,0,0]=3 4960 B7R1.14 CC1(CCNC1)O MCULE-6355817754 [1,0,0,1,0,0|1,0,0]=3 4961 B7R1.14 CC1(CCNC1)O MCULE-7199660654 [1,0,0,1,0,0|1,0,0]=3 4962 B7R1.14 CC1(CCOC1)N MCULE-1997756007 [1,0,0,1,0,0|2,0,0]=4 4963 B7R1.14 CC1(CCOC1)N MCULE-5807249895 [1,0,0,1,0,0|2,0,0]=4 4964 B7R1.14 CC1(CCOC1)O MCULE-5065022086 [1,0,0,1,0,0|1,0,0]=3 4965 B7R1.14 CC1(CCSC1)O MCULE-3138867143 [1,0,0,1,0,0|1,0,0]=3 4966 B7R1.14 C[C@@]1(CCNC1)F MCULE-1340440767 [1,0,0,1,0,0|2,0,0]=4 4967 B7R1.14 C[C@@]1(CCNC1)F MCULE-5898059594 [1,0,0,1,0,0|2,0,0]=4 4968 B7R1.14 C[C@@]1(CCNC1)F MCULE-6901424312 [1,0,0,1,0,0|2,0,0]=4 4969 B7R1.14 C[C@@]1(CCNC1)F MCULE-9433824470 [1,0,0,1,0,0|2,0,0]=4 4970 B7R1.14 C[C@@]1(CCNC1)N MCULE-3652011553 [1,0,0,1,0,0|2,0,0]=4 4971 B7R1.14 C[C@@]1(CCNC1)O MCULE-2185266890 [1,0,0,1,0,0|1,0,0]=3 4972 B7R1.14 C[C@@]1(CCNC1)O MCULE-4472850857 [1,0,0,1,0,0|1,0,0]=3 4973 B7R1.14 C[C@@]1(CCNC1)O MCULE-7216590589 [1,0,0,1,0,0|1,0,0]=3 4974 B7R1.14 C[C@@]1(CCNC1)O MCULE-9031112405 [1,0,0,1,0,0|1,0,0]=3 4975 B7R1.14 C[C@@]1(CNOC1)O MCULE-2135476163 [1,0,0,1,0,0|2,0,0]=4 4976 B7R1.14 C[C@@]1(CNOC1)O MCULE-2596956621 [1,0,0,1,0,0|2,0,0]=4 4977 B7R1.14 C[C@@]1(CNOC1)O MCULE-6080745149 [1,0,0,1,0,0|2,0,0]=4 4978 B7R1.14 C[C@@]1(CNOC1)O MCULE-7091595110 [1,0,0,1,0,0|2,0,0]=4 4979 B7R1.14 C[C@]1(CCNC1)F MCULE-1291336282 [1,0,0,1,0,0|2,0,0]=4 4980 B7R1.14 C[C@]1(CCNC1)F MCULE-2571688853 [1,0,0,1,0,0|2,0,0]=4 4981 B7R1.14 C[C@]1(CCNC1)O MCULE-2513078981 [1,0,0,1,0,0|1,0,0]=3 4982 B7R1.14 C[C@]1(CCNC1)O MCULE-2837064957 [1,0,0,1,0,0|1,0,0]=3 4983 B7R1.14 C[C@]1(CCNC1)O MCULE-5133863014 [1,0,0,1,0,0|1,0,0]=3 4984 B7R1.14 C[C@]1(CCNC1)O MCULE-5887726834 [1,0,0,1,0,0|1,0,0]=3 4985 B7R1.14 C[C@]1(CNOC1)O MCULE-1405004782 [1,0,0,1,0,0|2,0,0]=4 4986 B7R1.14 C[C@]1(CNOC1)O MCULE-4558122242 [1,0,0,1,0,0|2,0,0]=4 4987 B7R1.14 C[N+]1(CCCC1)C MCULE-3715522497 [1,0,0,1,0,0|2,0,0]=4 4988 B7R1.14 C[N+]1(CCCC1)C MCULE-9941565311 [1,0,0,1,0,0|2,0,0]=4 4989 B7R1.14 C[Si]1(CCCC1)C MCULE-1541355807 [1,0,0,1,0,0|1,1,0]=4 4990 B7R1.17 CC1(CCC1Br)C MCULE-2707590334 [1,0,0,1,0,0|2,0,0]=4 4991 B7R1.17 CC1(CCC1N)C MCULE-3143969489 [1,0,0,1,0,0|2,0,0]=4 4992 B7R1.17 CC1(CCC1N)C MCULE-7719131610 [1,0,0,1,0,0|2,0,0]=4 4993 B7R1.17 CC1(CCC1O)C MCULE-7385359414 [1,0,0,1,0,0|2,0,0]=4 4994 B7R1.17 CC1(CC[C@@H]1O)C MCULE-9766955692 [1,0,0,1,0,0|2,0,0]=4 4995 B7R1.18 CC(=O)C1CCC1 MCULE-5770046789 [1,0,0,1,0,0|0,0,2]=4 4996 B7R1.18 CC(C)C1CNC1 MCULE-4830353053 [1,0,0,1,0,0|2,0,0]=4 4997 B7R1.18 CC(C)C1CNC1 MCULE-7304386148 [1,0,0,1,0,0|2,0,0]=4 4998 B7R1.18 CC(N)C1CCC1 MCULE-1055775237 [1,0,0,1,0,0|1,0,0]=3 4999 B7R1.18 CC(N)C1CCC1 MCULE-4303681430 [1,0,0,1,0,0|1,0,0]=3 5000 B7R1.18 CC(N)C1COC1 MCULE-1380624257 [1,0,0,1,0,0|2,0,0]=4 5001 B7R1.18 CC(N)C1CSC1 MCULE-5095506053 [1,0,0,1,0,0|2,0,0]=4 5002 B7R1.18 CC(O)C1CCC1 MCULE-7846963519 [1,0,0,1,0,0|0,0,0]=2 5003 B7R1.18 CC(O)C1CNC1 MCULE-1265886795 [1,0,0,1,0,0|1,0,0]=3 5004 B7R1.18 CC(O)C1CNC1 MCULE-5108259269 [1,0,0,1,0,0|1,0,0]=3 5005 B7R1.18 CC(O)C1CNC1 MCULE-8265279011 [1,0,0,1,0,0|1,0,0]=3 5006 B7R1.18 CC(O)C1COC1 MCULE-4981198639 [1,0,0,1,0,0|1,0,0]=3 5007 B7R1.18 C[C@@H](N)C1CCC1 MCULE-4670161237 [1,0,0,1,0,0|1,0,0]=3 5008 B7R1.18 C[C@@H](N)C1CCC1 MCULE-6520272933 [1,0,0,1,0,0|1,0,0]=3 5009 B7R1.18 C[C@@H](N)C1CCC1 MCULE-8342688572 [1,0,0,1,0,0|1,0,0]=3 5010 B7R1.18 C[C@@H](N)C1CCC1 MCULE-9076983662 [1,0,0,1,0,0|1,0,0]=3 5011 B7R1.18 C[C@@H](N)C1COC1 MCULE-7669553866 [1,0,0,1,0,0|2,0,0]=4 5012 B7R1.18 C[C@@H](O)C1CCC1 MCULE-6990873960 [1,0,0,1,0,0|0,0,0]=2 5013 B7R1.18 C[C@@H](O)C1COC1 MCULE-5223611242 [1,0,0,1,0,0|1,0,0]=3 5014 B7R1.18 C[C@@H](O)C1COC1 MCULE-5819578881 [1,0,0,1,0,0|1,0,0]=3 5015 B7R1.18 C[C@H](N)C1CCC1 MCULE-2555280675 [1,0,0,1,0,0|1,0,0]=3 5016 B7R1.18 C[C@H](N)C1CCC1 MCULE-3888125434 [1,0,0,1,0,0|1,0,0]=3 5017 B7R1.18 C[C@H](N)C1CCC1 MCULE-6963105805 [1,0,0,1,0,0|1,0,0]=3 5018 B7R1.18 C[C@H](N)C1CCC1 MCULE-7483270694 [1,0,0,1,0,0|1,0,0]=3 5019 B7R1.18 C[C@H](N)C1COC1 MCULE-8337949293 [1,0,0,1,0,0|2,0,0]=4 5020 B7R1.18 C[C@H](O)C1CCC1 MCULE-5072123772 [1,0,0,1,0,0|0,0,0]=2 5021 B7R1.18 C[C@H](O)C1CCC1 MCULE-6701623925 [1,0,0,1,0,0|0,0,0]=2 5022 B7R1.18 C[C@H](O)C1CNC1 MCULE-4694154501 [1,0,0,1,0,0|1,0,0]=3 5023 B7R1.18 C[C@H](O)C1CNC1 MCULE-5870270724 [1,0,0,1,0,0|1,0,0]=3 5024 B7R1.18 C[C@H](O)C1COC1 MCULE-1396791034 [1,0,0,1,0,0|1,0,0]=3 5025 B7R1.18 C[C@H](O)C1COC1 MCULE-8805369596 [1,0,0,1,0,0|1,0,0]=3 5026 B7R1.18 O=C(O)C1CCC1 MCULE-2498509888 [1,0,0,1,0,0|0,0,2]=4 5027 B7R1.18 OB(O)C1CCC1 MCULE-3574521261 [1,0,0,1,0,0|1,0,0]=3 5028 B7R1.20 CC(=O)CC1CC1 MCULE-3465510397 [1,0,0,1,0,0|0,0,2]=4 5029 B7R1.20 CC(C)CC1CO1 MCULE-7259971470 [1,0,0,1,0,0|2,0,0]=4 5030 B7R1.20 CC(C)NC1CC1 MCULE-6011790113 [1,0,0,1,0,0|2,0,0]=4 5031 B7R1.20 CC(C)NC1CC1 MCULE-8727654998 [1,0,0,1,0,0|2,0,0]=4 5032 B7R1.20 CC(N)CC1CC1 MCULE-1913565015 [1,0,0,1,0,0|1,0,0]=3 5033 B7R1.20 CC(N)CC1CC1 MCULE-2214997571 [1,0,0,1,0,0|1,0,0]=3 5034 B7R1.20 CC(O)CC1CC1 MCULE-1952195648 [1,0,0,1,0,0|0,0,0]=2 5035 B7R1.20 CN(C)CC1CC1 MCULE-6678267289 [1,0,0,1,0,0|2,0,0]=4 5036 B7R1.20 C[C@@H](O)CC1CC1 MCULE-2616688976 [1,0,0,1,0,0|0,0,0]=2 5037 B7R1.20 C[C@H](O)CC1CC1 MCULE-5001414363 [1,0,0,1,0,0|0,0,0]=2 5038 B7R1.20 O=C(O)CC1CC1 MCULE-3026300598 [1,0,0,1,0,0|0,0,2]=4 5039 B7R1.20 OB(O)CC1CC1 MCULE-2775080556 [1,0,0,1,0,0|1,0,0]=3 5040 B7R1.23 CC1(CC1CN)C MCULE-5243006209 [1,0,0,1,0,0|2,0,0]=4 5041 B7R1.23 CC1(CC1CN)C MCULE-8803769775 [1,0,0,1,0,0|2,0,0]=4 5042 B7R1.23 CC1(CC1CO)Br MCULE-1246890004 [1,0,0,1,0,0|2,0,0]=4 5043 B7R1.23 CC1(CC1CO)C MCULE-3855230422 [1,0,0,1,0,0|2,0,0]=4 5044 B7R1.23 CC1(C[C@@H]1CO)C MCULE-2771980454 [1,0,0,1,0,0|2,0,0]=4 5045 B7R1.23 CC1(C[C@H]1CO)C MCULE-7876524457 [1,0,0,1,0,0|2,0,0]=4 5046 B7R1.23 CNC1CC1(C)C MCULE-2392748327 [1,0,0,1,0,0|2,0,0]=4 5047 B7R1.23 CNC1CC1(C)C MCULE-6195602506 [1,0,0,1,0,0|2,0,0]=4 5048 B7R1.24 C1=CCCCCC1 MCULE-4514853156 [1,0,0,1,0,0|1,0,1]=4 5049 B7R1.24 C1CCCCCC1 MCULE-5257270866 [1,0,0,1,0,0|1,0,0]=3 5050 B7R1.24 C1CCCNCC1 MCULE-6467465155 [1,0,0,1,0,0|1,0,0]=3 5051 B7R1.24 C1CCCOCC1 MCULE-9994899395 [1,0,0,1,0,0|0,0,0]=2 5052 B7R1.24 C1CCNCNC1 MCULE-9023922794 [1,0,0,1,0,0|2,0,0]=4 5053 B7R1.24 C1CCNNCC1 MCULE-1174944539 [1,0,0,1,0,0|2,0,0]=4 5054 B7R1.24 C1CCNNCC1 MCULE-8518491960 [1,0,0,1,0,0|2,0,0]=4 5055 B7R1.24 C1CCNOCC1 MCULE-7242354366 [1,0,0,1,0,0|1,0,0]=3 5056 B7R1.24 C1CCNOCC1 MCULE-7451936178 [1,0,0,1,0,0|1,0,0]=3 5057 B7R1.24 C1CCOCOC1 MCULE-4779745094 [1,0,0,1,0,0|1,0,0]=3 5058 B7R1.24 C1CNCCNC1 MCULE-8878366291 [1,0,0,1,0,0|2,0,0]=4 5059 B7R1.24 C1CNCCOC1 MCULE-9147617519 [1,0,0,1,0,0|1,0,0]=3 5060 B7R1.24 C1CNCCOC1 MCULE-9722986943 [1,0,0,1,0,0|1,0,0]=3 5061 B7R1.24 C1CNCCSC1 MCULE-3091366568 [1,0,0,1,0,0|1,1,0]=4 5062 B7R1.24 C1CNCCSC1 MCULE-7881506212 [1,0,0,1,0,0|1,1,0]=4 5063 B7R1.24 C1CNOCCN1 MCULE-3548078740 [1,0,0,1,0,0|2,0,0]=4 5064 B7R1.24 C1CNOCCN1 MCULE-4676245477 [1,0,0,1,0,0|2,0,0]=4 5065 B7R1.24 C1COCCNN1 MCULE-5237837037 [1,0,0,1,0,0|2,0,0]=4 5066 B7R1.24 C1COCCNN1 MCULE-6195400312 [1,0,0,1,0,0|2,0,0]=4 5067 B7R1.24 C1COCCNN1 MCULE-8018224954 [1,0,0,1,0,0|2,0,0]=4 5068 B7R1.24 C1COCCON1 MCULE-1064422282 [1,0,0,1,0,0|2,0,0]=4 5069 B7R1.24 C1COCCON1 MCULE-2039128953 [1,0,0,1,0,0|2,0,0]=4 5070 B9R1.2 C1(CCCN(C1)C)CN MCULE-2271262657 [0,1,0,1,0,0|2,0,0]=4 5071 B9R1.2 C1(CCCN(C1)C)CN MCULE-8286462374 [0,1,0,1,0,0|2,0,0]=4 5072 B9R1.2 C1(CCCN(C1)C)CO MCULE-7393298394 [0,1,0,1,0,0|1,0,0]=3 5073 B9R1.2 CC1CC(CCO1)CBr MCULE-2331277769 [0,1,0,1,0,0|2,0,0]=4 5074 B9R1.2 CC1CC(CCO1)CO MCULE-1147018894 [0,1,0,1,0,0|1,0,0]=3 5075 B9R1.2 CC1CCCC(C1)CBr MCULE-4436738297 [0,1,0,1,0,0|2,0,0]=4 5076 B9R1.2 CC1CCCC(C1)CN MCULE-5692325071 [0,1,0,1,0,0|2,0,0]=4 5077 B9R1.2 CC1CCCC(C1)CO MCULE-5618525751 [0,1,0,1,0,0|1,0,0]=3 5078 B9R1.2 CC1CCCC(N1)CO MCULE-1132392693 [0,1,0,1,0,0|1,0,0]=3 5079 B9R1.2 CC1CCCC(O1)CN MCULE-9065375307 [0,1,0,1,0,0|1,0,0]=3 5080 B9R1.2 CC1CNCC(C1)CO MCULE-1604083581 [0,1,0,1,0,0|1,0,0]=3 5081 B9R1.2 CC1CNCC(O1)C#N MCULE-8375247309 [0,1,0,1,0,0|1,0,1]=4 5082 B9R1.2 CC1CNCC(O1)CO MCULE-6915504187 [0,1,0,1,0,0|0,0,0]=2 5083 B9R1.2 CCC1CC(=O)CCO1 MCULE-5885330152 [0,1,0,1,0,0|0,0,2]=4 5084 B9R1.2 CCC1CC(CCN1)O MCULE-4953737441 [0,1,0,1,0,0|1,0,0]=3 5085 B9R1.2 CCC1CC(CCN1)O MCULE-9634837614 [0,1,0,1,0,0|1,0,0]=3 5086 B9R1.2 CCC1CC(CCO1)N MCULE-4187863149 [0,1,0,1,0,0|1,0,0]=3 5087 B9R1.2 CCC1CC(CCO1)O MCULE-2215415390 [0,1,0,1,0,0|0,0,0]=2 5088 B9R1.2 CCC1CCCC(C1)C MCULE-6755768980 [0,1,0,1,0,0|2,0,0]=4 5089 B9R1.2 CCC1CCCC(C1)N MCULE-8754064896 [0,1,0,1,0,0|2,0,0]=4 5090 B9R1.2 CCC1CCCC(C1)O MCULE-5149394080 [0,1,0,1,0,0|1,0,0]=3 5091 B9R1.2 CCC1CNCC(O1)C MCULE-6402129304 [0,1,0,1,0,0|1,0,0]=3 5092 B9R1.2 CCC1COCC(N1)C MCULE-1227991263 [0,1,0,1,0,0|2,0,0]=4 5093 B9R1.2 CCN1CCCC(C1)O MCULE-8313066373 [0,1,0,1,0,0|2,0,0]=4 5094 B9R1.2 CC[C@@H]1CCC[C@@H](N1)C MCULE-4368459266 [0,1,0,1,0,0|2,0,0]=4 5095 B9R1.2 CC[C@@H]1CNC[C@@H](N1)C MCULE-8386790724 [0,1,0,1,0,0|2,0,0]=4 5096 B9R1.2 CC[C@@H]1C[C@@H](CCN1)O MCULE-1934337871 [0,1,0,1,0,0|1,0,0]=3 5097 B9R1.2 CC[C@@H]1C[C@@H](CCN1)O MCULE-5295834203 [0,1,0,1,0,0|1,0,0]=3 5098 B9R1.2 CC[C@H]1CNC[C@H](O1)C MCULE-1726802726 [0,1,0,1,0,0|1,0,0]=3 5099 B9R1.2 CN1CCCC(C1)CBr MCULE-2188601392 [0,1,0,1,0,0|2,0,0]=4 5100 B9R1.2 CN1CCCC(C1)CBr MCULE-8416104252 [0,1,0,1,0,0|2,0,0]=4 5101 B9R1.2 CN1CCCC(C1)CCl MCULE-9072621944 [0,1,0,1,0,0|2,0,0]=4 5102 B9R1.2 CN1CCCC(C1)CCl MCULE-9082077674 [0,1,0,1,0,0|2,0,0]=4 5103 B9R1.2 CN1CCCC(C1)CI MCULE-6139756055 [0,1,0,1,0,0|2,0,0]=4 5104 B9R1.2 CN1CCCC(C1)CN MCULE-2577219370 [0,1,0,1,0,0|2,0,0]=4 5105 B9R1.2 CN1CCCC(C1)CN MCULE-8304464940 [0,1,0,1,0,0|2,0,0]=4 5106 B9R1.2 CN1CCCC(C1)CO MCULE-1489029640 [0,1,0,1,0,0|1,0,0]=3 5107 B9R1.2 CN1CCC[C@@H](C1)CBr MCULE-4380599715 [0,1,0,1,0,0|2,0,0]=4 5108 B9R1.2 CN1CCC[C@@H](C1)CBr MCULE-9642300938 [0,1,0,1,0,0|2,0,0]=4 5109 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-1159146844 [0,1,0,1,0,0|2,0,0]=4 5110 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-2312161748 [0,1,0,1,0,0|2,0,0]=4 5111 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-4996339542 [0,1,0,1,0,0|2,0,0]=4 5112 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-9830055203 [0,1,0,1,0,0|2,0,0]=4 5113 B9R1.2 CN1CCC[C@@H](C1)CO MCULE-7399583774 [0,1,0,1,0,0|1,0,0]=3 5114 B9R1.2 CN1CCC[C@@H](C1)CO MCULE-9308847454 [0,1,0,1,0,0|1,0,0]=3 5115 B9R1.2 CN1CCC[C@H](C1)CN MCULE-4714048215 [0,1,0,1,0,0|2,0,0]=4 5116 B9R1.2 CN1CCC[C@H](C1)CN MCULE-7433181082 [0,1,0,1,0,0|2,0,0]=4 5117 B9R1.2 CN1CCC[C@H](C1)CN MCULE-7796559163 [0,1,0,1,0,0|2,0,0]=4 5118 B9R1.2 CN1CCC[C@H](C1)CN MCULE-8440296789 [0,1,0,1,0,0|2,0,0]=4 5119 B9R1.2 CN1CCC[C@H](C1)CO MCULE-1288636914 [0,1,0,1,0,0|1,0,0]=3 5120 B9R1.2 CN1CCC[C@H](C1)CO MCULE-7586480861 [0,1,0,1,0,0|1,0,0]=3 5121 B9R1.2 CN1CCNC(C1)CO MCULE-8532368493 [0,1,0,1,0,0|2,0,0]=4 5122 B9R1.2 CN1CCNC(C1)CO MCULE-9785700847 [0,1,0,1,0,0|2,0,0]=4 5123 B9R1.2 CN1CCN[C@H](C1)CO MCULE-1037396112 [0,1,0,1,0,0|2,0,0]=4 5124 B9R1.2 CN1CCN[C@H](C1)CO MCULE-4462296258 [0,1,0,1,0,0|2,0,0]=4 5125 B9R1.2 CN1CCOC(C1)CCl MCULE-2838116420 [0,1,0,1,0,0|2,0,0]=4 5126 B9R1.2 CN1CCOC(C1)CN MCULE-5075701170 [0,1,0,1,0,0|2,0,0]=4 5127 B9R1.2 CN1CCOC(C1)CN MCULE-9040589582 [0,1,0,1,0,0|2,0,0]=4 5128 B9R1.2 CN1CCOC(C1)CN MCULE-9062990993 [0,1,0,1,0,0|2,0,0]=4 5129 B9R1.2 CN1CCOC(C1)CO MCULE-2306737561 [0,1,0,1,0,0|1,0,0]=3 5130 B9R1.2 CN1CCOC(C1)CO MCULE-7568948293 [0,1,0,1,0,0|1,0,0]=3 5131 B9R1.2 CN1CCOC(C1)CS MCULE-3129090286 [0,1,0,1,0,0|1,1,0]=4 5132 B9R1.2 CN1CCO[C@@H](C1)CN MCULE-4004989139 [0,1,0,1,0,0|2,0,0]=4 5133 B9R1.2 CN1CCO[C@@H](C1)CN MCULE-5571700229 [0,1,0,1,0,0|2,0,0]=4 5134 B9R1.2 CN1CCO[C@@H](C1)CN MCULE-9575781523 [0,1,0,1,0,0|2,0,0]=4 5135 B9R1.2 CN1CCO[C@@H](C1)CO MCULE-1798451024 [0,1,0,1,0,0|1,0,0]=3 5136 B9R1.2 CN1CCO[C@@H](C1)CO MCULE-3962856755 [0,1,0,1,0,0|1,0,0]=3 5137 B9R1.2 CN1CCO[C@H](C1)CN MCULE-5912986487 [0,1,0,1,0,0|2,0,0]=4 5138 B9R1.2 CN1CCO[C@H](C1)CN MCULE-9455752015 [0,1,0,1,0,0|2,0,0]=4 5139 B9R1.2 CN1CCO[C@H](C1)CO MCULE-1402976006 [0,1,0,1,0,0|1,0,0]=3 5140 B9R1.2 CN1CCO[C@H](C1)CO MCULE-5169286559 [0,1,0,1,0,0|1,0,0]=3 5141 B9R1.2 CNC1CCCC(C1)O MCULE-3150330707 [0,1,0,1,0,0|2,0,0]=4 5142 B9R1.2 CN[C@@H]1CCC[C@@H](C1)O MCULE-1060958874 [0,1,0,1,0,0|2,0,0]=4 5143 B9R1.2 CN[C@@H]1CCC[C@@H](C1)O MCULE-9730712811 [0,1,0,1,0,0|2,0,0]=4 5144 B9R1.2 CN[C@@H]1CCC[C@H](C1)O MCULE-6828213328 [0,1,0,1,0,0|2,0,0]=4 5145 B9R1.2 CN[C@H]1CCC[C@@H](C1)O MCULE-2291380032 [0,1,0,1,0,0|2,0,0]=4 5146 B9R1.2 CN[C@H]1CCC[C@@H](C1)O MCULE-3803581681 [0,1,0,1,0,0|2,0,0]=4 5147 B9R1.2 CN[C@H]1CCC[C@H](C1)O MCULE-2111305075 [0,1,0,1,0,0|2,0,0]=4 5148 B9R1.2 CN[C@H]1CCC[C@H](C1)O MCULE-2407641582 [0,1,0,1,0,0|2,0,0]=4 5149 B9R1.2 COC1CCCC(C1)O MCULE-2685242786 [0,1,0,1,0,0|2,0,0]=4 5150 B9R1.2 CO[C@@H]1CCC[C@@H](C1)O MCULE-3702179990 [0,1,0,1,0,0|2,0,0]=4 5151 B9R1.2 CO[C@@H]1CCC[C@@H](C1)O MCULE-5015018919 [0,1,0,1,0,0|2,0,0]=4 5152 B9R1.2 CO[C@@H]1CCC[C@@H](C1)O MCULE-6057275148 [0,1,0,1,0,0|2,0,0]=4 5153 B9R1.2 CSC1CCCC(C1)O MCULE-7728689337 [0,1,0,1,0,0|2,0,0]=4 5154 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-4030187082 [0,1,0,1,0,0|0,0,0]=2 5155 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-8521542499 [0,1,0,1,0,0|0,0,0]=2 5156 B9R1.2 C[C@@H]1C[C@@H](CCN1)CO MCULE-8058559032 [0,1,0,1,0,0|1,0,0]=3 5157 B9R1.2 C[C@@H]1C[C@@H](CCN1)CO MCULE-9351987850 [0,1,0,1,0,0|1,0,0]=3 5158 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6331587635 [0,1,0,1,0,0|0,0,0]=2 5159 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6791243811 [0,1,0,1,0,0|0,0,0]=2 5160 B9R1.2 FC1CCCC(C1)CBr MCULE-9227693146 [0,1,0,1,0,0|2,0,0]=4 5161 B9R1.2 NC1CCCC(C1)CO MCULE-1724466395 [0,1,0,1,0,0|1,0,0]=3 5162 B9R1.2 NC1CCCC(C1)CO MCULE-8087216563 [0,1,0,1,0,0|1,0,0]=3 5163 B9R1.2 NC1CCOC(C1)CO MCULE-2895862257 [0,1,0,1,0,0|0,0,0]=2 5164 B9R1.2 NC1CCOC(C1)CO MCULE-9883092947 [0,1,0,1,0,0|0,0,0]=2 5165 B9R1.2 NCC1CCCC(C1)F MCULE-2632687383 [0,1,0,1,0,0|2,0,0]=4 5166 B9R1.2 NCC1CCCC(C1)F MCULE-7609751819 [0,1,0,1,0,0|2,0,0]=4 5167 B9R1.2 NCC1CCCC(C1)N MCULE-9853807311 [0,1,0,1,0,0|2,0,0]=4 5168 B9R1.2 NCC1CCCC(C1)O MCULE-3067555499 [0,1,0,1,0,0|2,0,0]=4 5169 B9R1.2 NC[C@@H]1CCC[C@H](C1)O MCULE-9062593795 [0,1,0,1,0,0|2,0,0]=4 5170 B9R1.2 N[C@@H]1CCC[C@@H](C1)CO MCULE-1617324917 [0,1,0,1,0,0|1,0,0]=3 5171 B9R1.2 N[C@@H]1CCC[C@@H](C1)CO MCULE-8272213010 [0,1,0,1,0,0|1,0,0]=3 5172 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-2296534416 [0,1,0,1,0,0|1,0,0]=3 5173 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-5952407491 [0,1,0,1,0,0|1,0,0]=3 5174 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-6614147143 [0,1,0,1,0,0|1,0,0]=3 5175 B9R1.2 N[C@H]1CCC[C@@H](C1)CO MCULE-2015163295 [0,1,0,1,0,0|1,0,0]=3 5176 B9R1.2 N[C@H]1CCC[C@@H](C1)CO MCULE-3293475931 [0,1,0,1,0,0|1,0,0]=3 5177 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-1868841620 [0,1,0,1,0,0|1,0,0]=3 5178 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-6949082967 [0,1,0,1,0,0|1,0,0]=3 5179 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-9275476449 [0,1,0,1,0,0|1,0,0]=3 5180 B9R1.2 O=C1CCCC(C1)CO MCULE-5732276352 [0,1,0,1,0,0|1,0,1]=4 5181 B9R1.2 O=C1CCCC(N1)CO MCULE-6546170250 [0,1,0,1,0,0|1,0,1]=4 5182 B9R1.2 O=C1CCC[C@@H](N1)CO MCULE-6845836782 [0,1,0,1,0,0|1,0,1]=4 5183 B9R1.2 O=C1CCC[C@H](C1)CO MCULE-7659844168 [0,1,0,1,0,0|1,0,1]=4 5184 B9R1.2 O=C1CCC[C@H](N1)CO MCULE-2745722091 [0,1,0,1,0,0|1,0,1]=4 5185 B9R1.2 O=C1CCC[C@H](N1)CO MCULE-3358051383 [0,1,0,1,0,0|1,0,1]=4 5186 B9R1.2 OC1CCCC(C1)CCl MCULE-3541903770 [0,1,0,1,0,0|2,0,0]=4 5187 B9R1.2 OCC1CNCC(C1)F MCULE-4143657441 [0,1,0,1,0,0|2,0,0]=4 5188 B9R1.2 OCC1CNCC(C1)F MCULE-8277902234 [0,1,0,1,0,0|2,0,0]=4 5189 B9R1.2 OC[C@@H]1C[C@@H](CCN1)O MCULE-6189374946 [0,1,0,1,0,0|1,0,0]=3 5190 B9R1.2 OC[C@@H]1C[C@@H](CCN1)O MCULE-7813341428 [0,1,0,1,0,0|1,0,0]=3 5191 B9R1.2 OC[C@H]1C[C@H](CCN1)O MCULE-6277104745 [0,1,0,1,0,0|1,0,0]=3 5192 B9R1.2 OC[C@H]1C[C@H](CCN1)O MCULE-9933354273 [0,1,0,1,0,0|1,0,0]=3 5193 B9R1.2 [C@H]1(CNC[C@@H](O1)CO)C MCULE-4259776230 [0,1,0,1,0,0|0,0,0]=2 5194 B9R1.7 CC1CCC(O1)CCN MCULE-6897276194 [0,1,0,1,0,0|1,0,0]=3 5195 B9R1.7 CC1CCC(O1)CCO MCULE-3947673644 [0,1,0,1,0,0|0,0,0]=2 5196 B9R1.7 CC1CCN(C1)CCO MCULE-4684988145 [0,1,0,1,0,0|2,0,0]=4 5197 B9R1.7 CCCC1OCC(O1)C MCULE-3762914452 [0,1,0,1,0,0|1,0,0]=3 5198 B9R1.7 CCCN1CCC(C1)N MCULE-2610775729 [0,1,0,1,0,0|2,0,0]=4 5199 B9R1.7 CCCN1CCC(C1)N MCULE-8678024266 [0,1,0,1,0,0|2,0,0]=4 5200 B9R1.7 CCSC1CCC(C1)N MCULE-5990503886 [0,1,0,1,0,0|2,0,0]=4 5201 B9R1.7 CN1CCC(C1)CCO MCULE-3937266905 [0,1,0,1,0,0|2,0,0]=4 5202 B9R1.7 CN1CC[C@@H](C1)CCO MCULE-7719827183 [0,1,0,1,0,0|2,0,0]=4 5203 B9R1.7 COCC1CC(CN1)O MCULE-1719796553 [0,1,0,1,0,0|1,0,0]=3 5204 B9R1.7 COCC1CC(CN1)O MCULE-2828004706 [0,1,0,1,0,0|1,0,0]=3 5205 B9R1.7 COC[C@@H]1C[C@@H](CN1)O MCULE-4903855773 [0,1,0,1,0,0|1,0,0]=3 5206 B9R1.7 COC[C@@H]1C[C@@H](CN1)O MCULE-5035930973 [0,1,0,1,0,0|1,0,0]=3 5207 B9R1.7 COC[C@@H]1C[C@H](CN1)O MCULE-1656210028 [0,1,0,1,0,0|1,0,0]=3 5208 B9R1.7 COC[C@@H]1C[C@H](CN1)O MCULE-8717772588 [0,1,0,1,0,0|1,0,0]=3 5209 B9R1.7 COC[C@H]1C[C@H](CN1)O MCULE-7483280166 [0,1,0,1,0,0|1,0,0]=3 5210 B9R1.7 COC[C@H]1C[C@H](CN1)O MCULE-7672691308 [0,1,0,1,0,0|1,0,0]=3 5211 B9R1.7 NCCC1CCC(C1)F MCULE-5549912018 [0,1,0,1,0,0|2,0,0]=4 5212 B9R1.7 NCCC1CCC(C1)F MCULE-5938015417 [0,1,0,1,0,0|2,0,0]=4 5213 B9R1.7 NCCC1CC[C@H](C1)O MCULE-3758609813 [0,1,0,1,0,0|1,0,0]=3 5214 B9R1.7 NCCN1CCC(C1)O MCULE-6486204934 [0,1,0,1,0,0|2,0,0]=4 5215 B9R1.7 NCCN1CC[C@@H](C1)O MCULE-5099361761 [0,1,0,1,0,0|2,0,0]=4 5216 B9R1.7 NCCN1CC[C@@H](C1)O MCULE-6257789938 [0,1,0,1,0,0|2,0,0]=4 5217 B9R1.7 NCCN1CC[C@@H](C1)O MCULE-6897946390 [0,1,0,1,0,0|2,0,0]=4 5218 B9R1.7 NCCN1CC[C@H](C1)O MCULE-6447258046 [0,1,0,1,0,0|2,0,0]=4 5219 B9R1.7 NCCN1CC[C@H](C1)O MCULE-9790959431 [0,1,0,1,0,0|2,0,0]=4 5220 B9R1.7 NCC[C@H]1CC[C@H](C1)O MCULE-7245034683 [0,1,0,1,0,0|1,0,0]=3 5221 B9R1.7 OC1CCN(C1)CCCl MCULE-8071621134 [0,1,0,1,0,0|2,0,0]=4 5222 B9R1.7 OC1CCN(C1)CCCl MCULE-9634514145 [0,1,0,1,0,0|2,0,0]=4 5223 B9R1.7 OC1CCN(C1)CCF MCULE-6866067467 [0,1,0,1,0,0|2,0,0]=4 5224 B9R1.7 O[C@@H]1CCN(C1)CCCl MCULE-2781150117 [0,1,0,1,0,0|2,0,0]=4 5225 B9R1.7 O[C@@H]1CCN(C1)CCCl MCULE-4735020944 [0,1,0,1,0,0|2,0,0]=4 5226 B9R1.7 O[C@@H]1CCN(C1)CCCl MCULE-5270968388 [0,1,0,1,0,0|2,0,0]=4 5227 B9R1.7 O[C@@H]1CCN(C1)CCCl MCULE-7622278211 [0,1,0,1,0,0|2,0,0]=4 5228 B9R1.7 O[C@H]1CCN(C1)CCCl MCULE-4793568082 [0,1,0,1,0,0|2,0,0]=4 5229 B9R1.7 O[C@H]1CCN(C1)CCCl MCULE-9092574270 [0,1,0,1,0,0|2,0,0]=4 5230 B9R1.8 BrCCC1CCCCC1 MCULE-9299250705 [0,1,0,1,0,0|2,0,0]=4 5231 B9R1.8 BrCCC1CCCCN1 MCULE-1500097659 [0,1,0,1,0,0|2,0,0]=4 5232 B9R1.8 BrCCC1CCCCN1 MCULE-3711942593 [0,1,0,1,0,0|2,0,0]=4 5233 B9R1.8 BrCCC1CCCCN1 MCULE-7767580351 [0,1,0,1,0,0|2,0,0]=4 5234 B9R1.8 BrCCC1CCCCO1 MCULE-4230649212 [0,1,0,1,0,0|1,0,0]=3 5235 B9R1.8 BrCCC1COCCO1 MCULE-6995566395 [0,1,0,1,0,0|2,0,0]=4 5236 B9R1.8 BrCCC1OCCCO1 MCULE-1909621175 [0,1,0,1,0,0|2,0,0]=4 5237 B9R1.8 BrCCN1CCCCO1 MCULE-1223411183 [0,1,0,1,0,0|2,0,0]=4 5238 B9R1.8 C#CCC1CCCCC1 MCULE-5692828942 [0,1,0,1,0,0|2,0,0]=4 5239 B9R1.8 C=CCC1CCCCC1 MCULE-6299666608 [0,1,0,1,0,0|2,0,0]=4 5240 B9R1.8 C=CCC1CCCCN1 MCULE-3454887222 [0,1,0,1,0,0|2,0,0]=4 5241 B9R1.8 C=CCC1CCCCN1 MCULE-6075767950 [0,1,0,1,0,0|2,0,0]=4 5242 B9R1.8 C=CC[C@@H]1CCCCN1 MCULE-1018362044 [0,1,0,1,0,0|2,0,0]=4 5243 B9R1.8 C=CC[C@@H]1CCCCN1 MCULE-5995948153 [0,1,0,1,0,0|2,0,0]=4 5244 B9R1.8 C=CC[C@@H]1CCCCN1 MCULE-8655344575 [0,1,0,1,0,0|2,0,0]=4 5245 B9R1.8 C=CC[C@@H]1CCCCN1 MCULE-9197925786 [0,1,0,1,0,0|2,0,0]=4 5246 B9R1.8 C=CC[C@H]1CCCCN1 MCULE-2273116881 [0,1,0,1,0,0|2,0,0]=4 5247 B9R1.8 C=CC[C@H]1CCCCN1 MCULE-4469247831 [0,1,0,1,0,0|2,0,0]=4 5248 B9R1.8 C=CC[C@H]1CCCCN1 MCULE-6202204683 [0,1,0,1,0,0|2,0,0]=4 5249 B9R1.8 C=CC[C@H]1CCCCN1 MCULE-7361084128 [0,1,0,1,0,0|2,0,0]=4 5250 B9R1.8 C=COC1CCCCO1 MCULE-7577926210 [0,1,0,1,0,0|1,0,1]=4 5251 B9R1.8 CCCC1CCCCC1 MCULE-7477053795 [0,1,0,1,0,0|2,0,0]=4 5252 B9R1.8 CCCC1CCCCN1 MCULE-1476155918 [0,1,0,1,0,0|2,0,0]=4 5253 B9R1.8 CCCC1CCCCN1 MCULE-1672724119 [0,1,0,1,0,0|2,0,0]=4 5254 B9R1.8 CCCC1CCCCN1 MCULE-5635587568 [0,1,0,1,0,0|2,0,0]=4 5255 B9R1.8 CCCC1CCCCN1 MCULE-7901233025 [0,1,0,1,0,0|2,0,0]=4 5256 B9R1.8 CCCC1CCCCN1 MCULE-8248346628 [0,1,0,1,0,0|2,0,0]=4 5257 B9R1.8 CCCC1CNCCO1 MCULE-9447741986 [0,1,0,1,0,0|2,0,0]=4 5258 B9R1.8 CCCC1OCCCO1 MCULE-8359246042 [0,1,0,1,0,0|2,0,0]=4 5259 B9R1.8 CCC[C@@H]1CCCCN1 MCULE-6770891257 [0,1,0,1,0,0|2,0,0]=4 5260 B9R1.8 CCC[C@@H]1CCCCN1 MCULE-7954142000 [0,1,0,1,0,0|2,0,0]=4 5261 B9R1.8 CCC[C@H]1CCCCN1 MCULE-2517558052 [0,1,0,1,0,0|2,0,0]=4 5262 B9R1.8 CCC[C@H]1CCCCN1 MCULE-8255238091 [0,1,0,1,0,0|2,0,0]=4 5263 B9R1.8 CCC[C@H]1CCCCN1 MCULE-8429691236 [0,1,0,1,0,0|2,0,0]=4 5264 B9R1.8 CCC[C@H]1CCCCN1 MCULE-9434683135 [0,1,0,1,0,0|2,0,0]=4 5265 B9R1.8 CCNC1CCCCC1 MCULE-1079828121 [0,1,0,1,0,0|2,0,0]=4 5266 B9R1.8 CCNC1CCCCC1 MCULE-5943281030 [0,1,0,1,0,0|2,0,0]=4 5267 B9R1.8 CCOC1CNCCO1 MCULE-5598394113 [0,1,0,1,0,0|2,0,0]=4 5268 B9R1.8 CNCC1CCCCC1 MCULE-3140944607 [0,1,0,1,0,0|2,0,0]=4 5269 B9R1.8 CNCC1CCCCC1 MCULE-3915957758 [0,1,0,1,0,0|2,0,0]=4 5270 B9R1.8 CNCC1CCCCO1 MCULE-2559251364 [0,1,0,1,0,0|1,0,0]=3 5271 B9R1.8 CNCC1CCCCO1 MCULE-2931965460 [0,1,0,1,0,0|1,0,0]=3 5272 B9R1.8 CNCC1CNCCO1 MCULE-2314810849 [0,1,0,1,0,0|2,0,0]=4 5273 B9R1.8 CNCC1CNCCO1 MCULE-6083185869 [0,1,0,1,0,0|2,0,0]=4 5274 B9R1.8 CNCC1COCCO1 MCULE-3663472494 [0,1,0,1,0,0|2,0,0]=4 5275 B9R1.8 CNCC1COCCO1 MCULE-4042719770 [0,1,0,1,0,0|2,0,0]=4 5276 B9R1.8 CNCC1COCCO1 MCULE-4373994709 [0,1,0,1,0,0|2,0,0]=4 5277 B9R1.8 CNC[C@@H]1CCCCN1 MCULE-4321064733 [0,1,0,1,0,0|2,0,0]=4 5278 B9R1.8 CNC[C@@H]1CCCCN1 MCULE-9313891572 [0,1,0,1,0,0|2,0,0]=4 5279 B9R1.8 CNC[C@@H]1COCCO1 MCULE-1631348179 [0,1,0,1,0,0|2,0,0]=4 5280 B9R1.8 CNC[C@@H]1COCCO1 MCULE-2978269905 [0,1,0,1,0,0|2,0,0]=4 5281 B9R1.8 CNC[C@@H]1COCCO1 MCULE-3723240434 [0,1,0,1,0,0|2,0,0]=4 5282 B9R1.8 CNC[C@@H]1COCCO1 MCULE-5028881677 [0,1,0,1,0,0|2,0,0]=4 5283 B9R1.8 CNC[C@H]1CCCCN1 MCULE-1546664766 [0,1,0,1,0,0|2,0,0]=4 5284 B9R1.8 CNC[C@H]1CCCCN1 MCULE-7467254233 [0,1,0,1,0,0|2,0,0]=4 5285 B9R1.8 CNC[C@H]1COCCO1 MCULE-2451760661 [0,1,0,1,0,0|2,0,0]=4 5286 B9R1.8 CNC[C@H]1COCCO1 MCULE-5593195285 [0,1,0,1,0,0|2,0,0]=4 5287 B9R1.8 CNC[C@H]1COCCO1 MCULE-6619773603 [0,1,0,1,0,0|2,0,0]=4 5288 B9R1.8 CNC[C@H]1COCCO1 MCULE-7870966324 [0,1,0,1,0,0|2,0,0]=4 5289 B9R1.8 COCC1CCCCN1 MCULE-1947273818 [0,1,0,1,0,0|1,0,0]=3 5290 B9R1.8 COCC1CCCCN1 MCULE-5179816472 [0,1,0,1,0,0|1,0,0]=3 5291 B9R1.8 COCC1CCCNC1 MCULE-4680480363 [0,1,0,1,0,0|2,0,0]=4 5292 B9R1.8 COCC1CCCNC1 MCULE-6787404650 [0,1,0,1,0,0|2,0,0]=4 5293 B9R1.8 COCC1CCNCC1 MCULE-3522933970 [0,1,0,1,0,0|2,0,0]=4 5294 B9R1.8 COCC1CCNCC1 MCULE-3961514053 [0,1,0,1,0,0|2,0,0]=4 5295 B9R1.8 COCC1CNCCN1 MCULE-4868097066 [0,1,0,1,0,0|2,0,0]=4 5296 B9R1.8 COCC1CNCCO1 MCULE-4284650075 [0,1,0,1,0,0|1,0,0]=3 5297 B9R1.8 COCC1CNCCO1 MCULE-4306480276 [0,1,0,1,0,0|1,0,0]=3 5298 B9R1.8 COCC1CNCCO1 MCULE-9238704936 [0,1,0,1,0,0|1,0,0]=3 5299 B9R1.8 COCC1CNCCO1 MCULE-9910887537 [0,1,0,1,0,0|1,0,0]=3 5300 B9R1.8 COCC1COCCN1 MCULE-1953610282 [0,1,0,1,0,0|2,0,0]=4 5301 B9R1.8 COCC1COCCN1 MCULE-7802034385 [0,1,0,1,0,0|2,0,0]=4 5302 B9R1.8 COCC1COCCN1 MCULE-8079699729 [0,1,0,1,0,0|2,0,0]=4 5303 B9R1.8 COCC1COCCN1 MCULE-8417361180 [0,1,0,1,0,0|2,0,0]=4 5304 B9R1.8 COC[C@@H]1CCCCN1 MCULE-2798950485 [0,1,0,1,0,0|1,0,0]=3 5305 B9R1.8 COC[C@@H]1CCCCN1 MCULE-8642793821 [0,1,0,1,0,0|1,0,0]=3 5306 B9R1.8 COC[C@@H]1CNCCN1 MCULE-4289401787 [0,1,0,1,0,0|2,0,0]=4 5307 B9R1.8 COC[C@@H]1CNCCN1 MCULE-4949987443 [0,1,0,1,0,0|2,0,0]=4 5308 B9R1.8 COC[C@@H]1CNCCO1 MCULE-1759320762 [0,1,0,1,0,0|1,0,0]=3 5309 B9R1.8 COC[C@@H]1CNCCO1 MCULE-3365011086 [0,1,0,1,0,0|1,0,0]=3 5310 B9R1.8 COC[C@@H]1CNCCO1 MCULE-6900505382 [0,1,0,1,0,0|1,0,0]=3 5311 B9R1.8 COC[C@@H]1CNCCO1 MCULE-8734322374 [0,1,0,1,0,0|1,0,0]=3 5312 B9R1.8 COC[C@@H]1COCCN1 MCULE-4694978701 [0,1,0,1,0,0|2,0,0]=4 5313 B9R1.8 COC[C@@H]1COCCN1 MCULE-6245412625 [0,1,0,1,0,0|2,0,0]=4 5314 B9R1.8 COC[C@@H]1COCCN1 MCULE-6710142160 [0,1,0,1,0,0|2,0,0]=4 5315 B9R1.8 COC[C@@H]1COCCN1 MCULE-9175746259 [0,1,0,1,0,0|2,0,0]=4 5316 B9R1.8 COC[C@H]1CCCCN1 MCULE-3580108507 [0,1,0,1,0,0|1,0,0]=3 5317 B9R1.8 COC[C@H]1CCCCN1 MCULE-4232708572 [0,1,0,1,0,0|1,0,0]=3 5318 B9R1.8 COC[C@H]1CCCNC1 MCULE-3011341019 [0,1,0,1,0,0|2,0,0]=4 5319 B9R1.8 COC[C@H]1CCCNC1 MCULE-4883513899 [0,1,0,1,0,0|2,0,0]=4 5320 B9R1.8 COC[C@H]1CCCNC1 MCULE-7083332172 [0,1,0,1,0,0|2,0,0]=4 5321 B9R1.8 COC[C@H]1CNCCO1 MCULE-1644022700 [0,1,0,1,0,0|1,0,0]=3 5322 B9R1.8 COC[C@H]1CNCCO1 MCULE-4433196291 [0,1,0,1,0,0|1,0,0]=3 5323 B9R1.8 COC[C@H]1CNCCO1 MCULE-5949615002 [0,1,0,1,0,0|1,0,0]=3 5324 B9R1.8 COC[C@H]1CNCCO1 MCULE-6997620929 [0,1,0,1,0,0|1,0,0]=3 5325 B9R1.8 COC[C@H]1COCCN1 MCULE-3750975840 [0,1,0,1,0,0|2,0,0]=4 5326 B9R1.8 COC[C@H]1COCCN1 MCULE-6746486493 [0,1,0,1,0,0|2,0,0]=4 5327 B9R1.8 COC[C@H]1COCCN1 MCULE-7553721851 [0,1,0,1,0,0|2,0,0]=4 5328 B9R1.8 COC[C@H]1COCCN1 MCULE-8062682753 [0,1,0,1,0,0|2,0,0]=4 5329 B9R1.8 CSCC1CCCCN1 MCULE-2012373064 [0,1,0,1,0,0|1,1,0]=4 5330 B9R1.8 CSCC1CCCCN1 MCULE-9083698079 [0,1,0,1,0,0|1,1,0]=4 5331 B9R1.8 ClCCC1CCCCC1 MCULE-9726073749 [0,1,0,1,0,0|2,0,0]=4 5332 B9R1.8 ClCCC1CCCCN1 MCULE-3550163742 [0,1,0,1,0,0|2,0,0]=4 5333 B9R1.8 ClCCC1CCCCN1 MCULE-4587156712 [0,1,0,1,0,0|2,0,0]=4 5334 B9R1.8 ClCOC1CCCCC1 MCULE-2178125784 [0,1,0,1,0,0|2,0,0]=4 5335 B9R1.8 FCCC1CNCCO1 MCULE-5391892512 [0,1,0,1,0,0|2,0,0]=4 5336 B9R1.8 ICCC1CCCCC1 MCULE-8795138408 [0,1,0,1,0,0|2,0,0]=4 5337 B9R1.8 N#CCC1CCCCC1 MCULE-1749955817 [0,1,0,1,0,0|2,0,0]=4 5338 B9R1.8 N#CCC1CCCCN1 MCULE-2197761743 [0,1,0,1,0,0|2,0,0]=4 5339 B9R1.8 N#CCC1CCCCO1 MCULE-6904630467 [0,1,0,1,0,0|1,0,0]=3 5340 B9R1.8 N#CCC1COCCO1 MCULE-6777176577 [0,1,0,1,0,0|2,0,0]=4 5341 B9R1.8 NCCC1CCCCC1 MCULE-3912289573 [0,1,0,1,0,0|2,0,0]=4 5342 B9R1.8 NCCC1CCCCC1 MCULE-8270155473 [0,1,0,1,0,0|2,0,0]=4 5343 B9R1.8 NCCC1CCCCN1 MCULE-3796829641 [0,1,0,1,0,0|2,0,0]=4 5344 B9R1.8 NCCC1CCCCN1 MCULE-8953940837 [0,1,0,1,0,0|2,0,0]=4 5345 B9R1.8 NCCC1CCCCO1 MCULE-3942491369 [0,1,0,1,0,0|1,0,0]=3 5346 B9R1.8 NCCC1CCCCO1 MCULE-8718659242 [0,1,0,1,0,0|1,0,0]=3 5347 B9R1.8 NCCC1CNCCO1 MCULE-5314215349 [0,1,0,1,0,0|2,0,0]=4 5348 B9R1.8 NCCC1COCCO1 MCULE-7148437042 [0,1,0,1,0,0|2,0,0]=4 5349 B9R1.8 NCCC1OCCCO1 MCULE-2186855737 [0,1,0,1,0,0|2,0,0]=4 5350 B9R1.8 NCCN1CCCCO1 MCULE-3193772471 [0,1,0,1,0,0|2,0,0]=4 5351 B9R1.8 NCCN1CCCCO1 MCULE-6744979905 [0,1,0,1,0,0|2,0,0]=4 5352 B9R1.8 NNCC1CCCCC1 MCULE-5000115152 [0,1,0,1,0,0|2,0,0]=4 5353 B9R1.8 NNCC1CCCCC1 MCULE-5929866009 [0,1,0,1,0,0|2,0,0]=4 5354 B9R1.8 NNCC1CCCCC1 MCULE-6807430135 [0,1,0,1,0,0|2,0,0]=4 5355 B9R1.8 NNCC1CCCCO1 MCULE-1287371850 [0,1,0,1,0,0|1,0,0]=3 5356 B9R1.8 NNCC1CCCCO1 MCULE-2768429905 [0,1,0,1,0,0|1,0,0]=3 5357 B9R1.8 NNCC1CCCCO1 MCULE-6733005378 [0,1,0,1,0,0|1,0,0]=3 5358 B9R1.8 NNCC1COCCO1 MCULE-6800146177 [0,1,0,1,0,0|2,0,0]=4 5359 B9R1.8 NNCC1COCCO1 MCULE-8044644563 [0,1,0,1,0,0|2,0,0]=4 5360 B9R1.8 NOCC1CCCCC1 MCULE-4119292714 [0,1,0,1,0,0|1,0,0]=3 5361 B9R1.8 NOCC1CCCCC1 MCULE-4685909729 [0,1,0,1,0,0|1,0,0]=3 5362 B9R1.8 NOCC1CCOCC1 MCULE-4340343308 [0,1,0,1,0,0|2,0,0]=4 5363 B9R1.8 NOCC1CCOCC1 MCULE-6343396872 [0,1,0,1,0,0|2,0,0]=4 5364 B9R1.8 O=C=NC1CCCCO1 MCULE-4345839369 [0,1,0,1,0,0|0,0,2]=4 5365 B9R1.8 O=CCC1CCCCC1 MCULE-1210709345 [0,1,0,1,0,0|1,0,1]=4 5366 B9R1.8 O=CCC1CCCCO1 MCULE-5585343100 [0,1,0,1,0,0|0,0,1]=3 5367 B9R1.8 O=CCC1CNCCO1 MCULE-6857081335 [0,1,0,1,0,0|1,0,1]=4 5368 B9R1.8 O=CCC1CNCCO1 MCULE-8149272613 [0,1,0,1,0,0|1,0,1]=4 5369 B9R1.8 OCC=C1CCCCC1 MCULE-1575946847 [0,1,0,1,0,0|1,0,1]=4 5370 B9R1.8 OCCC1=CCCCC1 MCULE-5341389843 [0,1,0,1,0,0|1,0,1]=4 5371 B9R1.8 OCCC1C=CCCC1 MCULE-4423636846 [0,1,0,1,0,0|1,0,1]=4 5372 B9R1.8 OCCC1CCCCC1 MCULE-1419875265 [0,1,0,1,0,0|1,0,0]=3 5373 B9R1.8 OCCC1CCCCN1 MCULE-5358571234 [0,1,0,1,0,0|1,0,0]=3 5374 B9R1.8 OCCC1CCCCN1 MCULE-6316167724 [0,1,0,1,0,0|1,0,0]=3 5375 B9R1.8 OCCC1CCCCN1 MCULE-6383343166 [0,1,0,1,0,0|1,0,0]=3 5376 B9R1.8 OCCC1CCCCN1 MCULE-8192447369 [0,1,0,1,0,0|1,0,0]=3 5377 B9R1.8 OCCC1CCCCO1 MCULE-8834615080 [0,1,0,1,0,0|0,0,0]=2 5378 B9R1.8 OCCC1CCCNC1 MCULE-1585744813 [0,1,0,1,0,0|2,0,0]=4 5379 B9R1.8 OCCC1CCCNC1 MCULE-2334553785 [0,1,0,1,0,0|2,0,0]=4 5380 B9R1.8 OCCC1CCCOC1 MCULE-3721207963 [0,1,0,1,0,0|2,0,0]=4 5381 B9R1.8 OCCC1CCNCC1 MCULE-4733455288 [0,1,0,1,0,0|2,0,0]=4 5382 B9R1.8 OCCC1CCNCC1 MCULE-8781109111 [0,1,0,1,0,0|2,0,0]=4 5383 B9R1.8 OCCC1CCOCC1 MCULE-2699930826 [0,1,0,1,0,0|2,0,0]=4 5384 B9R1.8 OCCC1CNCCN1 MCULE-1485603248 [0,1,0,1,0,0|2,0,0]=4 5385 B9R1.8 OCCC1CNCCN1 MCULE-4527044795 [0,1,0,1,0,0|2,0,0]=4 5386 B9R1.8 OCCC1CNCCN1 MCULE-5830758261 [0,1,0,1,0,0|2,0,0]=4 5387 B9R1.8 OCCC1CNCCN1 MCULE-6879027812 [0,1,0,1,0,0|2,0,0]=4 5388 B9R1.8 OCCC1CNCCO1 MCULE-5426840446 [0,1,0,1,0,0|1,0,0]=3 5389 B9R1.8 OCCC1CNCCO1 MCULE-7364226481 [0,1,0,1,0,0|1,0,0]=3 5390 B9R1.8 OCCC1COCCN1 MCULE-7671693934 [0,1,0,1,0,0|2,0,0]=4 5391 B9R1.8 OCCC1COCCN1 MCULE-7975926802 [0,1,0,1,0,0|2,0,0]=4 5392 B9R1.8 OCCC1COCCO1 MCULE-8026004111 [0,1,0,1,0,0|1,0,0]=3 5393 B9R1.8 OCCC1CSCCN1 MCULE-2529715107 [0,1,0,1,0,0|2,0,0]=4 5394 B9R1.8 OCCC1SCCCS1 MCULE-5450372948 [0,1,0,1,0,0|1,1,0]=4 5395 B9R1.8 OCCN1CCCCC1 MCULE-5210318838 [0,1,0,1,0,0|2,0,0]=4 5396 B9R1.8 OCCN1CCCCC1 MCULE-6060210408 [0,1,0,1,0,0|2,0,0]=4 5397 B9R1.8 OCCN1CCCCO1 MCULE-3704734263 [0,1,0,1,0,0|1,0,0]=3 5398 B9R1.8 OCC[C@@H]1CCCCN1 MCULE-1411975903 [0,1,0,1,0,0|1,0,0]=3 5399 B9R1.8 OCC[C@@H]1CCCCN1 MCULE-1687945599 [0,1,0,1,0,0|1,0,0]=3 5400 B9R1.8 OCC[C@@H]1CCCCN1 MCULE-4768860231 [0,1,0,1,0,0|1,0,0]=3 5401 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-1010322548 [0,1,0,1,0,0|2,0,0]=4 5402 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-1682721450 [0,1,0,1,0,0|2,0,0]=4 5403 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-2510457733 [0,1,0,1,0,0|2,0,0]=4 5404 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-7412945816 [0,1,0,1,0,0|2,0,0]=4 5405 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-7736283995 [0,1,0,1,0,0|2,0,0]=4 5406 B9R1.8 OCC[C@@H]1COCCN1 MCULE-2492409848 [0,1,0,1,0,0|2,0,0]=4 5407 B9R1.8 OCC[C@@H]1COCCN1 MCULE-7538532704 [0,1,0,1,0,0|2,0,0]=4 5408 B9R1.8 OCC[C@@H]1COCCN1 MCULE-8411336469 [0,1,0,1,0,0|2,0,0]=4 5409 B9R1.8 OCC[C@H]1CCCCN1 MCULE-1159412973 [0,1,0,1,0,0|1,0,0]=3 5410 B9R1.8 OCC[C@H]1CCCCN1 MCULE-7155911761 [0,1,0,1,0,0|1,0,0]=3 5411 B9R1.8 OCC[C@H]1CCCCN1 MCULE-8194139814 [0,1,0,1,0,0|1,0,0]=3 5412 B9R1.8 OCC[C@H]1CCCCN1 MCULE-9431208414 [0,1,0,1,0,0|1,0,0]=3 5413 B9R1.8 OCC[C@H]1CCCNC1 MCULE-7415878358 [0,1,0,1,0,0|2,0,0]=4 5414 B9R1.8 OCC[C@H]1CNCCN1 MCULE-1153840758 [0,1,0,1,0,0|2,0,0]=4 5415 B9R1.8 OCC[C@H]1CNCCN1 MCULE-2356486057 [0,1,0,1,0,0|2,0,0]=4 5416 B9R1.8 OCC[C@H]1CNCCN1 MCULE-5425698593 [0,1,0,1,0,0|2,0,0]=4 5417 B9R1.8 OCC[C@H]1CNCCN1 MCULE-7344138049 [0,1,0,1,0,0|2,0,0]=4 5418 B9R1.8 OCC[C@H]1COCCN1 MCULE-4269275620 [0,1,0,1,0,0|2,0,0]=4 5419 B9R1.8 SCCC1CCCCC1 MCULE-4338002677 [0,1,0,1,0,0|1,1,0]=4 5420 B9R1.8 [C@H]1(CCCCN1)CCO MCULE-4666239626 [0,1,0,1,0,0|1,0,0]=3 5421 B9R1.12 BrCCCC1CCOC1 MCULE-8066690419 [0,1,0,1,0,0|2,0,0]=4 5422 B9R1.12 BrCCCC1OCCO1 MCULE-1201884899 [0,1,0,1,0,0|2,0,0]=4 5423 B9R1.12 CCCCC1=NCCO1 MCULE-6606126914 [0,1,0,1,0,0|1,0,1]=4 5424 B9R1.12 CCCCC1C=CCN1 MCULE-4174975086 [0,1,0,1,0,0|2,0,0]=4 5425 B9R1.12 CCCCC1C=CCN1 MCULE-9078280480 [0,1,0,1,0,0|2,0,0]=4 5426 B9R1.12 CCCCC1CCCN1 MCULE-1125287156 [0,1,0,1,0,0|2,0,0]=4 5427 B9R1.12 CCCCC1CCCN1 MCULE-9488507483 [0,1,0,1,0,0|2,0,0]=4 5428 B9R1.12 CCCCC1CCCO1 MCULE-6226220964 [0,1,0,1,0,0|1,0,0]=3 5429 B9R1.12 CCCCC1CCNC1 MCULE-3000104007 [0,1,0,1,0,0|2,0,0]=4 5430 B9R1.12 CCCCC1CCNC1 MCULE-5937287599 [0,1,0,1,0,0|2,0,0]=4 5431 B9R1.12 CCCCC1OCCO1 MCULE-6084525207 [0,1,0,1,0,0|1,0,0]=3 5432 B9R1.12 CCNCC1CCCO1 MCULE-6762362230 [0,1,0,1,0,0|2,0,0]=4 5433 B9R1.12 CCNCC1CCCO1 MCULE-6799465904 [0,1,0,1,0,0|2,0,0]=4 5434 B9R1.12 CCNCC1CCOC1 MCULE-5570173374 [0,1,0,1,0,0|2,0,0]=4 5435 B9R1.12 CCNCC1CCOC1 MCULE-6755096868 [0,1,0,1,0,0|2,0,0]=4 5436 B9R1.12 CCOCC1CCCO1 MCULE-8991933635 [0,1,0,1,0,0|2,0,0]=4 5437 B9R1.12 CNCCC1CCCO1 MCULE-7311615257 [0,1,0,1,0,0|2,0,0]=4 5438 B9R1.12 CNCCC1CCCO1 MCULE-8833199856 [0,1,0,1,0,0|2,0,0]=4 5439 B9R1.12 CNCCC1CCOC1 MCULE-4276743145 [0,1,0,1,0,0|2,0,0]=4 5440 B9R1.12 CNCCC1CCOC1 MCULE-5831967563 [0,1,0,1,0,0|2,0,0]=4 5441 B9R1.12 CNCCC1OCCO1 MCULE-6125926841 [0,1,0,1,0,0|2,0,0]=4 5442 B9R1.12 ClCCCC1OCCO1 MCULE-5692195295 [0,1,0,1,0,0|2,0,0]=4 5443 B9R1.12 NCCCC1CCOC1 MCULE-2790704688 [0,1,0,1,0,0|2,0,0]=4 5444 B9R1.12 NCCCC1CCOC1 MCULE-4180248181 [0,1,0,1,0,0|2,0,0]=4 5445 B9R1.12 OCCCC1CCCO1 MCULE-9721808816 [0,1,0,1,0,0|2,0,0]=4 5446 B9R1.12 OCCCC1OCCO1 MCULE-3402600084 [0,1,0,1,0,0|2,0,0]=4 5447 B9R1.15 C#CC1CCCCC1C MCULE-6198776424 [0,1,0,1,0,0|2,0,0]=4 5448 B9R1.15 C#CC1CCCCC1O MCULE-6683374669 [0,1,0,1,0,0|1,0,0]=3 5449 B9R1.15 C=CC1CCCCC1O MCULE-8134168493 [0,1,0,1,0,0|1,0,0]=3 5450 B9R1.15 CC1=C(CCCC1)CO MCULE-8750813787 [0,1,0,1,0,0|1,0,1]=4 5451 B9R1.15 CC1CCCCC1=NO MCULE-1706609645 [0,1,0,1,0,0|1,0,1]=4 5452 B9R1.15 CC1CCCCC1C=O MCULE-5772126890 [0,1,0,1,0,0|1,0,1]=4 5453 B9R1.15 CC1CCCCC1CBr MCULE-8034060072 [0,1,0,1,0,0|2,0,0]=4 5454 B9R1.15 CC1CCCCC1CN MCULE-2749107040 [0,1,0,1,0,0|2,0,0]=4 5455 B9R1.15 CC1CCCCC1NN MCULE-1627711305 [0,1,0,1,0,0|2,0,0]=4 5456 B9R1.15 CC1CCCCC1NN MCULE-6482426688 [0,1,0,1,0,0|2,0,0]=4 5457 B9R1.15 CC1CCCCC1NN MCULE-6532690515 [0,1,0,1,0,0|2,0,0]=4 5458 B9R1.15 CC1CCCNC1CN MCULE-6481829543 [0,1,0,1,0,0|2,0,0]=4 5459 B9R1.15 CC1CCCNC1CO MCULE-4408087733 [0,1,0,1,0,0|1,0,0]=3 5460 B9R1.15 CC1CCNCC1CO MCULE-7653018616 [0,1,0,1,0,0|2,0,0]=4 5461 B9R1.15 CC1NCCCC1CO MCULE-2033869519 [0,1,0,1,0,0|2,0,0]=4 5462 B9R1.15 CC1OCCNC1CO MCULE-1741355006 [0,1,0,1,0,0|2,0,0]=4 5463 B9R1.15 CC1OCCNC1CO MCULE-9766545086 [0,1,0,1,0,0|2,0,0]=4 5464 B9R1.15 CCC1CCCCC1=O MCULE-2493543558 [0,1,0,1,0,0|1,0,1]=4 5465 B9R1.15 CCC1CCCCC1Br MCULE-1178311442 [0,1,0,1,0,0|2,0,0]=4 5466 B9R1.15 CCC1CCCCC1C MCULE-1792942786 [0,1,0,1,0,0|2,0,0]=4 5467 B9R1.15 CCC1CCCCC1N MCULE-3637799906 [0,1,0,1,0,0|2,0,0]=4 5468 B9R1.15 CCC1CCCCC1O MCULE-7514335194 [0,1,0,1,0,0|1,0,0]=3 5469 B9R1.15 CCC1COCCC1O MCULE-9521346817 [0,1,0,1,0,0|2,0,0]=4 5470 B9R1.15 CC\1CCCC/C1=N/O MCULE-2965052832 [0,1,0,1,0,0|1,0,1]=4 5471 B9R1.15 CN1CCCCC1CBr MCULE-3728031205 [0,1,0,1,0,0|2,0,0]=4 5472 B9R1.15 CN1CCCCC1CBr MCULE-6733933371 [0,1,0,1,0,0|2,0,0]=4 5473 B9R1.15 CN1CCCCC1CCl MCULE-1207908283 [0,1,0,1,0,0|2,0,0]=4 5474 B9R1.15 CN1CCCCC1CCl MCULE-8530079563 [0,1,0,1,0,0|2,0,0]=4 5475 B9R1.15 CN1CCCCC1CN MCULE-7056988540 [0,1,0,1,0,0|2,0,0]=4 5476 B9R1.15 CN1CCCCC1CN MCULE-7969324848 [0,1,0,1,0,0|2,0,0]=4 5477 B9R1.15 CN1CCCCC1CN MCULE-9107319494 [0,1,0,1,0,0|2,0,0]=4 5478 B9R1.15 CN1CCCCC1CO MCULE-6705032794 [0,1,0,1,0,0|1,0,0]=3 5479 B9R1.15 CN1CCCCC1CO MCULE-7433359891 [0,1,0,1,0,0|1,0,0]=3 5480 B9R1.15 CN1CCCC[C@@H]1CO MCULE-4169808027 [0,1,0,1,0,0|1,0,0]=3 5481 B9R1.15 CN1CCCC[C@@H]1CO MCULE-5806828736 [0,1,0,1,0,0|1,0,0]=3 5482 B9R1.15 CN1CCCC[C@H]1CO MCULE-5720351306 [0,1,0,1,0,0|1,0,0]=3 5483 B9R1.15 CN1CCCC[C@H]1CO MCULE-6512254506 [0,1,0,1,0,0|1,0,0]=3 5484 B9R1.15 CN1CCNCC1CO MCULE-7112745401 [0,1,0,1,0,0|2,0,0]=4 5485 B9R1.15 CN1CCNCC1CO MCULE-8816850395 [0,1,0,1,0,0|2,0,0]=4 5486 B9R1.15 CN1CCOCC1CO MCULE-2139047530 [0,1,0,1,0,0|2,0,0]=4 5487 B9R1.15 CN1CCOCC1CO MCULE-4226067396 [0,1,0,1,0,0|2,0,0]=4 5488 B9R1.15 CN1CCOCC1CO MCULE-9641882387 [0,1,0,1,0,0|2,0,0]=4 5489 B9R1.15 CN1CCOC[C@@H]1CO MCULE-6676365616 [0,1,0,1,0,0|2,0,0]=4 5490 B9R1.15 CN1CCOC[C@@H]1CO MCULE-7199870435 [0,1,0,1,0,0|2,0,0]=4 5491 B9R1.15 CN1CCOC[C@H]1CO MCULE-1567784253 [0,1,0,1,0,0|2,0,0]=4 5492 B9R1.15 CN1CCOC[C@H]1CO MCULE-4386696956 [0,1,0,1,0,0|2,0,0]=4 5493 B9R1.15 CN1CCOC[C@H]1CO MCULE-4994265717 [0,1,0,1,0,0|2,0,0]=4 5494 B9R1.15 CN1CCOC[C@H]1CO MCULE-9355808488 [0,1,0,1,0,0|2,0,0]=4 5495 B9R1.15 CNC1CCCCC1C MCULE-2012338656 [0,1,0,1,0,0|2,0,0]=4 5496 B9R1.15 CNC1CCCCC1C MCULE-4226953987 [0,1,0,1,0,0|2,0,0]=4 5497 B9R1.15 CNC1CCCCC1O MCULE-4436069957 [0,1,0,1,0,0|1,0,0]=3 5498 B9R1.15 CNC1CCCCC1O MCULE-5405173336 [0,1,0,1,0,0|1,0,0]=3 5499 B9R1.15 CN[C@@H]1CCCC[C@@H]1C MCULE-5411502617 [0,1,0,1,0,0|2,0,0]=4 5500 B9R1.15 CN[C@@H]1CCCC[C@@H]1O MCULE-1137921028 [0,1,0,1,0,0|1,0,0]=3 5501 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-3605342765 [0,1,0,1,0,0|1,0,0]=3 5502 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-5222257369 [0,1,0,1,0,0|1,0,0]=3 5503 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-5595138673 [0,1,0,1,0,0|1,0,0]=3 5504 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-8677073091 [0,1,0,1,0,0|1,0,0]=3 5505 B9R1.15 CN[C@H]1CCCC[C@@H]1O MCULE-1707284588 [0,1,0,1,0,0|1,0,0]=3 5506 B9R1.15 CN[C@H]1CCCC[C@@H]1O MCULE-2780832664 [0,1,0,1,0,0|1,0,0]=3 5507 B9R1.15 CN[C@H]1CCCC[C@@H]1O MCULE-5064297221 [0,1,0,1,0,0|1,0,0]=3 5508 B9R1.15 CN[C@H]1CCCC[C@H]1C MCULE-9095592965 [0,1,0,1,0,0|2,0,0]=4 5509 B9R1.15 CN[C@H]1CCCC[C@H]1O MCULE-1705616364 [0,1,0,1,0,0|1,0,0]=3 5510 B9R1.15 CN[C@H]1CCCC[C@H]1O MCULE-9104661315 [0,1,0,1,0,0|1,0,0]=3 5511 B9R1.15 COC1CCCCC1=O MCULE-7022503614 [0,1,0,1,0,0|0,0,2]=4 5512 B9R1.15 COC1CCCCC1N MCULE-1737804569 [0,1,0,1,0,0|1,0,0]=3 5513 B9R1.15 COC1CCCCC1N MCULE-2194963487 [0,1,0,1,0,0|1,0,0]=3 5514 B9R1.15 COC1CCCCC1O MCULE-9502513295 [0,1,0,1,0,0|0,0,0]=2 5515 B9R1.15 COC1CCNCC1C MCULE-6572363150 [0,1,0,1,0,0|2,0,0]=4 5516 B9R1.15 COC1CCNCC1C MCULE-9231668375 [0,1,0,1,0,0|2,0,0]=4 5517 B9R1.15 COC1CCNCC1F MCULE-7976464568 [0,1,0,1,0,0|2,0,0]=4 5518 B9R1.15 COC1CCNCC1F MCULE-8083874636 [0,1,0,1,0,0|2,0,0]=4 5519 B9R1.15 COC1CCNCC1O MCULE-4844568872 [0,1,0,1,0,0|1,0,0]=3 5520 B9R1.15 COC1CCNCC1O MCULE-5658669344 [0,1,0,1,0,0|1,0,0]=3 5521 B9R1.15 COC1CCOCC1N MCULE-2339019157 [0,1,0,1,0,0|2,0,0]=4 5522 B9R1.15 COC1CCOCC1N MCULE-3754642498 [0,1,0,1,0,0|2,0,0]=4 5523 B9R1.15 COC1CNCCC1C MCULE-7419288321 [0,1,0,1,0,0|2,0,0]=4 5524 B9R1.15 COC1CNCCC1C MCULE-8027196152 [0,1,0,1,0,0|2,0,0]=4 5525 B9R1.15 COC1COCCC1N MCULE-2610127479 [0,1,0,1,0,0|2,0,0]=4 5526 B9R1.15 COC1COCCC1N MCULE-5980111106 [0,1,0,1,0,0|2,0,0]=4 5527 B9R1.15 COC1COCCC1O MCULE-4002896267 [0,1,0,1,0,0|1,0,0]=3 5528 B9R1.15 CO[C@@H]1CCCC[C@@H]1N MCULE-1989542198 [0,1,0,1,0,0|1,0,0]=3 5529 B9R1.15 CO[C@@H]1CCCC[C@@H]1N MCULE-6852448083 [0,1,0,1,0,0|1,0,0]=3 5530 B9R1.15 CO[C@@H]1CCCC[C@H]1Br MCULE-6359637259 [0,1,0,1,0,0|1,0,0]=3 5531 B9R1.15 CO[C@@H]1CCCC[C@H]1I MCULE-4229510302 [0,1,0,1,0,0|1,0,0]=3 5532 B9R1.15 CO[C@@H]1CCCC[C@H]1N MCULE-2893854338 [0,1,0,1,0,0|1,0,0]=3 5533 B9R1.15 CO[C@@H]1CCCC[C@H]1N MCULE-9329529471 [0,1,0,1,0,0|1,0,0]=3 5534 B9R1.15 CO[C@@H]1CCNC[C@@H]1C MCULE-6937999613 [0,1,0,1,0,0|2,0,0]=4 5535 B9R1.15 CO[C@@H]1CCNC[C@@H]1F MCULE-2512070306 [0,1,0,1,0,0|2,0,0]=4 5536 B9R1.15 CO[C@@H]1CCNC[C@@H]1F MCULE-7797845494 [0,1,0,1,0,0|2,0,0]=4 5537 B9R1.15 CO[C@@H]1CCNC[C@@H]1F MCULE-9041649195 [0,1,0,1,0,0|2,0,0]=4 5538 B9R1.15 CO[C@@H]1CCNC[C@@H]1F MCULE-9209782990 [0,1,0,1,0,0|2,0,0]=4 5539 B9R1.15 CO[C@@H]1CCNC[C@@H]1O MCULE-1786216428 [0,1,0,1,0,0|1,0,0]=3 5540 B9R1.15 CO[C@@H]1CCNC[C@@H]1O MCULE-5747785572 [0,1,0,1,0,0|1,0,0]=3 5541 B9R1.15 CO[C@@H]1CCNC[C@@H]1O MCULE-8933003557 [0,1,0,1,0,0|1,0,0]=3 5542 B9R1.15 CO[C@@H]1CCNC[C@@H]1O MCULE-9963782997 [0,1,0,1,0,0|1,0,0]=3 5543 B9R1.15 CO[C@@H]1CCNC[C@H]1C MCULE-3269567126 [0,1,0,1,0,0|2,0,0]=4 5544 B9R1.15 CO[C@@H]1CCNC[C@H]1F MCULE-4833090578 [0,1,0,1,0,0|2,0,0]=4 5545 B9R1.15 CO[C@@H]1CCNC[C@H]1F MCULE-6648657868 [0,1,0,1,0,0|2,0,0]=4 5546 B9R1.15 CO[C@@H]1CCNC[C@H]1F MCULE-6852938749 [0,1,0,1,0,0|2,0,0]=4 5547 B9R1.15 CO[C@@H]1CCNC[C@H]1F MCULE-9714361421 [0,1,0,1,0,0|2,0,0]=4 5548 B9R1.15 CO[C@@H]1CCOC[C@@H]1N MCULE-1952254967 [0,1,0,1,0,0|2,0,0]=4 5549 B9R1.15 CO[C@@H]1CCOC[C@@H]1N MCULE-6506526189 [0,1,0,1,0,0|2,0,0]=4 5550 B9R1.15 CO[C@@H]1CCOC[C@H]1N MCULE-4110998380 [0,1,0,1,0,0|2,0,0]=4 5551 B9R1.15 CO[C@@H]1CCOC[C@H]1N MCULE-4975019043 [0,1,0,1,0,0|2,0,0]=4 5552 B9R1.15 CO[C@@H]1CCOC[C@H]1N MCULE-7897581898 [0,1,0,1,0,0|2,0,0]=4 5553 B9R1.15 CO[C@@H]1CCOC[C@H]1N MCULE-9438744527 [0,1,0,1,0,0|2,0,0]=4 5554 B9R1.15 CO[C@@H]1CNCC[C@@H]1C MCULE-7888271922 [0,1,0,1,0,0|2,0,0]=4 5555 B9R1.15 CO[C@@H]1CNCC[C@@H]1C MCULE-9709371025 [0,1,0,1,0,0|2,0,0]=4 5556 B9R1.15 CO[C@@H]1CNCC[C@H]1C MCULE-2338099561 [0,1,0,1,0,0|2,0,0]=4 5557 B9R1.15 CO[C@@H]1CNCC[C@H]1C MCULE-5997296248 [0,1,0,1,0,0|2,0,0]=4 5558 B9R1.15 CO[C@@H]1CNCC[C@H]1F MCULE-8978919146 [0,1,0,1,0,0|2,0,0]=4 5559 B9R1.15 CO[C@@H]1COCC[C@@H]1N MCULE-1690232834 [0,1,0,1,0,0|2,0,0]=4 5560 B9R1.15 CO[C@@H]1COCC[C@@H]1N MCULE-3005233421 [0,1,0,1,0,0|2,0,0]=4 5561 B9R1.15 CO[C@@H]1COCC[C@@H]1N MCULE-3350884306 [0,1,0,1,0,0|2,0,0]=4 5562 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-5292719252 [0,1,0,1,0,0|2,0,0]=4 5563 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-5893587941 [0,1,0,1,0,0|2,0,0]=4 5564 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-6732618277 [0,1,0,1,0,0|2,0,0]=4 5565 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-7200503666 [0,1,0,1,0,0|2,0,0]=4 5566 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-7347456098 [0,1,0,1,0,0|2,0,0]=4 5567 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-7764251079 [0,1,0,1,0,0|2,0,0]=4 5568 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-9959357254 [0,1,0,1,0,0|2,0,0]=4 5569 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-2586194317 [0,1,0,1,0,0|1,0,0]=3 5570 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-3721985129 [0,1,0,1,0,0|1,0,0]=3 5571 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-5933697798 [0,1,0,1,0,0|1,0,0]=3 5572 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-8173559541 [0,1,0,1,0,0|1,0,0]=3 5573 B9R1.15 CO[C@H]1CCCC[C@@H]1O MCULE-5178021878 [0,1,0,1,0,0|0,0,0]=2 5574 B9R1.15 CO[C@H]1CCCC[C@H]1N MCULE-1897256905 [0,1,0,1,0,0|1,0,0]=3 5575 B9R1.15 CO[C@H]1CCCC[C@H]1N MCULE-2520513048 [0,1,0,1,0,0|1,0,0]=3 5576 B9R1.15 CO[C@H]1CCNC[C@@H]1C MCULE-4739410328 [0,1,0,1,0,0|2,0,0]=4 5577 B9R1.15 CO[C@H]1CCNC[C@@H]1F MCULE-7424205754 [0,1,0,1,0,0|2,0,0]=4 5578 B9R1.15 CO[C@H]1CCNC[C@@H]1F MCULE-9633708288 [0,1,0,1,0,0|2,0,0]=4 5579 B9R1.15 CO[C@H]1CCNC[C@@H]1O MCULE-6153348705 [0,1,0,1,0,0|1,0,0]=3 5580 B9R1.15 CO[C@H]1CCNC[C@@H]1O MCULE-8285848321 [0,1,0,1,0,0|1,0,0]=3 5581 B9R1.15 CO[C@H]1CCNC[C@@H]1O MCULE-8316883665 [0,1,0,1,0,0|1,0,0]=3 5582 B9R1.15 CO[C@H]1CCNC[C@@H]1O MCULE-8980786259 [0,1,0,1,0,0|1,0,0]=3 5583 B9R1.15 CO[C@H]1CCNC[C@H]1C MCULE-7934229731 [0,1,0,1,0,0|2,0,0]=4 5584 B9R1.15 CO[C@H]1CCNC[C@H]1F MCULE-4853981735 [0,1,0,1,0,0|2,0,0]=4 5585 B9R1.15 CO[C@H]1CCNC[C@H]1F MCULE-5377982862 [0,1,0,1,0,0|2,0,0]=4 5586 B9R1.15 CO[C@H]1CCNC[C@H]1F MCULE-5447985826 [0,1,0,1,0,0|2,0,0]=4 5587 B9R1.15 CO[C@H]1CCNC[C@H]1F MCULE-5478075190 [0,1,0,1,0,0|2,0,0]=4 5588 B9R1.15 CO[C@H]1CCOC[C@@H]1N MCULE-2730884989 [0,1,0,1,0,0|2,0,0]=4 5589 B9R1.15 CO[C@H]1CCOC[C@@H]1N MCULE-4217006981 [0,1,0,1,0,0|2,0,0]=4 5590 B9R1.15 CO[C@H]1CCOC[C@H]1N MCULE-1293806136 [0,1,0,1,0,0|2,0,0]=4 5591 B9R1.15 CO[C@H]1CCOC[C@H]1N MCULE-5751918733 [0,1,0,1,0,0|2,0,0]=4 5592 B9R1.15 CO[C@H]1CCOC[C@H]1N MCULE-7877424101 [0,1,0,1,0,0|2,0,0]=4 5593 B9R1.15 CO[C@H]1CCOC[C@H]1N MCULE-9079567930 [0,1,0,1,0,0|2,0,0]=4 5594 B9R1.15 CO[C@H]1CNCC[C@@H]1C MCULE-2481587773 [0,1,0,1,0,0|2,0,0]=4 5595 B9R1.15 CO[C@H]1CNCC[C@@H]1C MCULE-8312413940 [0,1,0,1,0,0|2,0,0]=4 5596 B9R1.15 CO[C@H]1CNCC[C@@H]1F MCULE-2359199932 [0,1,0,1,0,0|2,0,0]=4 5597 B9R1.15 CO[C@H]1CNCC[C@H]1C MCULE-3369664933 [0,1,0,1,0,0|2,0,0]=4 5598 B9R1.15 CO[C@H]1CNCC[C@H]1C MCULE-6381125186 [0,1,0,1,0,0|2,0,0]=4 5599 B9R1.15 CO[C@H]1COCC[C@@H]1N MCULE-2924350485 [0,1,0,1,0,0|2,0,0]=4 5600 B9R1.15 CO[C@H]1COCC[C@@H]1N MCULE-6248531340 [0,1,0,1,0,0|2,0,0]=4 5601 B9R1.15 CO[C@H]1COCC[C@@H]1N MCULE-9169417719 [0,1,0,1,0,0|2,0,0]=4 5602 B9R1.15 CO[C@H]1COCC[C@@H]1N MCULE-9444528578 [0,1,0,1,0,0|2,0,0]=4 5603 B9R1.15 CO[C@H]1COCC[C@H]1N MCULE-5932043600 [0,1,0,1,0,0|2,0,0]=4 5604 B9R1.15 CO[C@H]1COCC[C@H]1N MCULE-6623157502 [0,1,0,1,0,0|2,0,0]=4 5605 B9R1.15 CO[C@H]1COCC[C@H]1N MCULE-7220613082 [0,1,0,1,0,0|2,0,0]=4 5606 B9R1.15 CO[C@H]1COCC[C@H]1N MCULE-8475817626 [0,1,0,1,0,0|2,0,0]=4 5607 B9R1.15 CSC1CCCCC1O MCULE-1801870498 [0,1,0,1,0,0|0,1,0]=3 5608 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-2713680724 [0,1,0,1,0,0|2,0,0]=4 5609 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-4338380603 [0,1,0,1,0,0|2,0,0]=4 5610 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-7590170950 [0,1,0,1,0,0|2,0,0]=4 5611 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-8556273106 [0,1,0,1,0,0|2,0,0]=4 5612 B9R1.15 C[C@@H]\1CCCC/C1=N/O MCULE-8176246926 [0,1,0,1,0,0|1,0,1]=4 5613 B9R1.15 C[C@H]1CCCN[C@@H]1CO MCULE-1290896647 [0,1,0,1,0,0|1,0,0]=3 5614 B9R1.15 C[C@H]1CCCN[C@@H]1CO MCULE-3602411590 [0,1,0,1,0,0|1,0,0]=3 5615 B9R1.15 C[C@H]1NCCC[C@H]1CO MCULE-6295458608 [0,1,0,1,0,0|2,0,0]=4 5616 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-2162620553 [0,1,0,1,0,0|2,0,0]=4 5617 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-4393718690 [0,1,0,1,0,0|2,0,0]=4 5618 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-6427512664 [0,1,0,1,0,0|2,0,0]=4 5619 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-6736855904 [0,1,0,1,0,0|2,0,0]=4 5620 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-8696304905 [0,1,0,1,0,0|2,0,0]=4 5621 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-9103105556 [0,1,0,1,0,0|2,0,0]=4 5622 B9R1.15 N#CC1CCCCC1N MCULE-2802928693 [0,1,0,1,0,0|2,0,0]=4 5623 B9R1.15 N#CC1CCCCC1O MCULE-6629804837 [0,1,0,1,0,0|1,0,0]=3 5624 B9R1.15 N#CC1OCCCC1Br MCULE-3280462949 [0,1,0,1,0,0|1,0,1]=4 5625 B9R1.15 N#C[C@@H]1CCCC[C@H]1O MCULE-4635617312 [0,1,0,1,0,0|1,0,0]=3 5626 B9R1.15 NC1CCCCC1CO MCULE-5262753422 [0,1,0,1,0,0|1,0,0]=3 5627 B9R1.15 NC1CCCCC1CO MCULE-9191988425 [0,1,0,1,0,0|1,0,0]=3 5628 B9R1.15 NC1CCOCC1CO MCULE-7912086901 [0,1,0,1,0,0|2,0,0]=4 5629 B9R1.15 NC1COCCC1CO MCULE-3392980000 [0,1,0,1,0,0|2,0,0]=4 5630 B9R1.15 NC1COCCC1CO MCULE-8617350186 [0,1,0,1,0,0|2,0,0]=4 5631 B9R1.15 NCC1CCCCC1F MCULE-5222863833 [0,1,0,1,0,0|2,0,0]=4 5632 B9R1.15 NCC1CCCCC1F MCULE-5775855535 [0,1,0,1,0,0|2,0,0]=4 5633 B9R1.15 NCC1CCCCC1N MCULE-1706815858 [0,1,0,1,0,0|2,0,0]=4 5634 B9R1.15 NCC1CCCCC1N MCULE-4873726709 [0,1,0,1,0,0|2,0,0]=4 5635 B9R1.15 NCC1CCCCC1O MCULE-3106014100 [0,1,0,1,0,0|1,0,0]=3 5636 B9R1.15 NCC1CCNCC1O MCULE-3055394995 [0,1,0,1,0,0|2,0,0]=4 5637 B9R1.15 NCC1CCNCC1O MCULE-6224685083 [0,1,0,1,0,0|2,0,0]=4 5638 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-2628011610 [0,1,0,1,0,0|2,0,0]=4 5639 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-4130182685 [0,1,0,1,0,0|2,0,0]=4 5640 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-4171309495 [0,1,0,1,0,0|2,0,0]=4 5641 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-9652322332 [0,1,0,1,0,0|2,0,0]=4 5642 B9R1.15 NC[C@@H]1CCNC[C@H]1O MCULE-2431660086 [0,1,0,1,0,0|2,0,0]=4 5643 B9R1.15 NC[C@@H]1CCNC[C@H]1O MCULE-5301710683 [0,1,0,1,0,0|2,0,0]=4 5644 B9R1.15 NC[C@H]1CCCC[C@@H]1O MCULE-1443897301 [0,1,0,1,0,0|1,0,0]=3 5645 B9R1.15 NC[C@H]1CCCC[C@@H]1O MCULE-4382665718 [0,1,0,1,0,0|1,0,0]=3 5646 B9R1.15 NC[C@H]1CCNC[C@@H]1O MCULE-7451941473 [0,1,0,1,0,0|2,0,0]=4 5647 B9R1.15 NC[C@H]1CCNC[C@@H]1O MCULE-8077996531 [0,1,0,1,0,0|2,0,0]=4 5648 B9R1.15 NNC1CCCCC1O MCULE-1144773369 [0,1,0,1,0,0|1,0,0]=3 5649 B9R1.15 NNC1CCCCC1O MCULE-8337335745 [0,1,0,1,0,0|1,0,0]=3 5650 B9R1.15 NN[C@@H]1CCCC[C@H]1O MCULE-1480471068 [0,1,0,1,0,0|1,0,0]=3 5651 B9R1.15 NN[C@@H]1CCCC[C@H]1O MCULE-3427466844 [0,1,0,1,0,0|1,0,0]=3 5652 B9R1.15 NN[C@@H]1CCCC[C@H]1O MCULE-3752922997 [0,1,0,1,0,0|1,0,0]=3 5653 B9R1.15 NN[C@@H]1CCCC[C@H]1O MCULE-4432854577 [0,1,0,1,0,0|1,0,0]=3 5654 B9R1.15 NN[C@H]1CCCC[C@@H]1O MCULE-4369531684 [0,1,0,1,0,0|1,0,0]=3 5655 B9R1.15 N[C@@H]1CCCC[C@@H]1CO MCULE-2333094825 [0,1,0,1,0,0|1,0,0]=3 5656 B9R1.15 N[C@@H]1CCCC[C@@H]1CO MCULE-6100111885 [0,1,0,1,0,0|1,0,0]=3 5657 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-2541489944 [0,1,0,1,0,0|1,0,0]=3 5658 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-4358798149 [0,1,0,1,0,0|1,0,0]=3 5659 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-6886498483 [0,1,0,1,0,0|1,0,0]=3 5660 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-9434700277 [0,1,0,1,0,0|1,0,0]=3 5661 B9R1.15 N[C@H]1CCCC[C@H]1CO MCULE-7191404876 [0,1,0,1,0,0|1,0,0]=3 5662 B9R1.15 N[C@H]1CCCC[C@H]1CO MCULE-8159159865 [0,1,0,1,0,0|1,0,0]=3 5663 B9R1.15 N[C@H]1COCC[C@H]1CO MCULE-5880045699 [0,1,0,1,0,0|2,0,0]=4 5664 B9R1.15 N[C@H]1COCC[C@H]1CO MCULE-8504787876 [0,1,0,1,0,0|2,0,0]=4 5665 B9R1.15 O=C1CCCCC1CO MCULE-1345678838 [0,1,0,1,0,0|0,0,1]=3 5666 B9R1.15 O=C1NCCCC1CO MCULE-3810407789 [0,1,0,1,0,0|1,0,1]=4 5667 B9R1.15 O=C1NCCOC1CO MCULE-4336719695 [0,1,0,1,0,0|1,0,1]=4 5668 B9R1.15 OC1CCCCC1CBr MCULE-3516289492 [0,1,0,1,0,0|1,0,0]=3 5669 B9R1.15 OCC1=C(CCCC1)Br MCULE-6936960603 [0,1,0,1,0,0|1,0,1]=4 5670 B9R1.15 OCC1CCCCC1O MCULE-1945714569 [0,1,0,1,0,0|0,0,0]=2 5671 B9R1.15 OCC1CCNCC1F MCULE-2928396204 [0,1,0,1,0,0|2,0,0]=4 5672 B9R1.15 OCC1CCNCC1F MCULE-4498079199 [0,1,0,1,0,0|2,0,0]=4 5673 B9R1.15 OCC1CCNCC1O MCULE-7571515188 [0,1,0,1,0,0|1,0,0]=3 5674 B9R1.15 OCC1CCNCC1O MCULE-8029631005 [0,1,0,1,0,0|1,0,0]=3 5675 B9R1.15 OCC1CNCCC1O MCULE-1394638729 [0,1,0,1,0,0|1,0,0]=3 5676 B9R1.15 OCC1CNCCC1O MCULE-3316949664 [0,1,0,1,0,0|1,0,0]=3 5677 B9R1.15 OCC1NCCCC1O MCULE-4567185313 [0,1,0,1,0,0|1,0,0]=3 5678 B9R1.15 OCC1NCCCC1O MCULE-6603271501 [0,1,0,1,0,0|1,0,0]=3 5679 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-2280671949 [0,1,0,1,0,0|2,0,0]=4 5680 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-5182685629 [0,1,0,1,0,0|2,0,0]=4 5681 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-6426816664 [0,1,0,1,0,0|2,0,0]=4 5682 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-6911928107 [0,1,0,1,0,0|2,0,0]=4 5683 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-7067705943 [0,1,0,1,0,0|2,0,0]=4 5684 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-3094062800 [0,1,0,1,0,0|1,0,0]=3 5685 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-6303448234 [0,1,0,1,0,0|1,0,0]=3 5686 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-6793824447 [0,1,0,1,0,0|1,0,0]=3 5687 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-9672123449 [0,1,0,1,0,0|1,0,0]=3 5688 B9R1.15 OC[C@@H]1CCNC[C@H]1O MCULE-2277053036 [0,1,0,1,0,0|1,0,0]=3 5689 B9R1.15 OC[C@@H]1CCNC[C@H]1O MCULE-4840185571 [0,1,0,1,0,0|1,0,0]=3 5690 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-1589442124 [0,1,0,1,0,0|1,0,0]=3 5691 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-5378098662 [0,1,0,1,0,0|1,0,0]=3 5692 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-5907126780 [0,1,0,1,0,0|1,0,0]=3 5693 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-6675818472 [0,1,0,1,0,0|1,0,0]=3 5694 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-3084007189 [0,1,0,1,0,0|2,0,0]=4 5695 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-6039491253 [0,1,0,1,0,0|2,0,0]=4 5696 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-6077710469 [0,1,0,1,0,0|2,0,0]=4 5697 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-7212928624 [0,1,0,1,0,0|2,0,0]=4 5698 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-8482961967 [0,1,0,1,0,0|2,0,0]=4 5699 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-1138683406 [0,1,0,1,0,0|1,0,0]=3 5700 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-2009456098 [0,1,0,1,0,0|1,0,0]=3 5701 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-6847756490 [0,1,0,1,0,0|1,0,0]=3 5702 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-8689272206 [0,1,0,1,0,0|1,0,0]=3 5703 B9R1.15 OC[C@H]1CNCC[C@H]1O MCULE-1702794715 [0,1,0,1,0,0|1,0,0]=3 5704 B9R1.15 OC[C@H]1CNCC[C@H]1O MCULE-9636833446 [0,1,0,1,0,0|1,0,0]=3 5705 B9R1.15 OC[C@H]1OCC=C[C@@H]1O MCULE-3248185970 [0,1,0,1,0,0|0,0,2]=4 5706 B9R1.15 [C@H]1(CNCC[C@H]1CN)O MCULE-2780379872 [0,1,0,1,0,0|2,0,0]=4 5707 B9R1.15 [C@H]1(CNCC[C@H]1CN)O MCULE-6533831464 [0,1,0,1,0,0|2,0,0]=4 5708 B9R1.15 [C@H]1(CNCC[C@H]1CO)O MCULE-6865852051 [0,1,0,1,0,0|1,0,0]=3 5709 B9R1.22 CCN1CC(CC1=O)O MCULE-3389024209 [0,1,0,1,0,0|1,0,1]=4 5710 B9R1.22 CCN1C[C@H](CC1=O)O MCULE-9379641102 [0,1,0,1,0,0|1,0,1]=4 5711 B9R1.22 CN1CC(CC1CN)O MCULE-7600471860 [0,1,0,1,0,0|2,0,0]=4 5712 B9R1.22 CN1CC(CC1CO)O MCULE-2631177865 [0,1,0,1,0,0|2,0,0]=4 5713 B9R1.22 CN1CC(CC1CO)O MCULE-7941036683 [0,1,0,1,0,0|2,0,0]=4 5714 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-6835957451 [0,1,0,1,0,0|2,0,0]=4 5715 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-6937864936 [0,1,0,1,0,0|2,0,0]=4 5716 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-7885385401 [0,1,0,1,0,0|2,0,0]=4 5717 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-9581024864 [0,1,0,1,0,0|2,0,0]=4 5718 B9R1.22 CN1C[C@H](C[C@H]1CO)O MCULE-6254507858 [0,1,0,1,0,0|2,0,0]=4 5719 B9R1.22 NC1CC(C(C1)CO)O MCULE-6483016480 [0,1,0,1,0,0|2,0,0]=4 5720 B9R1.22 NC1CC(C(C1)CO)O MCULE-7351789396 [0,1,0,1,0,0|2,0,0]=4 5721 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-1625502283 [0,1,0,1,0,0|2,0,0]=4 5722 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-2916623249 [0,1,0,1,0,0|2,0,0]=4 5723 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-3265275024 [0,1,0,1,0,0|2,0,0]=4 5724 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-5953198671 [0,1,0,1,0,0|2,0,0]=4 5725 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-6935436356 [0,1,0,1,0,0|2,0,0]=4 5726 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-8122722811 [0,1,0,1,0,0|2,0,0]=4 5727 B9R1.22 O=C1CC(C(O1)CO)O MCULE-1210550303 [0,1,0,1,0,0|1,0,1]=4 5728 B9R1.22 O=C1C[C@@H]([C@H](O1)CO)O MCULE-2550191764 [0,1,0,1,0,0|1,0,1]=4 5729 B9R1.22 O=C1C[C@@H]([C@H](O1)CO)O MCULE-3529189398 [0,1,0,1,0,0|1,0,1]=4 5730 B9R1.22 OCC1OC(CC1O)O MCULE-1321369472 [0,1,0,1,0,0|1,0,0]=3 5731 B9R1.22 OC[C@@H]1OC(C[C@H]1O)O MCULE-2396008864 [0,1,0,1,0,0|1,0,0]=3 5732 B9R1.22 OC[C@@H]1OC(C[C@H]1O)O MCULE-3186725991 [0,1,0,1,0,0|1,0,0]=3 5733 B9R1.22 OC[C@@H]1OC(C[C@H]1O)O MCULE-8127322430 [0,1,0,1,0,0|1,0,0]=3 5734 B9R1.22 OC[C@H]1OC(C[C@@H]1O)O MCULE-5678157789 [0,1,0,1,0,0|1,0,0]=3 5735 B9R1.22 [C@@H]1(CC(=O)O[C@@H]1CO)O MCULE-1905436889 [0,1,0,1,0,0|1,0,1]=4 5736 B9R1.33 CCNC1COCC1O MCULE-7678905536 [0,1,0,1,0,0|1,0,0]=3 5737 B9R1.33 CCN[C@H]1COC[C@@H]1O MCULE-1056741017 [0,1,0,1,0,0|1,0,0]=3 5738 B9R1.33 CCN[C@H]1COC[C@@H]1O MCULE-9348333209 [0,1,0,1,0,0|1,0,0]=3 5739 B9R1.33 CCOC1COCC1N MCULE-2162651380 [0,1,0,1,0,0|2,0,0]=4 5740 B9R1.33 CCOC1COCC1N MCULE-9082503329 [0,1,0,1,0,0|2,0,0]=4 5741 B9R1.33 CCO[C@@H]1COC[C@H]1N MCULE-1741753592 [0,1,0,1,0,0|2,0,0]=4 5742 B9R1.33 CCO[C@@H]1COC[C@H]1N MCULE-6669405898 [0,1,0,1,0,0|2,0,0]=4 5743 B9R1.33 CCO[C@H]1COC[C@@H]1N MCULE-2150046389 [0,1,0,1,0,0|2,0,0]=4 5744 B9R1.33 CCO[C@H]1COC[C@@H]1N MCULE-4858617743 [0,1,0,1,0,0|2,0,0]=4 5745 B9R1.33 CCO[C@H]1COC[C@@H]1N MCULE-8083115654 [0,1,0,1,0,0|2,0,0]=4 5746 B9R1.33 CCO[C@H]1COC[C@@H]1N MCULE-8977340327 [0,1,0,1,0,0|2,0,0]=4 5747 B9R1.33 CNCC1CCCC1O MCULE-1707127587 [0,1,0,1,0,0|2,0,0]=4 5748 B9R1.33 OCCC1CCCC1O MCULE-2038693822 [0,1,0,1,0,0|2,0,0]=4 5749 B9R1.48 CC1CCCCC(=O)C1 MCULE-5791948972 [0,1,0,1,0,0|1,0,1]=4 5750 B9R1.48 CC1CCCCC(N1)C MCULE-5797406782 [0,1,0,1,0,0|2,0,0]=4 5751 B9R1.48 CN1CCCCC(C1)N MCULE-8384083495 [0,1,0,1,0,0|2,0,0]=4 5752 B9R1.48 CN1CCOCC(C1)O MCULE-1541124940 [0,1,0,1,0,0|1,0,0]=3 5753 B9R1.48 CN1CCOCC(C1)O MCULE-6224231752 [0,1,0,1,0,0|1,0,0]=3 5754 B9R1.48 C[C@@H]1CCCC[C@H](N1)C MCULE-7954748247 [0,1,0,1,0,0|2,0,0]=4 5755 B9R1.48 C[C@H]1CCCC[C@@H](N1)C MCULE-2719547061 [0,1,0,1,0,0|2,0,0]=4 5756 B9R1.48 C[C@H]1CCCC[C@H](N1)C MCULE-7122277223 [0,1,0,1,0,0|2,0,0]=4 5757 B9R1.48 NC1CCCCC(C1)O MCULE-5548192102 [0,1,0,1,0,0|1,0,0]=3 5758 B9R1.48 NC1CCCCC(C1)O MCULE-8953029807 [0,1,0,1,0,0|1,0,0]=3 5759 B9R1.48 N[C@@H]1CCCC[C@@H](C1)O MCULE-7609350144 [0,1,0,1,0,0|1,0,0]=3 5760 B9R1.48 N[C@@H]1CCCC[C@@H](C1)O MCULE-9626764594 [0,1,0,1,0,0|1,0,0]=3 5761 B9R1.48 N[C@@H]1CCCC[C@H](C1)O MCULE-4772681431 [0,1,0,1,0,0|1,0,0]=3 5762 B9R1.48 N[C@@H]1CCCC[C@H](C1)O MCULE-6968396232 [0,1,0,1,0,0|1,0,0]=3 5763 B9R1.48 N[C@H]1CCCC[C@@H](C1)O MCULE-4503660630 [0,1,0,1,0,0|1,0,0]=3 5764 B9R1.48 N[C@H]1CCCC[C@@H](C1)O MCULE-4564760854 [0,1,0,1,0,0|1,0,0]=3 5765 B9R1.48 N[C@H]1CCCC[C@H](C1)O MCULE-2271050688 [0,1,0,1,0,0|1,0,0]=3 5766 B9R1.48 N[C@H]1CCCC[C@H](C1)O MCULE-7801993304 [0,1,0,1,0,0|1,0,0]=3 5767 B9R1.48 O=C1CC(CCCN1)O MCULE-6648954515 [0,1,0,1,0,0|1,0,1]=4 5768 B9R1.48 O=C1CCCCC(N1)O MCULE-6756895418 [0,1,0,1,0,0|0,0,2]=4 5769 B9R1.49 CC1CCCC(CC1)N MCULE-7634847223 [0,1,0,1,0,0|2,0,0]=4 5770 B9R1.49 CC1CCCC(NC1)C MCULE-1631903049 [0,1,0,1,0,0|2,0,0]=4 5771 B9R1.49 CN1CCCC(CC1)N MCULE-6912137278 [0,1,0,1,0,0|2,0,0]=4 5772 B9R1.49 CN1CCCC(CC1)N MCULE-8190526879 [0,1,0,1,0,0|2,0,0]=4 5773 B9R1.49 CN1CCCC(CC1)O MCULE-6133611762 [0,1,0,1,0,0|1,0,0]=3 5774 B9R1.49 CN1CCCC(CC1)O MCULE-6589317799 [0,1,0,1,0,0|1,0,0]=3 5775 B9R1.49 CN1CCC[C@@H](CC1)N MCULE-1565470542 [0,1,0,1,0,0|2,0,0]=4 5776 B9R1.49 CN1CCC[C@@H](CC1)O MCULE-2532340714 [0,1,0,1,0,0|1,0,0]=3 5777 B9R1.49 CN1CCC[C@H](CC1)O MCULE-6867682041 [0,1,0,1,0,0|1,0,0]=3 5778 B9R1.49 NC1CCCC(CC1)O MCULE-5371360262 [0,1,0,1,0,0|1,0,0]=3 5779 B9R1.49 NC1CCCC(CC1)O MCULE-7262958041 [0,1,0,1,0,0|1,0,0]=3 5780 B9R1.49 N[C@@H]1CCC[C@@H](CC1)O MCULE-1133973283 [0,1,0,1,0,0|1,0,0]=3 5781 B9R1.49 N[C@@H]1CCC[C@@H](CC1)O MCULE-4169090989 [0,1,0,1,0,0|1,0,0]=3 5782 B9R1.49 N[C@@H]1CCC[C@H](CC1)O MCULE-2007393276 [0,1,0,1,0,0|1,0,0]=3 5783 B9R1.49 N[C@H]1CCC[C@@H](CC1)O MCULE-2524209060 [0,1,0,1,0,0|1,0,0]=3 5784 B9R1.49 N[C@H]1CCC[C@H](CC1)O MCULE-3889106863 [0,1,0,1,0,0|1,0,0]=3 5785 B9R1.49 O=C1CCCC(CN1)O MCULE-2883103344 [0,1,0,1,0,0|1,0,1]=4 5786 B9R1.50 BrC1CCCCCCC1 MCULE-9261673111 [0,1,0,1,0,0|2,0,0]=4 5787 B9R1.50 NC1CCCCCCC1 MCULE-6537375543 [0,1,0,1,0,0|2,0,0]=4 5788 B9R1.50 NC1CCCCCNC1 MCULE-8217686828 [0,1,0,1,0,0|2,0,0]=4 5789 B9R1.50 OC1C=CCCCCC1 MCULE-1181214133 [0,1,0,1,0,0|1,0,1]=4 5790 B9R1.50 OC1CCC=CCCC1 MCULE-1736825337 [0,1,0,1,0,0|1,0,1]=4 5791 B9R1.50 OC1CCC=CCCC1 MCULE-6297988885 [0,1,0,1,0,0|1,0,1]=4 5792 B9R1.50 OC1CCCCCCC1 MCULE-7379371136 [0,1,0,1,0,0|1,0,0]=3 5793 B9R1.50 OC1CNCCCNC1 MCULE-3177425947 [0,1,0,1,0,0|1,0,0]=3 5794 B9R1.50 OC1CNCCCNC1 MCULE-5698562435 [0,1,0,1,0,0|1,0,0]=3 5795 B9R1.50 OC1CSCCCSC1 MCULE-8296129342 [0,1,0,1,0,0|0,1,0]=3 5796 B9R1.50 O[C@@H]1CCC=CCCC1 MCULE-2143953157 [0,1,0,1,0,0|1,0,1]=4 5797 B9R1.50 O[C@H]1CCC=CCCC1 MCULE-9747750449 [0,1,0,1,0,0|1,0,1]=4 5798 B9R1.58 CCOC1CC(C1)CBr MCULE-3252036766 [0,1,0,1,0,0|2,0,0]=4 5799 B9R1.58 CCOC1CC(C1)CO MCULE-8200075252 [0,1,0,1,0,0|1,0,0]=3 5800 B9R1.58 CN[C@H]1C[C@H](C1)COC MCULE-7841321229 [0,1,0,1,0,0|2,0,0]=4 5801 B9R1.69 CC1CC(=O)CCC1O MCULE-7552412875 [0,1,0,1,0,0|1,0,1]=4 5802 B9R1.69 CC1CC(C(CN1)C)O MCULE-4236165208 [0,1,0,1,0,0|2,0,0]=4 5803 B9R1.69 CC1CC(C(CN1)C)O MCULE-4276808995 [0,1,0,1,0,0|2,0,0]=4 5804 B9R1.69 CC1CC(C(CN1)C)O MCULE-7662096159 [0,1,0,1,0,0|2,0,0]=4 5805 B9R1.69 CC1CC(CCC1O)N MCULE-2064143098 [0,1,0,1,0,0|1,0,0]=3 5806 B9R1.69 CC1CC(CCN1C)O MCULE-1191672097 [0,1,0,1,0,0|2,0,0]=4 5807 B9R1.69 CC1CCC(C(=O)C1)C MCULE-1189470004 [0,1,0,1,0,0|1,0,1]=4 5808 B9R1.69 CC1CCC(C(C1)C)C MCULE-8423605383 [0,1,0,1,0,0|2,0,0]=4 5809 B9R1.69 CC1CCC(C(C1)C)N MCULE-8155557981 [0,1,0,1,0,0|2,0,0]=4 5810 B9R1.69 CC1CCC(C(C1)C)O MCULE-1958135453 [0,1,0,1,0,0|1,0,0]=3 5811 B9R1.69 CC1CCC(C(C1)N)C MCULE-3108482020 [0,1,0,1,0,0|2,0,0]=4 5812 B9R1.69 CC1CCC(C(C1)N)C MCULE-8540581791 [0,1,0,1,0,0|2,0,0]=4 5813 B9R1.69 CC1CCC(C(C1)O)C MCULE-8174479267 [0,1,0,1,0,0|1,0,0]=3 5814 B9R1.69 CC1CCC(C(N1)C)N MCULE-4753292681 [0,1,0,1,0,0|2,0,0]=4 5815 B9R1.69 CC1CCC(CC1C)N MCULE-1561023388 [0,1,0,1,0,0|2,0,0]=4 5816 B9R1.69 CC1CCC(CC1C)O MCULE-6171532647 [0,1,0,1,0,0|1,0,0]=3 5817 B9R1.69 CC1CCC(CC1N)N MCULE-9493089768 [0,1,0,1,0,0|2,0,0]=4 5818 B9R1.69 CC1CN(CCC1O)C MCULE-2311637252 [0,1,0,1,0,0|2,0,0]=4 5819 B9R1.69 CC1CN(CCC1O)C MCULE-2388697417 [0,1,0,1,0,0|2,0,0]=4 5820 B9R1.69 CC1CNC(C(C1)C)C MCULE-6407956484 [0,1,0,1,0,0|2,0,0]=4 5821 B9R1.69 CC1CNC(C(O1)C)C MCULE-7872244038 [0,1,0,1,0,0|2,0,0]=4 5822 B9R1.69 CN1CCC(C(C1)N)O MCULE-3391658337 [0,1,0,1,0,0|2,0,0]=4 5823 B9R1.69 CN1CCC(C(C1)N)O MCULE-6290719349 [0,1,0,1,0,0|2,0,0]=4 5824 B9R1.69 CN1CC[C@@H]([C@H](C1)N)O MCULE-3271450175 [0,1,0,1,0,0|2,0,0]=4 5825 B9R1.69 CN1CC[C@@H]([C@H](C1)N)O MCULE-6377414868 [0,1,0,1,0,0|2,0,0]=4 5826 B9R1.69 CN1CC[C@H]([C@@H](C1)N)O MCULE-4189507303 [0,1,0,1,0,0|2,0,0]=4 5827 B9R1.69 CN1CC[C@H]([C@@H](C1)N)O MCULE-5782034171 [0,1,0,1,0,0|2,0,0]=4 5828 B9R1.69 CN1CC[C@H]([C@@H](C1)N)O MCULE-6728779168 [0,1,0,1,0,0|2,0,0]=4 5829 B9R1.69 CN1CC[C@H]([C@@H](C1)N)O MCULE-9441385805 [0,1,0,1,0,0|2,0,0]=4 5830 B9R1.69 C[C@@H]1CC(=O)CC[C@@H]1O MCULE-8675773780 [0,1,0,1,0,0|1,0,1]=4 5831 B9R1.69 C[C@@H]1C[C@@H](CCN1C)O MCULE-3810592624 [0,1,0,1,0,0|2,0,0]=4 5832 B9R1.69 C[C@@H]1C[C@H](CCN1C)O MCULE-9999971568 [0,1,0,1,0,0|2,0,0]=4 5833 B9R1.69 C[C@H]1CC(=O)CC[C@@H]1O MCULE-5873948412 [0,1,0,1,0,0|1,0,1]=4 5834 B9R1.69 C[C@H]1C[C@@H](CCN1C)O MCULE-6393127551 [0,1,0,1,0,0|2,0,0]=4 5835 B9R1.69 C[C@H]1C[C@H](CCN1C)O MCULE-9074192480 [0,1,0,1,0,0|2,0,0]=4 5836 B9R1.69 OC1CC(C(CO1)O)O MCULE-3654762746 [0,1,0,1,0,0|1,0,0]=3 5837 B9R1.69 OC1C[C@@H]([C@@H](CO1)O)O MCULE-2084054051 [0,1,0,1,0,0|1,0,0]=3 5838 B9R1.69 OC1C[C@@H]([C@@H](CO1)O)O MCULE-9105480679 [0,1,0,1,0,0|1,0,0]=3 5839 B9R1.69 OC1C[C@H]([C@H](CO1)O)O MCULE-7375065985 [0,1,0,1,0,0|1,0,0]=3 5840 B9R1.73 CCCC(N)C1CCC1 MCULE-2304710158 [0,1,0,1,0,0|2,0,0]=4 5841 B9R1.73 NC(CCO)C1CCC1 MCULE-1474058368 [0,1,0,1,0,0|1,0,0]=3 5842 B9R1.73 NC(CCO)C1CCC1 MCULE-1872378337 [0,1,0,1,0,0|1,0,0]=3 5843 B9R1.73 NCCC(O)C1CCC1 MCULE-6094534332 [0,1,0,1,0,0|1,0,0]=3 5844 B9R1.117 CCCCC1(COC1)O MCULE-9957945621 [0,1,0,1,0,0|0,0,0]=2 5845 B9R1.117 NC1(COC1)CCCO MCULE-1830214215 [0,1,0,1,0,0|2,0,0]=4 5846 B9R1.117 NCCCC1(CCC1)O MCULE-2174534831 [0,1,0,1,0,0|2,0,0]=4 5847 B9R1.117 OCCCC1(CCC1)O MCULE-7389166419 [0,1,0,1,0,0|2,0,0]=4 5848 B9R1.134 C#CCC1(CCCC1)O MCULE-2140547097 [0,1,0,1,0,0|1,0,0]=3 5849 B9R1.134 C=CCC1(CCCC1)N MCULE-9439388732 [0,1,0,1,0,0|2,0,0]=4 5850 B9R1.134 CC1(CCCC1)CC#N MCULE-9033840944 [0,1,0,1,0,0|2,0,0]=4 5851 B9R1.134 CC1(CCCC1)CCN MCULE-4782087694 [0,1,0,1,0,0|2,0,0]=4 5852 B9R1.134 CC1(CCCC1)CNN MCULE-3711399803 [0,1,0,1,0,0|2,0,0]=4 5853 B9R1.134 CC1(CCCC1)CNN MCULE-9248085182 [0,1,0,1,0,0|2,0,0]=4 5854 B9R1.134 CCCC1(CCCC1)O MCULE-5471676226 [0,1,0,1,0,0|1,0,0]=3 5855 B9R1.134 CNCC1(CCCC1)O MCULE-5781338172 [0,1,0,1,0,0|1,0,0]=3 5856 B9R1.134 COCC1(CCCC1)N MCULE-4902857537 [0,1,0,1,0,0|1,0,0]=3 5857 B9R1.134 COCC1(CCCC1)N MCULE-7196976973 [0,1,0,1,0,0|1,0,0]=3 5858 B9R1.134 COCC1(CCNC1)C MCULE-3041347405 [0,1,0,1,0,0|2,0,0]=4 5859 B9R1.134 COCC1(CCNC1)C MCULE-9218828467 [0,1,0,1,0,0|2,0,0]=4 5860 B9R1.134 COCC1(CCNC1)F MCULE-1014824799 [0,1,0,1,0,0|2,0,0]=4 5861 B9R1.134 COCC1(CCNC1)F MCULE-9693040142 [0,1,0,1,0,0|2,0,0]=4 5862 B9R1.134 COCC1(CCNC1)O MCULE-5228974252 [0,1,0,1,0,0|1,0,0]=3 5863 B9R1.134 COCC1(CCOC1)N MCULE-4642000021 [0,1,0,1,0,0|2,0,0]=4 5864 B9R1.134 COCC1(CCOC1)N MCULE-5928206934 [0,1,0,1,0,0|2,0,0]=4 5865 B9R1.134 COC[C@@]1(CCNC1)F MCULE-2716103046 [0,1,0,1,0,0|2,0,0]=4 5866 B9R1.134 N#CCC1(CCCC1)N MCULE-4524120267 [0,1,0,1,0,0|2,0,0]=4 5867 B9R1.134 N#CCC1(CCCC1)N MCULE-5267593854 [0,1,0,1,0,0|2,0,0]=4 5868 B9R1.134 N#CCC1(CCCC1)O MCULE-8349326849 [0,1,0,1,0,0|1,0,0]=3 5869 B9R1.134 N#CCC1(CCNC1)O MCULE-5756715746 [0,1,0,1,0,0|2,0,0]=4 5870 B9R1.134 N#CCC1(CCNC1)O MCULE-8981798172 [0,1,0,1,0,0|2,0,0]=4 5871 B9R1.134 NC1(CCCC1)CCO MCULE-4642086605 [0,1,0,1,0,0|1,0,0]=3 5872 B9R1.134 NC1(CCOC1)CCO MCULE-4522691616 [0,1,0,1,0,0|2,0,0]=4 5873 B9R1.134 NCCC1(CCCC1)O MCULE-1201498736 [0,1,0,1,0,0|1,0,0]=3 5874 B9R1.134 NCCC1(CCCC1)O MCULE-7256828688 [0,1,0,1,0,0|1,0,0]=3 5875 B9R1.134 NCCC1(CCOC1)O MCULE-8536689384 [0,1,0,1,0,0|2,0,0]=4 5876 B9R1.134 OCCC1(CCCC1)O MCULE-4832877397 [0,1,0,1,0,0|0,0,0]=2 5877 B9R1.3 C1(CCNC(C1C)C)O MCULE-7157710103 [0,1,0,1,0,0|1,0,0]=3 5878 B9R1.3 C1(CCNC(C1C)C)O MCULE-8288554330 [0,1,0,1,0,0|1,0,0]=3 5879 B9R1.3 CC1=C(C(CCC1)O)C MCULE-7202234917 [0,1,0,1,0,0|1,0,1]=4 5880 B9R1.3 CC1C(CCCN1C)N MCULE-8069613594 [0,1,0,1,0,0|2,0,0]=4 5881 B9R1.3 CC1CCCC(C1C)C MCULE-9375072995 [0,1,0,1,0,0|2,0,0]=4 5882 B9R1.3 CC1CCCC(C1C)N MCULE-7085283833 [0,1,0,1,0,0|2,0,0]=4 5883 B9R1.3 CC1CCCC(C1C)O MCULE-1285216829 [0,1,0,1,0,0|1,0,0]=3 5884 B9R1.3 CC1CCCC(C1N)C MCULE-4904455493 [0,1,0,1,0,0|2,0,0]=4 5885 B9R1.3 CC1CCCC(C1N)C MCULE-9589109711 [0,1,0,1,0,0|2,0,0]=4 5886 B9R1.3 CC1CCCC(C1O)C MCULE-8568932421 [0,1,0,1,0,0|1,0,0]=3 5887 B9R1.3 CC1CNCC(C1O)C MCULE-6809685999 [0,1,0,1,0,0|1,0,0]=3 5888 B9R1.3 CC1CNCC(C1O)C MCULE-8043720997 [0,1,0,1,0,0|1,0,0]=3 5889 B9R1.3 CC1COCC(C1N)C MCULE-8557502930 [0,1,0,1,0,0|2,0,0]=4 5890 B9R1.3 CC1CSCC(C1N)C MCULE-8942533897 [0,1,0,1,0,0|2,0,0]=4 5891 B9R1.3 CC1OCCC(C1O)O MCULE-6494583965 [0,1,0,1,0,0|0,0,0]=2 5892 B9R1.3 CN1CCCC(C1=O)O MCULE-9396895370 [0,1,0,1,0,0|0,0,2]=4 5893 B9R1.3 C[C@@H]1CNC[C@@H]([C@@H]1O)O MCULE-4065345114 [0,1,0,1,0,0|0,0,0]=2 5894 B9R1.3 C[C@@H]1CNC[C@@H]([C@@H]1O)O MCULE-5732596905 [0,1,0,1,0,0|0,0,0]=2 5895 B9R1.3 C[C@H]1CNC[C@@H]([C@@H]1O)O MCULE-3640440568 [0,1,0,1,0,0|0,0,0]=2 5896 B9R1.3 C[C@H]1CNC[C@@H]([C@@H]1O)O MCULE-9501528896 [0,1,0,1,0,0|0,0,0]=2 5897 B9R1.3 NC1C(CCCC1O)O MCULE-1978359416 [0,1,0,1,0,0|1,0,0]=3 5898 B9R1.3 N[C@@H]1CCC[C@H]([C@@H]1O)O MCULE-7294484287 [0,1,0,1,0,0|0,0,0]=2 5899 B9R1.3 N[C@H]1CCC[C@@H]([C@@H]1O)O MCULE-4901407173 [0,1,0,1,0,0|0,0,0]=2 5900 B9R1.3 N[C@H]1CCC[C@H]([C@@H]1O)O MCULE-2706489441 [0,1,0,1,0,0|0,0,0]=2 5901 B9R1.3 OC1CCCC(C1O)O MCULE-2835511427 [0,1,0,1,0,0|0,0,0]=2 5902 B9R1.3 [C@@H]1(CCC[C@H]([C@@H]1N)O)O MCULE-9327450801 [0,1,0,1,0,0|1,0,0]=3 5903 B9R1.5 BrC1CCCCCC1Br MCULE-2183687656 [0,1,0,1,0,0|2,0,0]=4 5904 B9R1.5 CC1CCCCCC1N MCULE-5854491023 [0,1,0,1,0,0|2,0,0]=4 5905 B9R1.5 CC1CCCNCC1C MCULE-3413141564 [0,1,0,1,0,0|2,0,0]=4 5906 B9R1.5 CC1CCCNCC1C MCULE-6316766408 [0,1,0,1,0,0|2,0,0]=4 5907 B9R1.5 CC1CCNCCC1O MCULE-2014482309 [0,1,0,1,0,0|1,0,0]=3 5908 B9R1.5 CC1CCNCCC1O MCULE-7020970444 [0,1,0,1,0,0|1,0,0]=3 5909 B9R1.5 CC1CNCCCC1O MCULE-7042298511 [0,1,0,1,0,0|1,0,0]=3 5910 B9R1.5 CC1CNCCCC1O MCULE-8658161534 [0,1,0,1,0,0|1,0,0]=3 5911 B9R1.5 NC1CCCCCC1O MCULE-8315023618 [0,1,0,1,0,0|1,0,0]=3 5912 B9R1.5 N[C@@H]1CCCCC[C@@H]1O MCULE-2063759577 [0,1,0,1,0,0|1,0,0]=3 5913 B9R1.5 N[C@@H]1CCCCC[C@@H]1O MCULE-8213087274 [0,1,0,1,0,0|1,0,0]=3 5914 B9R1.5 N[C@@H]1CCCCC[C@H]1O MCULE-5613622981 [0,1,0,1,0,0|1,0,0]=3 5915 B9R1.5 N[C@H]1CCCCC[C@@H]1O MCULE-6991711117 [0,1,0,1,0,0|1,0,0]=3 5916 B9R1.5 N[C@H]1CCCCC[C@H]1N MCULE-4838437415 [0,1,0,1,0,0|2,0,0]=4 5917 B9R1.5 N[C@H]1CCCCC[C@H]1N MCULE-9986210496 [0,1,0,1,0,0|2,0,0]=4 5918 B9R1.5 N[C@H]1CCCCC[C@H]1O MCULE-2920839467 [0,1,0,1,0,0|1,0,0]=3 5919 B9R1.5 N[C@H]1CCCCC[C@H]1O MCULE-2969566133 [0,1,0,1,0,0|1,0,0]=3 5920 B9R1.5 O=C1CCCCCC1O MCULE-1763055677 [0,1,0,1,0,0|0,0,2]=4 5921 B9R1.5 OC1CCCCCC1O MCULE-7682077273 [0,1,0,1,0,0|0,0,0]=2 5922 B9R1.5 OC1CCNCCC1F MCULE-6523954631 [0,1,0,1,0,0|1,0,0]=3 5923 B9R1.5 OC1CCNCCC1F MCULE-9888134998 [0,1,0,1,0,0|1,0,0]=3 5924 B9R1.5 OC1CNCCCC1F MCULE-3253307740 [0,1,0,1,0,0|1,0,0]=3 5925 B9R1.5 OC1CNCCCC1F MCULE-9432299615 [0,1,0,1,0,0|1,0,0]=3 5926 B9R1.5 O[C@H]1CCCCC[C@@H]1O MCULE-9651607332 [0,1,0,1,0,0|0,0,0]=2 5927 B9R1.11 C#CC(O)C1CCCC1 MCULE-2991189926 [0,1,0,1,0,0|1,0,1]=4 5928 B9R1.11 C=CC(O)C1CCCC1 MCULE-8096299119 [0,1,0,1,0,0|1,0,1]=4 5929 B9R1.11 CC(CBr)C1CCCC1 MCULE-7239123079 [0,1,0,1,0,0|2,0,0]=4 5930 B9R1.11 CC(CCl)N1CCCC1 MCULE-1307780796 [0,1,0,1,0,0|2,0,0]=4 5931 B9R1.11 CC(CCl)N1CCCC1 MCULE-4095888015 [0,1,0,1,0,0|2,0,0]=4 5932 B9R1.11 CC(CN)N1CCCC1 MCULE-1901324821 [0,1,0,1,0,0|2,0,0]=4 5933 B9R1.11 CC(CN)N1CCCC1 MCULE-5999254614 [0,1,0,1,0,0|2,0,0]=4 5934 B9R1.11 CC(CO)N1CCCC1 MCULE-2818984547 [0,1,0,1,0,0|1,0,0]=3 5935 B9R1.11 CCC(C)C1CCCN1 MCULE-6263276107 [0,1,0,1,0,0|2,0,0]=4 5936 B9R1.11 CCC(C)C1CCNC1 MCULE-1019713366 [0,1,0,1,0,0|2,0,0]=4 5937 B9R1.11 CCC(N)C1CCCC1 MCULE-2018376160 [0,1,0,1,0,0|2,0,0]=4 5938 B9R1.11 CCC(N)C1CCCO1 MCULE-7946594021 [0,1,0,1,0,0|2,0,0]=4 5939 B9R1.11 CCC(N)C1CCOC1 MCULE-9731711708 [0,1,0,1,0,0|2,0,0]=4 5940 B9R1.11 C[C@@H](CO)N1CCCC1 MCULE-3412759469 [0,1,0,1,0,0|1,0,0]=3 5941 B9R1.11 C[C@H](CO)N1CCCC1 MCULE-3282668740 [0,1,0,1,0,0|1,0,0]=3 5942 B9R1.11 NC(CO)C1CCCC1 MCULE-3542083676 [0,1,0,1,0,0|1,0,0]=3 5943 B9R1.11 NC(CO)C1CCCC1 MCULE-5931245443 [0,1,0,1,0,0|1,0,0]=3 5944 B9R1.11 NC(CO)C1CCCO1 MCULE-1115414738 [0,1,0,1,0,0|1,0,0]=3 5945 B9R1.11 NC(CO)C1CCOC1 MCULE-3949685203 [0,1,0,1,0,0|1,0,0]=3 5946 B9R1.11 NC(CO)C1CCOC1 MCULE-7535404270 [0,1,0,1,0,0|1,0,0]=3 5947 B9R1.11 NCC(F)C1CCCC1 MCULE-2563707089 [0,1,0,1,0,0|2,0,0]=4 5948 B9R1.11 NCC(F)C1CCCC1 MCULE-5929697460 [0,1,0,1,0,0|2,0,0]=4 5949 B9R1.11 NCC(N)C1CCCC1 MCULE-6437780642 [0,1,0,1,0,0|2,0,0]=4 5950 B9R1.11 NCC(O)C1CCCC1 MCULE-1826088467 [0,1,0,1,0,0|1,0,0]=3 5951 B9R1.11 NCC(O)C1CCCC1 MCULE-5186127631 [0,1,0,1,0,0|1,0,0]=3 5952 B9R1.11 NCC(O)C1CCCO1 MCULE-1674634827 [0,1,0,1,0,0|1,0,0]=3 5953 B9R1.11 NCC(O)C1CCOC1 MCULE-2353712692 [0,1,0,1,0,0|1,0,0]=3 5954 B9R1.11 NCC(O)C1CCOC1 MCULE-2647033518 [0,1,0,1,0,0|1,0,0]=3 5955 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-1672080667 [0,1,0,1,0,0|1,0,0]=3 5956 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-2468572391 [0,1,0,1,0,0|1,0,0]=3 5957 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-9200212417 [0,1,0,1,0,0|1,0,0]=3 5958 B9R1.11 O=C(CO)N1CCCC1 MCULE-6227389604 [0,1,0,1,0,0|0,0,2]=4 5959 B9R1.37 CC1OC(=O)C(C1O)O MCULE-1862325809 [0,1,0,1,0,0|1,0,1]=4 5960 B9R1.37 CC1OC(C(C1O)O)O MCULE-7774087123 [0,1,0,1,0,0|1,0,0]=3 5961 B9R1.37 C[C@@H]1OC(=O)[C@@H]([C@H]1O)O MCULE-3554272195 [0,1,0,1,0,0|1,0,1]=4 5962 B9R1.37 N[C@@H]1C[C@@H]([C@H]([C@H]1O)O)O MCULE-7192019909 [0,1,0,1,0,0|1,0,0]=3 5963 B9R1.37 N[C@@H]1C[C@@H]([C@H]([C@H]1O)O)O MCULE-9128030642 [0,1,0,1,0,0|1,0,0]=3 5964 B9R1.88 COC(=O)[C@H]1O[C@@H]1CO MCULE-8447681594 [0,1,0,1,0,0|1,0,1]=4 5965 B9R1.132 CN1CCC(C1=O)CO MCULE-4783255632 [0,1,0,1,0,0|1,0,1]=4 5966 B9R1.132 OCC1NCC(C1O)O MCULE-7093172739 [0,1,0,1,0,0|1,0,0]=3 5967 B9R1.132 OCC1NCC(C1O)O MCULE-9377849443 [0,1,0,1,0,0|1,0,0]=3 5968 B9R1.132 OCC1OCC(C1O)O MCULE-6035918255 [0,1,0,1,0,0|1,0,0]=3 5969 B9R1.132 OC[C@@H]1OC[C@H]([C@H]1O)O MCULE-5977248366 [0,1,0,1,0,0|1,0,0]=3 5970 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-1707860323 [0,1,0,1,0,0|1,0,0]=3 5971 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-3279393618 [0,1,0,1,0,0|1,0,0]=3 5972 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-8001939489 [0,1,0,1,0,0|1,0,0]=3 5973 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-9735967120 [0,1,0,1,0,0|1,0,0]=3 5974 B9R1.132 OC[C@H]1NC[C@H]([C@@H]1O)O MCULE-2264267716 [0,1,0,1,0,0|1,0,0]=3 5975 B9R1.132 OC[C@H]1NC[C@H]([C@@H]1O)O MCULE-3690741497 [0,1,0,1,0,0|1,0,0]=3 5976 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-1695946114 [0,1,0,1,0,0|1,0,0]=3 5977 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-4767198765 [0,1,0,1,0,0|1,0,0]=3 5978 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-7740799111 [0,1,0,1,0,0|1,0,0]=3 5979 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-9816210484 [0,1,0,1,0,0|1,0,0]=3 5980 B9R1.132 OC[C@H]1OC[C@@H]([C@@H]1O)O MCULE-2426542638 [0,1,0,1,0,0|1,0,0]=3 5981 B9R1.132 OC[C@H]1OC[C@@H]([C@H]1O)O MCULE-2697830391 [0,1,0,1,0,0|1,0,0]=3 5982 B9R1.132 OC[C@H]1OC[C@@H]([C@H]1O)O MCULE-3664631398 [0,1,0,1,0,0|1,0,0]=3 5983 B9R1.132 OC[C@H]1SC[C@@H]([C@@H]1O)O MCULE-5460809648 [0,1,0,1,0,0|1,0,0]=3 5984 B9R1.202 CC1CCCC1(C)CN MCULE-5501074724 [0,1,0,1,0,0|2,0,0]=4 5985 B9R1.202 CC1CCCC1(O)CN MCULE-5192081064 [0,1,0,1,0,0|1,0,0]=3 5986 B9R1.202 CC1CNCC1(C)CO MCULE-3212764422 [0,1,0,1,0,0|1,0,0]=3 5987 B9R1.202 CC1CNCC1(C)CO MCULE-9218006550 [0,1,0,1,0,0|1,0,0]=3 5988 B9R1.202 CC1OCCC1(O)CN MCULE-1109816284 [0,1,0,1,0,0|1,0,0]=3 5989 B9R1.1 C#CC1CCC(CC1)C MCULE-6002923209 [0,1,0,1,0,0|2,0,0]=4 5990 B9R1.1 C#CC1CCC(CC1)O MCULE-6461950655 [0,1,0,1,0,0|1,0,1]=4 5991 B9R1.1 C#C[C@H]1CC[C@@H](CC1)C MCULE-8662769226 [0,1,0,1,0,0|2,0,0]=4 5992 B9R1.1 C#C[C@H]1CC[C@@H](CC1)O MCULE-3971807040 [0,1,0,1,0,0|1,0,1]=4 5993 B9R1.1 C=C1CCC(CC1)CO MCULE-2073650564 [0,1,0,1,0,0|1,0,1]=4 5994 B9R1.1 C=C[C@H]1CC[C@@H](CC1)C MCULE-5121440754 [0,1,0,1,0,0|2,0,0]=4 5995 B9R1.1 CC1=CCC(CC1)CO MCULE-6377131123 [0,1,0,1,0,0|1,0,1]=4 5996 B9R1.1 CC1CCC(=NO)CC1 MCULE-2071848184 [0,1,0,1,0,0|1,0,1]=4 5997 B9R1.1 CC1CCC(CC1)C#N MCULE-7218488709 [0,1,0,1,0,0|2,0,0]=4 5998 B9R1.1 CC1CCC(CC1)C=O MCULE-9251304568 [0,1,0,1,0,0|1,0,1]=4 5999 B9R1.1 CC1CCC(CC1)CBr MCULE-2379495845 [0,1,0,1,0,0|2,0,0]=4 6000 B9R1.1 CC1CCC(CC1)CCl MCULE-5363729041 [0,1,0,1,0,0|2,0,0]=4 6001 B9R1.1 CC1CCC(CC1)CN MCULE-3411857424 [0,1,0,1,0,0|2,0,0]=4 6002 B9R1.1 CC1CCC(CC1)CN MCULE-7607454957 [0,1,0,1,0,0|2,0,0]=4 6003 B9R1.1 CC1CCC(CC1)CO MCULE-4775289633 [0,1,0,1,0,0|1,0,0]=3 6004 B9R1.1 CC1CCC(CC1)NN MCULE-1371911581 [0,1,0,1,0,0|2,0,0]=4 6005 B9R1.1 CC1CCC(CC1)NN MCULE-8489153821 [0,1,0,1,0,0|2,0,0]=4 6006 B9R1.1 CC1CCC(CC1)NN MCULE-9583748825 [0,1,0,1,0,0|2,0,0]=4 6007 B9R1.1 CC1CCC(CN1)C#N MCULE-5465530876 [0,1,0,1,0,0|2,0,0]=4 6008 B9R1.1 CC1CCC(CN1)C#N MCULE-5656204098 [0,1,0,1,0,0|2,0,0]=4 6009 B9R1.1 CC1CCC(CN1)CO MCULE-4885325889 [0,1,0,1,0,0|1,0,0]=3 6010 B9R1.1 CC1CCC(CN1)CO MCULE-7825916156 [0,1,0,1,0,0|1,0,0]=3 6011 B9R1.1 CC1CCC(NC1)CO MCULE-3943626768 [0,1,0,1,0,0|1,0,0]=3 6012 B9R1.1 CC1CCC(NC1)CO MCULE-6105965267 [0,1,0,1,0,0|1,0,0]=3 6013 B9R1.1 CC1CNC(CN1)CO MCULE-1614236035 [0,1,0,1,0,0|2,0,0]=4 6014 B9R1.1 CC1CNC(CN1)CO MCULE-5390030755 [0,1,0,1,0,0|2,0,0]=4 6015 B9R1.1 CC1CNC(CN1)CO MCULE-9969171906 [0,1,0,1,0,0|2,0,0]=4 6016 B9R1.1 CC1COC(CN1)CO MCULE-1554968868 [0,1,0,1,0,0|1,0,0]=3 6017 B9R1.1 CCC1CCC(CC1)C MCULE-2653372010 [0,1,0,1,0,0|2,0,0]=4 6018 B9R1.1 CCC1CCC(CC1)N MCULE-3699342075 [0,1,0,1,0,0|2,0,0]=4 6019 B9R1.1 CCC1CCC(CC1)N MCULE-8941706723 [0,1,0,1,0,0|2,0,0]=4 6020 B9R1.1 CCC1CCC(CC1)O MCULE-8097752772 [0,1,0,1,0,0|1,0,0]=3 6021 B9R1.1 CCC1CCC(NC1)C MCULE-9037446160 [0,1,0,1,0,0|2,0,0]=4 6022 B9R1.1 CCC1CNC(CO1)C MCULE-7865619397 [0,1,0,1,0,0|1,0,0]=3 6023 B9R1.1 CCC1COC(CN1)C MCULE-1901675082 [0,1,0,1,0,0|2,0,0]=4 6024 B9R1.1 CCN1CCC(CC1)N MCULE-4737186172 [0,1,0,1,0,0|2,0,0]=4 6025 B9R1.1 CCN1CCC(CC1)N MCULE-6572122139 [0,1,0,1,0,0|2,0,0]=4 6026 B9R1.1 CCN1CCC(CC1)N MCULE-9378027533 [0,1,0,1,0,0|2,0,0]=4 6027 B9R1.1 CCN1CCC(CC1)O MCULE-9813710535 [0,1,0,1,0,0|1,0,0]=3 6028 B9R1.1 CC[C@H]1CC[C@@H](CC1)N MCULE-4018920391 [0,1,0,1,0,0|2,0,0]=4 6029 B9R1.1 CC[C@H]1CC[C@@H](CC1)N MCULE-6650148008 [0,1,0,1,0,0|2,0,0]=4 6030 B9R1.1 CC[C@H]1CC[C@@H](CC1)O MCULE-2707983247 [0,1,0,1,0,0|1,0,0]=3 6031 B9R1.1 CC[C@H]1CC[C@H](CC1)N MCULE-9970355250 [0,1,0,1,0,0|2,0,0]=4 6032 B9R1.1 CC[C@H]1CC[C@H](CC1)O MCULE-2491233696 [0,1,0,1,0,0|1,0,0]=3 6033 B9R1.1 CN1CCC(CC1)CO MCULE-5079962022 [0,1,0,1,0,0|2,0,0]=4 6034 B9R1.1 CN1CCC(CC1)CO MCULE-5746614060 [0,1,0,1,0,0|2,0,0]=4 6035 B9R1.1 CN1CCC(CC1)ON MCULE-1011805273 [0,1,0,1,0,0|2,0,0]=4 6036 B9R1.1 CN1CCC(CC1)ON MCULE-7611533351 [0,1,0,1,0,0|2,0,0]=4 6037 B9R1.1 CNC1CCC(CC1)C MCULE-6239587317 [0,1,0,1,0,0|2,0,0]=4 6038 B9R1.1 CNC1CCC(CC1)F MCULE-5202352466 [0,1,0,1,0,0|2,0,0]=4 6039 B9R1.1 CNC1CCC(CC1)F MCULE-7819326865 [0,1,0,1,0,0|2,0,0]=4 6040 B9R1.1 CNC1CCC(CC1)N MCULE-4849862844 [0,1,0,1,0,0|2,0,0]=4 6041 B9R1.1 CNC1CCC(CC1)N MCULE-7202824262 [0,1,0,1,0,0|2,0,0]=4 6042 B9R1.1 CNC1CCC(CC1)N MCULE-8789561054 [0,1,0,1,0,0|2,0,0]=4 6043 B9R1.1 CNC1CCC(CC1)O MCULE-4830228871 [0,1,0,1,0,0|1,0,0]=3 6044 B9R1.1 CNC1CCC(CC1)O MCULE-6477610530 [0,1,0,1,0,0|1,0,0]=3 6045 B9R1.1 CN[C@H]1CC[C@@H](CC1)C MCULE-7736797442 [0,1,0,1,0,0|2,0,0]=4 6046 B9R1.1 CN[C@H]1CC[C@@H](CC1)C MCULE-9400644211 [0,1,0,1,0,0|2,0,0]=4 6047 B9R1.1 CN[C@H]1CC[C@@H](CC1)N MCULE-6791977848 [0,1,0,1,0,0|2,0,0]=4 6048 B9R1.1 CN[C@H]1CC[C@@H](CC1)N MCULE-6805584014 [0,1,0,1,0,0|2,0,0]=4 6049 B9R1.1 CN[C@H]1CC[C@@H](CC1)O MCULE-1022113223 [0,1,0,1,0,0|1,0,0]=3 6050 B9R1.1 CN[C@H]1CC[C@@H](CC1)O MCULE-1356433778 [0,1,0,1,0,0|1,0,0]=3 6051 B9R1.1 CN[C@H]1CC[C@H](CC1)F MCULE-3026120256 [0,1,0,1,0,0|2,0,0]=4 6052 B9R1.1 CN[C@H]1CC[C@H](CC1)F MCULE-7966777784 [0,1,0,1,0,0|2,0,0]=4 6053 B9R1.1 CN[C@H]1CC[C@H](CC1)N MCULE-1619373967 [0,1,0,1,0,0|2,0,0]=4 6054 B9R1.1 CN[C@H]1CC[C@H](CC1)O MCULE-1490699426 [0,1,0,1,0,0|1,0,0]=3 6055 B9R1.1 CN[C@H]1CC[C@H](CC1)O MCULE-7508857663 [0,1,0,1,0,0|1,0,0]=3 6056 B9R1.1 COC1=CCC(CC1)O MCULE-8647551052 [0,1,0,1,0,0|1,0,1]=4 6057 B9R1.1 COC1CCC(CC1)C MCULE-7339052202 [0,1,0,1,0,0|1,0,0]=3 6058 B9R1.1 COC1CCC(CC1)N MCULE-2795199231 [0,1,0,1,0,0|2,0,0]=4 6059 B9R1.1 COC1CCC(CC1)N MCULE-5693399345 [0,1,0,1,0,0|2,0,0]=4 6060 B9R1.1 COC1CCC(CC1)O MCULE-7486081080 [0,1,0,1,0,0|1,0,0]=3 6061 B9R1.1 COC1CCC(NC1)C MCULE-9387169751 [0,1,0,1,0,0|1,0,0]=3 6062 B9R1.1 CO[C@H]1CC[C@@H](CC1)N MCULE-7922484076 [0,1,0,1,0,0|2,0,0]=4 6063 B9R1.1 CO[C@H]1CC[C@@H](CC1)N MCULE-8209407868 [0,1,0,1,0,0|2,0,0]=4 6064 B9R1.1 CO[C@H]1CC[C@@H](CC1)O MCULE-6913861887 [0,1,0,1,0,0|1,0,0]=3 6065 B9R1.1 CO[C@H]1CC[C@H](CC1)N MCULE-4604239385 [0,1,0,1,0,0|2,0,0]=4 6066 B9R1.1 CO[C@H]1CC[C@H](CC1)N MCULE-6766317879 [0,1,0,1,0,0|2,0,0]=4 6067 B9R1.1 C[C@@H]1CC[C@@H](CN1)C#N MCULE-3340382347 [0,1,0,1,0,0|2,0,0]=4 6068 B9R1.1 C[C@@H]1CC[C@@H](CN1)C#N MCULE-7218185509 [0,1,0,1,0,0|2,0,0]=4 6069 B9R1.1 C[C@@H]1CC[C@H](CN1)CO MCULE-5971217485 [0,1,0,1,0,0|1,0,0]=3 6070 B9R1.1 C[C@@H]1CC[C@H](CN1)CO MCULE-6553308509 [0,1,0,1,0,0|1,0,0]=3 6071 B9R1.1 C[C@@H]1CC[C@H](CN1)CO MCULE-8196926230 [0,1,0,1,0,0|1,0,0]=3 6072 B9R1.1 C[C@@H]1CN[C@@H](CN1)CO MCULE-1352735683 [0,1,0,1,0,0|2,0,0]=4 6073 B9R1.1 C[C@@H]1CN[C@@H](CN1)CO MCULE-9858180760 [0,1,0,1,0,0|2,0,0]=4 6074 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-1821680880 [0,1,0,1,0,0|2,0,0]=4 6075 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-3362911354 [0,1,0,1,0,0|2,0,0]=4 6076 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-5387806502 [0,1,0,1,0,0|2,0,0]=4 6077 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-5622504658 [0,1,0,1,0,0|2,0,0]=4 6078 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-8906918574 [0,1,0,1,0,0|2,0,0]=4 6079 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-9114523826 [0,1,0,1,0,0|2,0,0]=4 6080 B9R1.1 C[C@H]1CC[C@@H](CC1)C=O MCULE-9199101836 [0,1,0,1,0,0|1,0,1]=4 6081 B9R1.1 C[C@H]1CC[C@@H](CC1)CN MCULE-5700583757 [0,1,0,1,0,0|2,0,0]=4 6082 B9R1.1 C[C@H]1CC[C@@H](CC1)CN MCULE-7874906340 [0,1,0,1,0,0|2,0,0]=4 6083 B9R1.1 C[C@H]1CC[C@@H](CC1)CO MCULE-1712721816 [0,1,0,1,0,0|1,0,0]=3 6084 B9R1.1 C[C@H]1CC[C@@H](CN1)C#N MCULE-2400500497 [0,1,0,1,0,0|2,0,0]=4 6085 B9R1.1 C[C@H]1CC[C@@H](CN1)C#N MCULE-7171157535 [0,1,0,1,0,0|2,0,0]=4 6086 B9R1.1 C[C@H]1CC[C@@H](CN1)C#N MCULE-8185817505 [0,1,0,1,0,0|2,0,0]=4 6087 B9R1.1 C[C@H]1CC[C@@H](CN1)C#N MCULE-8610394671 [0,1,0,1,0,0|2,0,0]=4 6088 B9R1.1 C[C@H]1CC[C@H](CC1)CO MCULE-8606500963 [0,1,0,1,0,0|1,0,0]=3 6089 B9R1.1 C[C@H]1CC[C@H](CN1)CO MCULE-1261345487 [0,1,0,1,0,0|1,0,0]=3 6090 B9R1.1 C[C@H]1CC[C@H](CN1)CO MCULE-5775202289 [0,1,0,1,0,0|1,0,0]=3 6091 B9R1.1 C[C@H]1CC[C@H](CN1)CO MCULE-6083345009 [0,1,0,1,0,0|1,0,0]=3 6092 B9R1.1 C[C@H]1CC[C@H](CN1)CO MCULE-6509601128 [0,1,0,1,0,0|1,0,0]=3 6093 B9R1.1 C[C@H]1CN[C@@H](CN1)CO MCULE-3337276228 [0,1,0,1,0,0|2,0,0]=4 6094 B9R1.1 C[C@H]1CN[C@@H](CN1)CO MCULE-4042671077 [0,1,0,1,0,0|2,0,0]=4 6095 B9R1.1 C[C@H]1CN[C@@H](CN1)CO MCULE-4706980610 [0,1,0,1,0,0|2,0,0]=4 6096 B9R1.1 C[C@H]1CN[C@@H](CN1)CO MCULE-6668546612 [0,1,0,1,0,0|2,0,0]=4 6097 B9R1.1 C[C@H]1CN[C@@H](CN1)CO MCULE-7908897272 [0,1,0,1,0,0|2,0,0]=4 6098 B9R1.1 FC1CCC(CC1)CBr MCULE-4243908979 [0,1,0,1,0,0|2,0,0]=4 6099 B9R1.1 N#CC1CCC(CC1)O MCULE-6628865106 [0,1,0,1,0,0|1,0,1]=4 6100 B9R1.1 N#C[C@H]1CC[C@@H](CC1)O MCULE-9374679419 [0,1,0,1,0,0|1,0,1]=4 6101 B9R1.1 NC1CCC(CC1)CF MCULE-2124685500 [0,1,0,1,0,0|2,0,0]=4 6102 B9R1.1 NC1CCC(CC1)CO MCULE-2058020777 [0,1,0,1,0,0|1,0,0]=3 6103 B9R1.1 NC1CCC(CC1)CO MCULE-9932194679 [0,1,0,1,0,0|1,0,0]=3 6104 B9R1.1 NC1CCC(OC1)CO MCULE-4245301257 [0,1,0,1,0,0|0,0,0]=2 6105 B9R1.1 NC1CCC(OC1)CO MCULE-4483575448 [0,1,0,1,0,0|0,0,0]=2 6106 B9R1.1 NCC1CCC(CC1)Cl MCULE-9608069479 [0,1,0,1,0,0|2,0,0]=4 6107 B9R1.1 NCC1CCC(CC1)F MCULE-1177099319 [0,1,0,1,0,0|2,0,0]=4 6108 B9R1.1 NCC1CCC(CC1)F MCULE-9653859754 [0,1,0,1,0,0|2,0,0]=4 6109 B9R1.1 NCC1CCC(CC1)N MCULE-1210790144 [0,1,0,1,0,0|2,0,0]=4 6110 B9R1.1 NCC1CCC(CC1)O MCULE-1773102107 [0,1,0,1,0,0|1,0,0]=3 6111 B9R1.1 NCC1CCC(CC1)O MCULE-3605496824 [0,1,0,1,0,0|1,0,0]=3 6112 B9R1.1 NCC1CCC(CO1)O MCULE-3286854000 [0,1,0,1,0,0|0,0,0]=2 6113 B9R1.1 NC[C@H]1CC[C@@H](CC1)F MCULE-2467907159 [0,1,0,1,0,0|2,0,0]=4 6114 B9R1.1 NC[C@H]1CC[C@@H](CC1)O MCULE-3725371515 [0,1,0,1,0,0|1,0,0]=3 6115 B9R1.1 NC[C@H]1CC[C@@H](CC1)O MCULE-3796180406 [0,1,0,1,0,0|1,0,0]=3 6116 B9R1.1 NC[C@H]1CC[C@H](CC1)F MCULE-8222856013 [0,1,0,1,0,0|2,0,0]=4 6117 B9R1.1 NC[C@H]1CC[C@H](CC1)F MCULE-9650435872 [0,1,0,1,0,0|2,0,0]=4 6118 B9R1.1 NC[C@H]1CC[C@H](CC1)O MCULE-6015230551 [0,1,0,1,0,0|1,0,0]=3 6119 B9R1.1 NC[C@H]1CC[C@H](CC1)O MCULE-9189660845 [0,1,0,1,0,0|1,0,0]=3 6120 B9R1.1 N[C@@H]1CC[C@H](OC1)CO MCULE-5075594203 [0,1,0,1,0,0|0,0,0]=2 6121 B9R1.1 N[C@@H]1CC[C@H](OC1)CO MCULE-6987959950 [0,1,0,1,0,0|0,0,0]=2 6122 B9R1.1 N[C@H]1CC[C@@H](CC1)CF MCULE-2967312725 [0,1,0,1,0,0|2,0,0]=4 6123 B9R1.1 N[C@H]1CC[C@@H](CC1)CF MCULE-3328650442 [0,1,0,1,0,0|2,0,0]=4 6124 B9R1.1 N[C@H]1CC[C@@H](CC1)CO MCULE-3217313684 [0,1,0,1,0,0|1,0,0]=3 6125 B9R1.1 N[C@H]1CC[C@@H](CC1)CO MCULE-5128673214 [0,1,0,1,0,0|1,0,0]=3 6126 B9R1.1 N[C@H]1CC[C@H](CC1)CF MCULE-5060717394 [0,1,0,1,0,0|2,0,0]=4 6127 B9R1.1 N[C@H]1CC[C@H](CC1)CF MCULE-5371505978 [0,1,0,1,0,0|2,0,0]=4 6128 B9R1.1 N[C@H]1CC[C@H](CC1)CO MCULE-4030751832 [0,1,0,1,0,0|1,0,0]=3 6129 B9R1.1 N[C@H]1CC[C@H](CC1)CO MCULE-7261455396 [0,1,0,1,0,0|1,0,0]=3 6130 B9R1.1 N[C@H]1CC[C@H](OC1)CO MCULE-2411909324 [0,1,0,1,0,0|0,0,0]=2 6131 B9R1.1 O=C1CCC(CC1)CO MCULE-4178685012 [0,1,0,1,0,0|1,0,1]=4 6132 B9R1.1 O=C1COC(CN1)CO MCULE-3703451145 [0,1,0,1,0,0|1,0,1]=4 6133 B9R1.1 O=C1COC(CN1)CO MCULE-5925278805 [0,1,0,1,0,0|1,0,1]=4 6134 B9R1.1 O=C1CO[C@@H](CN1)CO MCULE-1871269946 [0,1,0,1,0,0|1,0,1]=4 6135 B9R1.1 O=C1CO[C@@H](CN1)CO MCULE-9723228936 [0,1,0,1,0,0|1,0,1]=4 6136 B9R1.1 O=C1CO[C@H](CN1)CO MCULE-2317836867 [0,1,0,1,0,0|1,0,1]=4 6137 B9R1.1 O=C1CO[C@H](CN1)CO MCULE-9180023061 [0,1,0,1,0,0|1,0,1]=4 6138 B9R1.1 OC1CCC(CC1)CCl MCULE-3310167491 [0,1,0,1,0,0|1,0,0]=3 6139 B9R1.1 OCC1CCC(CC1)F MCULE-9846629385 [0,1,0,1,0,0|1,0,0]=3 6140 B9R1.1 OCC1CCC(CC1)O MCULE-2821884453 [0,1,0,1,0,0|1,0,0]=3 6141 B9R1.1 OCC1CCC(CO1)O MCULE-4333559257 [0,1,0,1,0,0|0,0,0]=2 6142 B9R1.1 OC[C@H]1CC[C@@H](CC1)O MCULE-4903112146 [0,1,0,1,0,0|1,0,0]=3 6143 B9R1.1 OC[C@H]1CC[C@H](CC1)O MCULE-5364161264 [0,1,0,1,0,0|1,0,0]=3 6144 B9R1.1 [C@@H]1(CC[C@H](NC1)C)C#N MCULE-7888499669 [0,1,0,1,0,0|2,0,0]=4 6145 B9R1.1 [C@@H]1(CC[C@H](NC1)C)C#N MCULE-8170462123 [0,1,0,1,0,0|2,0,0]=4 6146 B9R1.1 [C@@H]1(CN[C@@H](CN1)C)CC MCULE-2670537482 [0,1,0,1,0,0|2,0,0]=4 6147 B9R1.16 C=CCCCC1CC1O MCULE-3233207097 [0,1,0,1,0,0|1,0,1]=4 6148 B9R1.17 CCCCCC1CNC1 MCULE-1187200413 [0,1,0,1,0,0|2,0,0]=4 6149 B9R1.17 CCCCCC1CNC1 MCULE-2508948694 [0,1,0,1,0,0|2,0,0]=4 6150 B9R1.17 CCCCOC1CNC1 MCULE-3133093097 [0,1,0,1,0,0|2,0,0]=4 6151 B9R1.17 CCCCOC1CNC1 MCULE-3942188925 [0,1,0,1,0,0|2,0,0]=4 6152 B9R1.17 CCCOCC1CNC1 MCULE-5727289236 [0,1,0,1,0,0|2,0,0]=4 6153 B9R1.17 OCCCNC1COC1 MCULE-5500778025 [0,1,0,1,0,0|2,0,0]=4 6154 B9R1.17 OCCCOC1COC1 MCULE-4049269381 [0,1,0,1,0,0|2,0,0]=4 6155 B9R1.21 C#CC1CCC(C1)CO MCULE-1991499886 [0,1,0,1,0,0|1,0,1]=4 6156 B9R1.21 CCC1=NOC(C1)CBr MCULE-6287727929 [0,1,0,1,0,0|1,0,1]=4 6157 B9R1.21 CCC1=NOC(C1)CN MCULE-5040673048 [0,1,0,1,0,0|1,0,1]=4 6158 B9R1.21 CCC1=NOC(C1)CN MCULE-9249977340 [0,1,0,1,0,0|1,0,1]=4 6159 B9R1.21 CCN1CCC(C1)CBr MCULE-1918580849 [0,1,0,1,0,0|2,0,0]=4 6160 B9R1.21 CCN1CCC(C1)CBr MCULE-7439537548 [0,1,0,1,0,0|2,0,0]=4 6161 B9R1.21 CCN1CCC(C1)CCl MCULE-1182345117 [0,1,0,1,0,0|2,0,0]=4 6162 B9R1.21 CCN1CCC(C1)CCl MCULE-1951990523 [0,1,0,1,0,0|2,0,0]=4 6163 B9R1.21 CCN1CCC(C1)CN MCULE-7153023715 [0,1,0,1,0,0|2,0,0]=4 6164 B9R1.21 CCN1CCC(C1)CN MCULE-7742751613 [0,1,0,1,0,0|2,0,0]=4 6165 B9R1.21 CCN1CCC(C1)CO MCULE-9507301668 [0,1,0,1,0,0|1,0,0]=3 6166 B9R1.21 CCN1CC[C@@H](C1)CO MCULE-4701790174 [0,1,0,1,0,0|1,0,0]=3 6167 B9R1.21 CCN1CC[C@H](C1)CN MCULE-8044865367 [0,1,0,1,0,0|2,0,0]=4 6168 B9R1.21 CCN1CC[C@H](C1)CO MCULE-2438276159 [0,1,0,1,0,0|1,0,0]=3 6169 B9R1.21 COC1CCC(O1)OC MCULE-3806876739 [0,1,0,1,0,0|2,0,0]=4 6170 B9R1.21 CO[C@H]1CN[C@@H](C1)CO MCULE-2365069332 [0,1,0,1,0,0|2,0,0]=4 6171 B9R1.21 NCC1CCC(O1)CN MCULE-4000228398 [0,1,0,1,0,0|1,0,0]=3 6172 B9R1.21 NC[C@@H]1CC[C@@H](O1)CN MCULE-4187719094 [0,1,0,1,0,0|1,0,0]=3 6173 B9R1.21 OCC1CCC(N1)CO MCULE-1103775354 [0,1,0,1,0,0|1,0,0]=3 6174 B9R1.21 OCC1CCC(O1)CO MCULE-3334782559 [0,1,0,1,0,0|0,0,0]=2 6175 B9R1.21 OCC1CNC(C1)CO MCULE-7672485489 [0,1,0,1,0,0|2,0,0]=4 6176 B9R1.21 OCC1CNC(C1)CO MCULE-7965706550 [0,1,0,1,0,0|2,0,0]=4 6177 B9R1.21 OC[C@@H]1CC[C@@H](O1)CO MCULE-5217154467 [0,1,0,1,0,0|0,0,0]=2 6178 B9R1.79 NC(CO)CC1CCC1 MCULE-2309333579 [0,1,0,1,0,0|1,0,0]=3 6179 B9R1.79 NC(CO)CC1CCC1 MCULE-6676177211 [0,1,0,1,0,0|1,0,0]=3 6180 B9R1.79 NCC(F)CC1CCC1 MCULE-6989081385 [0,1,0,1,0,0|2,0,0]=4 6181 B9R1.79 NCC(F)CC1CCC1 MCULE-8217653310 [0,1,0,1,0,0|2,0,0]=4 6182 B9R1.80 CCC(C)CNC1CC1 MCULE-2512139294 [0,1,0,1,0,0|2,0,0]=4 6183 B9R1.80 CCC(C)CNC1CC1 MCULE-4348094564 [0,1,0,1,0,0|2,0,0]=4 6184 B9R1.80 CCC(C)NCC1CC1 MCULE-5989144815 [0,1,0,1,0,0|2,0,0]=4 6185 B9R1.89 BrCC1CCCCCC1 MCULE-3804149088 [0,1,0,1,0,0|2,0,0]=4 6186 B9R1.89 BrCC1COCCOC1 MCULE-6221292036 [0,1,0,1,0,0|2,0,0]=4 6187 B9R1.89 BrCC1OCCCCO1 MCULE-3435142846 [0,1,0,1,0,0|1,0,0]=3 6188 B9R1.89 C#CC1CCCCCC1 MCULE-7810681377 [0,1,0,1,0,0|2,0,0]=4 6189 B9R1.89 C#CC1CCCCNC1 MCULE-1408244571 [0,1,0,1,0,0|2,0,0]=4 6190 B9R1.89 C#CC1CCCCNC1 MCULE-8428822099 [0,1,0,1,0,0|2,0,0]=4 6191 B9R1.89 CCC1CCCCCN1 MCULE-9043964617 [0,1,0,1,0,0|2,0,0]=4 6192 B9R1.89 CCC1CCCNCC1 MCULE-1208066309 [0,1,0,1,0,0|2,0,0]=4 6193 B9R1.89 CCC1CNCCCO1 MCULE-5736441757 [0,1,0,1,0,0|1,0,0]=3 6194 B9R1.89 CCC1CNCCOC1 MCULE-8196044665 [0,1,0,1,0,0|2,0,0]=4 6195 B9R1.89 CNC1CCCCCC1 MCULE-3477928342 [0,1,0,1,0,0|2,0,0]=4 6196 B9R1.89 CNC1CCCCCC1 MCULE-9182986806 [0,1,0,1,0,0|2,0,0]=4 6197 B9R1.89 CNC1CCCCNC1 MCULE-4863452887 [0,1,0,1,0,0|2,0,0]=4 6198 B9R1.89 COC1CCCNCC1 MCULE-3865112637 [0,1,0,1,0,0|2,0,0]=4 6199 B9R1.89 COC1CCCNCC1 MCULE-8695975811 [0,1,0,1,0,0|2,0,0]=4 6200 B9R1.89 COC1CNCCNC1 MCULE-1833812784 [0,1,0,1,0,0|2,0,0]=4 6201 B9R1.89 COC1CNCCNC1 MCULE-7875554019 [0,1,0,1,0,0|2,0,0]=4 6202 B9R1.89 CO[C@@H]1CCCNCC1 MCULE-7843793451 [0,1,0,1,0,0|2,0,0]=4 6203 B9R1.89 CO[C@@H]1CCCNCC1 MCULE-8658047616 [0,1,0,1,0,0|2,0,0]=4 6204 B9R1.89 CO[C@H]1CCCNCC1 MCULE-3812820732 [0,1,0,1,0,0|2,0,0]=4 6205 B9R1.89 CO[C@H]1CCCNCC1 MCULE-5564803880 [0,1,0,1,0,0|2,0,0]=4 6206 B9R1.89 CO[C@H]1CCCNCC1 MCULE-7219983991 [0,1,0,1,0,0|2,0,0]=4 6207 B9R1.89 CO[C@H]1CCCNCC1 MCULE-9051418657 [0,1,0,1,0,0|2,0,0]=4 6208 B9R1.89 ClCC1CCCCCN1 MCULE-7509075716 [0,1,0,1,0,0|2,0,0]=4 6209 B9R1.89 ClCC1CCCCCN1 MCULE-9950332690 [0,1,0,1,0,0|2,0,0]=4 6210 B9R1.89 ClCC1SCCCCS1 MCULE-2929531834 [0,1,0,1,0,0|1,1,0]=4 6211 B9R1.89 FCC1CCNCCO1 MCULE-2885724612 [0,1,0,1,0,0|1,0,0]=3 6212 B9R1.89 FCC1CCNCCO1 MCULE-5255949130 [0,1,0,1,0,0|1,0,0]=3 6213 B9R1.89 FCC1CNCCCO1 MCULE-4304507356 [0,1,0,1,0,0|1,0,0]=3 6214 B9R1.89 FCC1CNCCCO1 MCULE-5204425397 [0,1,0,1,0,0|1,0,0]=3 6215 B9R1.89 ICC1CCCCCO1 MCULE-8717458528 [0,1,0,1,0,0|1,0,0]=3 6216 B9R1.89 N#CC1CCCCCC1 MCULE-4572641162 [0,1,0,1,0,0|2,0,0]=4 6217 B9R1.89 N#CC1CCCCNC1 MCULE-5438753302 [0,1,0,1,0,0|2,0,0]=4 6218 B9R1.89 N#CC1CCCCNC1 MCULE-9604206710 [0,1,0,1,0,0|2,0,0]=4 6219 B9R1.89 NCC1CCCCCC1 MCULE-6071072186 [0,1,0,1,0,0|2,0,0]=4 6220 B9R1.89 NCC1CCCCCC1 MCULE-8981470928 [0,1,0,1,0,0|2,0,0]=4 6221 B9R1.89 NCC1CCCCNC1 MCULE-7705035602 [0,1,0,1,0,0|2,0,0]=4 6222 B9R1.89 NCC1CCCCNC1 MCULE-8170909949 [0,1,0,1,0,0|2,0,0]=4 6223 B9R1.89 NNC1CCCCCC1 MCULE-1821259900 [0,1,0,1,0,0|2,0,0]=4 6224 B9R1.89 NNC1CCCCCC1 MCULE-6325204009 [0,1,0,1,0,0|2,0,0]=4 6225 B9R1.89 NNC1CCCCCC1 MCULE-7894671218 [0,1,0,1,0,0|2,0,0]=4 6226 B9R1.89 O=CC1CCCCCC1 MCULE-2750232256 [0,1,0,1,0,0|1,0,1]=4 6227 B9R1.89 O=CC1COCCOC1 MCULE-8006105385 [0,1,0,1,0,0|1,0,1]=4 6228 B9R1.89 OCC1CCC=CCC1 MCULE-1974756879 [0,1,0,1,0,0|1,0,1]=4 6229 B9R1.89 OCC1CCCCCC1 MCULE-1749370417 [0,1,0,1,0,0|1,0,0]=3 6230 B9R1.89 OCC1CCCCCC1 MCULE-2629813419 [0,1,0,1,0,0|1,0,0]=3 6231 B9R1.89 OCC1CCCCCN1 MCULE-1586506984 [0,1,0,1,0,0|1,0,0]=3 6232 B9R1.89 OCC1CCCCNC1 MCULE-1649629703 [0,1,0,1,0,0|1,0,0]=3 6233 B9R1.89 OCC1CCCCNC1 MCULE-6297064506 [0,1,0,1,0,0|1,0,0]=3 6234 B9R1.89 OCC1CCCNCC1 MCULE-1276268438 [0,1,0,1,0,0|1,0,0]=3 6235 B9R1.89 OCC1CCCNCC1 MCULE-6937244427 [0,1,0,1,0,0|1,0,0]=3 6236 B9R1.89 OCC1CCNCCO1 MCULE-9176508562 [0,1,0,1,0,0|0,0,0]=2 6237 B9R1.89 OCC1CNCCCO1 MCULE-7903525804 [0,1,0,1,0,0|0,0,0]=2 6238 B9R1.89 OCC1CNCCCO1 MCULE-9908272497 [0,1,0,1,0,0|0,0,0]=2 6239 B9R1.89 OCC1CNCCOC1 MCULE-9049672869 [0,1,0,1,0,0|1,0,0]=3 6240 B9R1.89 OCC1COCCOC1 MCULE-3330785002 [0,1,0,1,0,0|1,0,0]=3 6241 B9R1.89 OC[C@@H]1CCCCCN1 MCULE-3068262302 [0,1,0,1,0,0|1,0,0]=3 6242 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-3544932007 [0,1,0,1,0,0|0,0,0]=2 6243 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-4726628241 [0,1,0,1,0,0|0,0,0]=2 6244 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-5225680882 [0,1,0,1,0,0|0,0,0]=2 6245 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-5475510815 [0,1,0,1,0,0|0,0,0]=2 6246 B9R1.89 OC[C@H]1CNCCCO1 MCULE-2922219127 [0,1,0,1,0,0|0,0,0]=2 6247 B9R1.89 OC[C@H]1CNCCCO1 MCULE-3177968218 [0,1,0,1,0,0|0,0,0]=2 6248 B9R1.89 OC[C@H]1CNCCCO1 MCULE-3793527665 [0,1,0,1,0,0|0,0,0]=2 6249 B9R1.89 OC[C@H]1CNCCCO1 MCULE-7260252629 [0,1,0,1,0,0|0,0,0]=2 6250 B9R1.89 ON=C1CCCCCC1 MCULE-4992018002 [0,1,0,1,0,0|1,0,1]=4 6251 B9R1.118 C#CC1(CCCCC1)O MCULE-8943429628 [0,1,0,1,0,0|1,0,1]=4 6252 B9R1.118 C#CC1(CCCOC1)O MCULE-6315759535 [0,1,0,1,0,0|1,0,1]=4 6253 B9R1.118 C#CC1(CCNCC1)O MCULE-7283234495 [0,1,0,1,0,0|1,0,1]=4 6254 B9R1.118 C#CC1(CCNCC1)O MCULE-9532622997 [0,1,0,1,0,0|1,0,1]=4 6255 B9R1.118 C#CC1(CCOCC1)O MCULE-4446957816 [0,1,0,1,0,0|1,0,1]=4 6256 B9R1.118 C=CC1(CCCCC1)O MCULE-7521116261 [0,1,0,1,0,0|1,0,1]=4 6257 B9R1.118 C=CC1(CCOCC1)O MCULE-1347861395 [0,1,0,1,0,0|1,0,1]=4 6258 B9R1.118 CC1(CC=CCC1)CO MCULE-9048517900 [0,1,0,1,0,0|1,0,1]=4 6259 B9R1.118 CC1(CCCCC1)CBr MCULE-2357240305 [0,1,0,1,0,0|2,0,0]=4 6260 B9R1.118 CC1(CCCCC1)CCl MCULE-9584097812 [0,1,0,1,0,0|2,0,0]=4 6261 B9R1.118 CC1(CCCCC1)CN MCULE-1723013704 [0,1,0,1,0,0|2,0,0]=4 6262 B9R1.118 CC1(CCCCC1)CO MCULE-7082905261 [0,1,0,1,0,0|1,0,0]=3 6263 B9R1.118 CC1(CCCCC1)CS MCULE-4716166156 [0,1,0,1,0,0|1,1,0]=4 6264 B9R1.118 CC1(CCCCN1)CO MCULE-2480758252 [0,1,0,1,0,0|1,0,0]=3 6265 B9R1.118 CC1(CCCCN1)CO MCULE-4992390900 [0,1,0,1,0,0|1,0,0]=3 6266 B9R1.118 CC1(CCCCO1)C#N MCULE-3641647056 [0,1,0,1,0,0|1,0,1]=4 6267 B9R1.118 CC1(CCCCO1)C=O MCULE-9760251174 [0,1,0,1,0,0|0,0,2]=4 6268 B9R1.118 CC1(CCCCO1)CN MCULE-4399570168 [0,1,0,1,0,0|1,0,0]=3 6269 B9R1.118 CC1(CCCCO1)CO MCULE-1474953219 [0,1,0,1,0,0|0,0,0]=2 6270 B9R1.118 CC1(CCCNC1)CN MCULE-1720695404 [0,1,0,1,0,0|2,0,0]=4 6271 B9R1.118 CC1(CCCNC1)CO MCULE-7859652987 [0,1,0,1,0,0|1,0,0]=3 6272 B9R1.118 CC1(CCCNC1)CO MCULE-9138617665 [0,1,0,1,0,0|1,0,0]=3 6273 B9R1.118 CC1(CCCOC1)CN MCULE-3404174774 [0,1,0,1,0,0|2,0,0]=4 6274 B9R1.118 CC1(CCCOC1)CO MCULE-5818698089 [0,1,0,1,0,0|1,0,0]=3 6275 B9R1.118 CC1(CCNCC1)CO MCULE-4193945417 [0,1,0,1,0,0|1,0,0]=3 6276 B9R1.118 CC1(CCNCC1)CO MCULE-6270876419 [0,1,0,1,0,0|1,0,0]=3 6277 B9R1.118 CC1(CCOCC1)CN MCULE-3479710651 [0,1,0,1,0,0|2,0,0]=4 6278 B9R1.118 CC1(CCOCC1)CN MCULE-7911793310 [0,1,0,1,0,0|2,0,0]=4 6279 B9R1.118 CC1(CCOCC1)CO MCULE-5535447172 [0,1,0,1,0,0|1,0,0]=3 6280 B9R1.118 CC1(CNCCN1)CO MCULE-1439368478 [0,1,0,1,0,0|2,0,0]=4 6281 B9R1.118 CC1(COCCN1)CO MCULE-1204894568 [0,1,0,1,0,0|2,0,0]=4 6282 B9R1.118 CC1(COCCO1)CBr MCULE-4911805523 [0,1,0,1,0,0|2,0,0]=4 6283 B9R1.118 CC1(COCCO1)CI MCULE-1114871153 [0,1,0,1,0,0|2,0,0]=4 6284 B9R1.118 CC1(COCCO1)CN MCULE-3869931142 [0,1,0,1,0,0|2,0,0]=4 6285 B9R1.118 CC1(COCCO1)CN MCULE-6966689189 [0,1,0,1,0,0|2,0,0]=4 6286 B9R1.118 CC1(COCCO1)CO MCULE-2402682578 [0,1,0,1,0,0|1,0,0]=3 6287 B9R1.118 CC1(COCOC1)CO MCULE-8507884308 [0,1,0,1,0,0|2,0,0]=4 6288 B9R1.118 CC1(OCCCO1)CN MCULE-9244283541 [0,1,0,1,0,0|2,0,0]=4 6289 B9R1.118 CCC1(CCCCC1)Cl MCULE-5513648578 [0,1,0,1,0,0|2,0,0]=4 6290 B9R1.118 CCC1(CCCCC1)N MCULE-3886661042 [0,1,0,1,0,0|2,0,0]=4 6291 B9R1.118 CCC1(CCCCC1)N MCULE-3921643203 [0,1,0,1,0,0|2,0,0]=4 6292 B9R1.118 CCC1(CCCCC1)O MCULE-9314704343 [0,1,0,1,0,0|1,0,0]=3 6293 B9R1.118 CCC1(CCCNC1)C MCULE-4065109647 [0,1,0,1,0,0|2,0,0]=4 6294 B9R1.118 CCC1(CCCNC1)C MCULE-8427718856 [0,1,0,1,0,0|2,0,0]=4 6295 B9R1.118 CCC1(CCCNC1)O MCULE-2359766186 [0,1,0,1,0,0|1,0,0]=3 6296 B9R1.118 CCC1(CCCNC1)O MCULE-4654641315 [0,1,0,1,0,0|1,0,0]=3 6297 B9R1.118 CCC1(CCNCC1)C MCULE-1372117738 [0,1,0,1,0,0|2,0,0]=4 6298 B9R1.118 CCC1(CCNCC1)C MCULE-3368880341 [0,1,0,1,0,0|2,0,0]=4 6299 B9R1.118 CCC1(CCNCC1)N MCULE-3050005338 [0,1,0,1,0,0|2,0,0]=4 6300 B9R1.118 CCC1(CCNCC1)N MCULE-6047230311 [0,1,0,1,0,0|2,0,0]=4 6301 B9R1.118 CCC1(CCNCC1)O MCULE-5103122746 [0,1,0,1,0,0|1,0,0]=3 6302 B9R1.118 CCC1(CCNCC1)O MCULE-8900140051 [0,1,0,1,0,0|1,0,0]=3 6303 B9R1.118 CCC1(CCOCC1)N MCULE-3790819064 [0,1,0,1,0,0|2,0,0]=4 6304 B9R1.118 CCC1(CCOCC1)N MCULE-5690381602 [0,1,0,1,0,0|2,0,0]=4 6305 B9R1.118 CCC1(CNCCO1)C MCULE-8570332066 [0,1,0,1,0,0|2,0,0]=4 6306 B9R1.118 C[C@@]1(CCCNC1)CO MCULE-2002234086 [0,1,0,1,0,0|1,0,0]=3 6307 B9R1.118 C[C@@]1(CCCNC1)CO MCULE-7671897310 [0,1,0,1,0,0|1,0,0]=3 6308 B9R1.118 FC1(CCCCC1)CBr MCULE-6400317289 [0,1,0,1,0,0|2,0,0]=4 6309 B9R1.118 FC1(CCOCC1)CBr MCULE-2691031242 [0,1,0,1,0,0|2,0,0]=4 6310 B9R1.118 N#CC1(CCCCC1)O MCULE-5791427313 [0,1,0,1,0,0|1,0,1]=4 6311 B9R1.118 N#CC1(CCCNC1)O MCULE-2572229172 [0,1,0,1,0,0|1,0,1]=4 6312 B9R1.118 N#CC1(CCCNC1)O MCULE-7780369642 [0,1,0,1,0,0|1,0,1]=4 6313 B9R1.118 N#CC1(CCNCC1)O MCULE-1294968081 [0,1,0,1,0,0|1,0,1]=4 6314 B9R1.118 N#CC1(CCNCC1)O MCULE-9444608414 [0,1,0,1,0,0|1,0,1]=4 6315 B9R1.118 N#CC1(CCOCC1)O MCULE-9380009767 [0,1,0,1,0,0|1,0,1]=4 6316 B9R1.118 NC1(CCCCC1)CO MCULE-5010483791 [0,1,0,1,0,0|1,0,0]=3 6317 B9R1.118 NC1(CCCCC1)CO MCULE-9568898546 [0,1,0,1,0,0|1,0,0]=3 6318 B9R1.118 NC1(CCNCC1)CO MCULE-4957450788 [0,1,0,1,0,0|1,0,0]=3 6319 B9R1.118 NC1(CCNCC1)CO MCULE-8808091761 [0,1,0,1,0,0|1,0,0]=3 6320 B9R1.118 NC1(CCOCC1)CF MCULE-6182015014 [0,1,0,1,0,0|2,0,0]=4 6321 B9R1.118 NC1(CCOCC1)CF MCULE-7419811491 [0,1,0,1,0,0|2,0,0]=4 6322 B9R1.118 NC1(CCOCC1)CO MCULE-5523370445 [0,1,0,1,0,0|1,0,0]=3 6323 B9R1.118 NC1(CCOCC1)CO MCULE-7081316740 [0,1,0,1,0,0|1,0,0]=3 6324 B9R1.118 NC1(CCSCC1)CO MCULE-3751635501 [0,1,0,1,0,0|1,0,0]=3 6325 B9R1.118 NC1(CCSCC1)CO MCULE-5887780207 [0,1,0,1,0,0|1,0,0]=3 6326 B9R1.118 NCC1(C=CCCC1)O MCULE-1781105765 [0,1,0,1,0,0|1,0,1]=4 6327 B9R1.118 NCC1(CCCCC1)F MCULE-7965775019 [0,1,0,1,0,0|2,0,0]=4 6328 B9R1.118 NCC1(CCCCC1)F MCULE-8275233201 [0,1,0,1,0,0|2,0,0]=4 6329 B9R1.118 NCC1(CCCCC1)N MCULE-1440012619 [0,1,0,1,0,0|2,0,0]=4 6330 B9R1.118 NCC1(CCCCC1)N MCULE-4904885698 [0,1,0,1,0,0|2,0,0]=4 6331 B9R1.118 NCC1(CCCCC1)N MCULE-5203944425 [0,1,0,1,0,0|2,0,0]=4 6332 B9R1.118 NCC1(CCCCC1)O MCULE-2235926257 [0,1,0,1,0,0|1,0,0]=3 6333 B9R1.118 NCC1(CCCCC1)O MCULE-3554445977 [0,1,0,1,0,0|1,0,0]=3 6334 B9R1.118 NCC1(CCCOC1)O MCULE-3380684017 [0,1,0,1,0,0|1,0,0]=3 6335 B9R1.118 NCC1(CCNCC1)O MCULE-2751818260 [0,1,0,1,0,0|1,0,0]=3 6336 B9R1.118 NCC1(CCOCC1)F MCULE-7380103518 [0,1,0,1,0,0|2,0,0]=4 6337 B9R1.118 NCC1(CCOCC1)F MCULE-8300593860 [0,1,0,1,0,0|2,0,0]=4 6338 B9R1.118 NCC1(CCOCC1)N MCULE-8014068638 [0,1,0,1,0,0|2,0,0]=4 6339 B9R1.118 NCC1(CCOCC1)O MCULE-2766533080 [0,1,0,1,0,0|1,0,0]=3 6340 B9R1.118 NCC1(CCOCC1)O MCULE-9208911413 [0,1,0,1,0,0|1,0,0]=3 6341 B9R1.118 NCC1(CCSCC1)O MCULE-9397305788 [0,1,0,1,0,0|1,0,0]=3 6342 B9R1.118 OC1(CCCCC1)CBr MCULE-3269466977 [0,1,0,1,0,0|1,0,0]=3 6343 B9R1.118 OC1(CCCNC1)CF MCULE-8890034237 [0,1,0,1,0,0|1,0,0]=3 6344 B9R1.118 OC1(CCCNC1)CF MCULE-9294734195 [0,1,0,1,0,0|1,0,0]=3 6345 B9R1.118 OC1(CCNCC1)CF MCULE-5603599172 [0,1,0,1,0,0|1,0,0]=3 6346 B9R1.118 OC1(CCNCC1)CF MCULE-7125873306 [0,1,0,1,0,0|1,0,0]=3 6347 B9R1.118 OC1(CCOCC1)CBr MCULE-2440342395 [0,1,0,1,0,0|1,0,0]=3 6348 B9R1.118 OCC1(CCCCC1)F MCULE-6893319227 [0,1,0,1,0,0|1,0,0]=3 6349 B9R1.118 OCC1(CCCCC1)O MCULE-4401054903 [0,1,0,1,0,0|0,0,0]=2 6350 B9R1.118 OCC1(CCCCC1)S MCULE-4689452330 [0,1,0,1,0,0|0,1,0]=3 6351 B9R1.118 OCC1(CCCNC1)F MCULE-1604953146 [0,1,0,1,0,0|1,0,0]=3 6352 B9R1.118 OCC1(CCCNC1)F MCULE-2701254971 [0,1,0,1,0,0|1,0,0]=3 6353 B9R1.118 OCC1(CCCNC1)O MCULE-2181561679 [0,1,0,1,0,0|0,0,0]=2 6354 B9R1.118 OCC1(CCCNC1)O MCULE-5468132031 [0,1,0,1,0,0|0,0,0]=2 6355 B9R1.118 OCC1(CCCOC1)F MCULE-7902519614 [0,1,0,1,0,0|1,0,0]=3 6356 B9R1.118 OCC1(CCNCC1)F MCULE-1911530330 [0,1,0,1,0,0|1,0,0]=3 6357 B9R1.118 OCC1(CCNCC1)F MCULE-6594830680 [0,1,0,1,0,0|1,0,0]=3 6358 B9R1.118 OCC1(CCNCC1)O MCULE-5825046102 [0,1,0,1,0,0|0,0,0]=2 6359 B9R1.118 OCC1(CCNCC1)O MCULE-9697641993 [0,1,0,1,0,0|0,0,0]=2 6360 B9R1.118 OCC1(CCOCC1)F MCULE-6397920040 [0,1,0,1,0,0|1,0,0]=3 6361 B9R1.118 OCC1(CCOCC1)O MCULE-9700422902 [0,1,0,1,0,0|0,0,0]=2 6362 B9R1.118 OCC1(CCSCC1)O MCULE-9917132643 [0,1,0,1,0,0|0,0,0]=2 6363 B9R1.118 OC[C@@]1(CCCNC1)F MCULE-1828463699 [0,1,0,1,0,0|1,0,0]=3 6364 B9R1.118 OC[C@]1(CCCNC1)F MCULE-1994723738 [0,1,0,1,0,0|1,0,0]=3 6365 B9R1.118 OC[C@]1(CCCNC1)F MCULE-5822647493 [0,1,0,1,0,0|1,0,0]=3 6366 B9R1.118 OC[C@]1(CCCNC1)F MCULE-6498345493 [0,1,0,1,0,0|1,0,0]=3 6367 B9R1.118 OC[C@]1(CCCNC1)F MCULE-7704795376 [0,1,0,1,0,0|1,0,0]=3 6368 B9R1.6 CC(=O)C1CCCCO1 MCULE-6292051941 [0,1,0,1,0,0|0,0,2]=4 6369 B9R1.6 CC(Br)C1CCCCC1 MCULE-5485461450 [0,1,0,1,0,0|2,0,0]=4 6370 B9R1.6 CC(C)C1CCCCC1 MCULE-6669359076 [0,1,0,1,0,0|2,0,0]=4 6371 B9R1.6 CC(C)C1CCCCN1 MCULE-3649476695 [0,1,0,1,0,0|2,0,0]=4 6372 B9R1.6 CC(C)C1CCCCN1 MCULE-8304532068 [0,1,0,1,0,0|2,0,0]=4 6373 B9R1.6 CC(C)C1CNCCO1 MCULE-1548709816 [0,1,0,1,0,0|2,0,0]=4 6374 B9R1.6 CC(C)C1CNCCO1 MCULE-3698866028 [0,1,0,1,0,0|2,0,0]=4 6375 B9R1.6 CC(C)C1OCCCO1 MCULE-5024002070 [0,1,0,1,0,0|2,0,0]=4 6376 B9R1.6 CC(C)[C@@H]1CNCCO1 MCULE-4730564774 [0,1,0,1,0,0|2,0,0]=4 6377 B9R1.6 CC(C)[C@@H]1CNCCO1 MCULE-6895424671 [0,1,0,1,0,0|2,0,0]=4 6378 B9R1.6 CC(C)[C@H]1CNCCO1 MCULE-6888809992 [0,1,0,1,0,0|2,0,0]=4 6379 B9R1.6 CC(C)[C@H]1CNCCO1 MCULE-8313613560 [0,1,0,1,0,0|2,0,0]=4 6380 B9R1.6 CC(N)C1CCCCC1 MCULE-1505914332 [0,1,0,1,0,0|2,0,0]=4 6381 B9R1.6 CC(N)C1CCCCC1 MCULE-2391650892 [0,1,0,1,0,0|2,0,0]=4 6382 B9R1.6 CC(N)C1CCCCC1 MCULE-4413711215 [0,1,0,1,0,0|2,0,0]=4 6383 B9R1.6 CC(N)C1CCCCN1 MCULE-2177574791 [0,1,0,1,0,0|2,0,0]=4 6384 B9R1.6 CC(N)C1CCCCO1 MCULE-8387374309 [0,1,0,1,0,0|1,0,0]=3 6385 B9R1.6 CC(N)C1CCCCO1 MCULE-9971513933 [0,1,0,1,0,0|1,0,0]=3 6386 B9R1.6 CC(O)C1CCCCC1 MCULE-5078012753 [0,1,0,1,0,0|1,0,0]=3 6387 B9R1.6 CC(O)C1CCCCN1 MCULE-2559324365 [0,1,0,1,0,0|1,0,0]=3 6388 B9R1.6 CC(O)C1CCCNC1 MCULE-2671166499 [0,1,0,1,0,0|2,0,0]=4 6389 B9R1.6 CC(O)C1CCCNC1 MCULE-3528761801 [0,1,0,1,0,0|2,0,0]=4 6390 B9R1.6 CC(O)C1CCNCC1 MCULE-4584203332 [0,1,0,1,0,0|2,0,0]=4 6391 B9R1.6 CC(O)C1CCNCC1 MCULE-5499145407 [0,1,0,1,0,0|2,0,0]=4 6392 B9R1.6 CC(O)C1CCNCC1 MCULE-6172957789 [0,1,0,1,0,0|2,0,0]=4 6393 B9R1.6 CC(O)C1CCNCC1 MCULE-9287143291 [0,1,0,1,0,0|2,0,0]=4 6394 B9R1.6 CC(O)C1CCOCC1 MCULE-9618372743 [0,1,0,1,0,0|2,0,0]=4 6395 B9R1.6 CC(O)C1CNCCN1 MCULE-7562437820 [0,1,0,1,0,0|2,0,0]=4 6396 B9R1.6 CC(O)C1CNCCO1 MCULE-5611108274 [0,1,0,1,0,0|1,0,0]=3 6397 B9R1.6 CC(S)C1CCCCC1 MCULE-3622234308 [0,1,0,1,0,0|1,1,0]=4 6398 B9R1.6 CN(C)C1CCCCO1 MCULE-4888978458 [0,1,0,1,0,0|2,0,0]=4 6399 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-3071844374 [0,1,0,1,0,0|2,0,0]=4 6400 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-6526660266 [0,1,0,1,0,0|2,0,0]=4 6401 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-8321480556 [0,1,0,1,0,0|2,0,0]=4 6402 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-8767179050 [0,1,0,1,0,0|2,0,0]=4 6403 B9R1.6 C[C@@H](N)C1CCCCO1 MCULE-3320469003 [0,1,0,1,0,0|1,0,0]=3 6404 B9R1.6 C[C@@H](N)C1CCCCO1 MCULE-9895193081 [0,1,0,1,0,0|1,0,0]=3 6405 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-4304404236 [0,1,0,1,0,0|1,0,0]=3 6406 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-7854211857 [0,1,0,1,0,0|1,0,0]=3 6407 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-1752623068 [0,1,0,1,0,0|2,0,0]=4 6408 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-2316047131 [0,1,0,1,0,0|2,0,0]=4 6409 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-9451593770 [0,1,0,1,0,0|2,0,0]=4 6410 B9R1.6 C[C@@H](O)C1CCOCC1 MCULE-1246138653 [0,1,0,1,0,0|2,0,0]=4 6411 B9R1.6 C[C@@H](O)C1CCOCC1 MCULE-5178620559 [0,1,0,1,0,0|2,0,0]=4 6412 B9R1.6 C[C@@H](O)[C@H]1CNCCN1 MCULE-2168214783 [0,1,0,1,0,0|2,0,0]=4 6413 B9R1.6 C[C@@H](O)[C@H]1CNCCN1 MCULE-8290718551 [0,1,0,1,0,0|2,0,0]=4 6414 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-1031735669 [0,1,0,1,0,0|2,0,0]=4 6415 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-3061879771 [0,1,0,1,0,0|2,0,0]=4 6416 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-7933942708 [0,1,0,1,0,0|2,0,0]=4 6417 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-8070329731 [0,1,0,1,0,0|2,0,0]=4 6418 B9R1.6 C[C@H](O)C1CCCCC1 MCULE-9702860419 [0,1,0,1,0,0|1,0,0]=3 6419 B9R1.6 C[C@H](O)C1CCNCC1 MCULE-2198012011 [0,1,0,1,0,0|2,0,0]=4 6420 B9R1.6 C[C@H](O)C1CCNCC1 MCULE-7131345979 [0,1,0,1,0,0|2,0,0]=4 6421 B9R1.6 C[C@H](O)C1CCOCC1 MCULE-4135856134 [0,1,0,1,0,0|2,0,0]=4 6422 B9R1.6 FC(F)C1CCCCN1 MCULE-6330116488 [0,1,0,1,0,0|2,0,0]=4 6423 B9R1.6 FC(F)C1CCCCN1 MCULE-6975833618 [0,1,0,1,0,0|2,0,0]=4 6424 B9R1.6 FC(F)C1CNCCO1 MCULE-3085847203 [0,1,0,1,0,0|2,0,0]=4 6425 B9R1.6 FC(F)C1CNCCO1 MCULE-7955903734 [0,1,0,1,0,0|2,0,0]=4 6426 B9R1.6 O=C(Cl)C1CCCCO1 MCULE-2871405989 [0,1,0,1,0,0|0,0,2]=4 6427 B9R1.6 O=C(O)C1CCCCC1 MCULE-2193918964 [0,1,0,1,0,0|1,0,1]=4 6428 B9R1.6 O=C(O)C1CCCCN1 MCULE-3485439173 [0,1,0,1,0,0|1,0,1]=4 6429 B9R1.6 O=C(O)C1CCCCN1 MCULE-4576094783 [0,1,0,1,0,0|1,0,1]=4 6430 B9R1.6 O=C(O)C1CCCCN1 MCULE-4851525706 [0,1,0,1,0,0|1,0,1]=4 6431 B9R1.6 O=C(O)C1CCCCN1 MCULE-6801625058 [0,1,0,1,0,0|1,0,1]=4 6432 B9R1.6 O=C(O)C1CCCCO1 MCULE-8947688342 [0,1,0,1,0,0|0,0,1]=3 6433 B9R1.6 O=C(O)C1CCCCS1 MCULE-6466357833 [0,1,0,1,0,0|0,1,1]=4 6434 B9R1.6 O=C(O)C1CNCCO1 MCULE-1106448255 [0,1,0,1,0,0|1,0,1]=4 6435 B9R1.6 O=C(O)C1CNCCO1 MCULE-5402647836 [0,1,0,1,0,0|1,0,1]=4 6436 B9R1.6 O=C(O)C1CNCCO1 MCULE-5647993069 [0,1,0,1,0,0|1,0,1]=4 6437 B9R1.6 O=C(O)C1CNCCO1 MCULE-6949638629 [0,1,0,1,0,0|1,0,1]=4 6438 B9R1.6 O=C(O)C1COCCO1 MCULE-3887767361 [0,1,0,1,0,0|1,0,1]=4 6439 B9R1.6 O=C(O)C1COCCO1 MCULE-6027603960 [0,1,0,1,0,0|1,0,1]=4 6440 B9R1.6 O=C(O)C1OCCCO1 MCULE-6505925267 [0,1,0,1,0,0|1,0,1]=4 6441 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-3257537289 [0,1,0,1,0,0|1,0,1]=4 6442 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-7236775885 [0,1,0,1,0,0|1,0,1]=4 6443 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-8859089797 [0,1,0,1,0,0|1,0,1]=4 6444 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-9674307172 [0,1,0,1,0,0|1,0,1]=4 6445 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-4995364653 [0,1,0,1,0,0|0,0,1]=3 6446 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-8767901302 [0,1,0,1,0,0|0,0,1]=3 6447 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-3078161658 [0,1,0,1,0,0|1,0,1]=4 6448 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-4550123668 [0,1,0,1,0,0|1,0,1]=4 6449 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7218215777 [0,1,0,1,0,0|1,0,1]=4 6450 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7983160968 [0,1,0,1,0,0|1,0,1]=4 6451 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-3560012987 [0,1,0,1,0,0|1,0,1]=4 6452 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-8883141087 [0,1,0,1,0,0|1,0,1]=4 6453 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8281618311 [0,1,0,1,0,0|1,0,1]=4 6454 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8486513131 [0,1,0,1,0,0|1,0,1]=4 6455 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9333123477 [0,1,0,1,0,0|1,0,1]=4 6456 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9786740249 [0,1,0,1,0,0|1,0,1]=4 6457 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-2856988466 [0,1,0,1,0,0|0,0,1]=3 6458 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-8960602925 [0,1,0,1,0,0|0,0,1]=3 6459 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-1051281674 [0,1,0,1,0,0|1,0,1]=4 6460 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-2477891803 [0,1,0,1,0,0|1,0,1]=4 6461 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-5182952887 [0,1,0,1,0,0|1,0,1]=4 6462 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-6051376580 [0,1,0,1,0,0|1,0,1]=4 6463 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-6591475838 [0,1,0,1,0,0|1,0,1]=4 6464 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-9849453248 [0,1,0,1,0,0|1,0,1]=4 6465 B9R1.6 O=S(O)C1CCCCC1 MCULE-2447383910 [0,1,0,1,0,0|2,0,0]=4 6466 B9R1.6 OB(O)C1CCCCC1 MCULE-7463281328 [0,1,0,1,0,0|2,0,0]=4 6467 B9R1.23 OCC1CC(C(O1)O)O MCULE-1894937679 [0,1,0,1,0,0|1,0,0]=3 6468 B9R1.35 CC(C)N1CCC(C1)O MCULE-3720057489 [0,1,0,1,0,0|2,0,0]=4 6469 B9R1.35 CC1CCC(C1)C(=O)O MCULE-5009837194 [0,1,0,1,0,0|1,0,1]=4 6470 B9R1.35 CC1CCC(N1)C(=O)O MCULE-7716142893 [0,1,0,1,0,0|1,0,1]=4 6471 B9R1.35 CC1CCC(N1)C(=O)O MCULE-7805688291 [0,1,0,1,0,0|1,0,1]=4 6472 B9R1.35 CC1CCC(O1)C(=O)O MCULE-7354058760 [0,1,0,1,0,0|0,0,1]=3 6473 B9R1.35 C[C@@H]1CC[C@@H](N1)C(=O)O MCULE-1712610304 [0,1,0,1,0,0|1,0,1]=4 6474 B9R1.35 C[C@@H]1CC[C@@H](N1)C(=O)O MCULE-3564743814 [0,1,0,1,0,0|1,0,1]=4 6475 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O MCULE-2451266259 [0,1,0,1,0,0|0,0,1]=3 6476 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O MCULE-9559412763 [0,1,0,1,0,0|0,0,1]=3 6477 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-1486502980 [0,1,0,1,0,0|1,0,1]=4 6478 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-2728269167 [0,1,0,1,0,0|1,0,1]=4 6479 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-4518040079 [0,1,0,1,0,0|1,0,1]=4 6480 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-5687588737 [0,1,0,1,0,0|1,0,1]=4 6481 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-5969663507 [0,1,0,1,0,0|1,0,1]=4 6482 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-7325534692 [0,1,0,1,0,0|1,0,1]=4 6483 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-3116688346 [0,1,0,1,0,0|1,0,1]=4 6484 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-3630959366 [0,1,0,1,0,0|1,0,1]=4 6485 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-9043504063 [0,1,0,1,0,0|1,0,1]=4 6486 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-9322368857 [0,1,0,1,0,0|1,0,1]=4 6487 B9R1.40 C1(CCCCC1(F)F)N MCULE-2272642766 [0,1,0,1,0,0|2,0,0]=4 6488 B9R1.40 C1(CCCCC1(F)F)N MCULE-2805377498 [0,1,0,1,0,0|2,0,0]=4 6489 B9R1.40 CC1(CCCCC1N)C MCULE-5951764286 [0,1,0,1,0,0|2,0,0]=4 6490 B9R1.40 CC1(CCCCC1N)O MCULE-5300265774 [0,1,0,1,0,0|1,0,0]=3 6491 B9R1.40 CC1(CCCCC1O)C MCULE-1365001070 [0,1,0,1,0,0|1,0,0]=3 6492 B9R1.40 CC1(CCNCC1F)O MCULE-5705747944 [0,1,0,1,0,0|2,0,0]=4 6493 B9R1.40 CC1(CCNCC1F)O MCULE-9734438039 [0,1,0,1,0,0|2,0,0]=4 6494 B9R1.40 CC1(CCOCC1O)O MCULE-9069325911 [0,1,0,1,0,0|1,0,0]=3 6495 B9R1.40 CC1(CNCCC1O)C MCULE-2471331536 [0,1,0,1,0,0|2,0,0]=4 6496 B9R1.40 CC1(CNCCC1O)F MCULE-2463645268 [0,1,0,1,0,0|2,0,0]=4 6497 B9R1.40 CC1(CNCCC1O)F MCULE-5270582869 [0,1,0,1,0,0|2,0,0]=4 6498 B9R1.40 CC1(CNCC[C@@H]1O)C MCULE-4112498170 [0,1,0,1,0,0|2,0,0]=4 6499 B9R1.40 CC1(COCCC1O)C MCULE-5191216126 [0,1,0,1,0,0|2,0,0]=4 6500 B9R1.40 CC1CCCCC1(C)N MCULE-4488389841 [0,1,0,1,0,0|2,0,0]=4 6501 B9R1.40 CC1CCCCC1(F)F MCULE-7532748980 [0,1,0,1,0,0|2,0,0]=4 6502 B9R1.40 CC1CCNCC1(C)O MCULE-6091048331 [0,1,0,1,0,0|2,0,0]=4 6503 B9R1.40 CC1CCNCC1(C)O MCULE-7827878467 [0,1,0,1,0,0|2,0,0]=4 6504 B9R1.40 CC1CNCCC1(C)O MCULE-3050558506 [0,1,0,1,0,0|2,0,0]=4 6505 B9R1.40 CC1CNCCC1(C)O MCULE-7122670765 [0,1,0,1,0,0|2,0,0]=4 6506 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O MCULE-2566777989 [0,1,0,1,0,0|2,0,0]=4 6507 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O MCULE-7280139378 [0,1,0,1,0,0|2,0,0]=4 6508 B9R1.40 C[C@@H]1CCNC[C@]1(C)O MCULE-1559795322 [0,1,0,1,0,0|2,0,0]=4 6509 B9R1.40 C[C@@H]1CCNC[C@]1(C)O MCULE-6569914928 [0,1,0,1,0,0|2,0,0]=4 6510 B9R1.40 C[C@@]1(CCOC[C@H]1O)O MCULE-3803598208 [0,1,0,1,0,0|1,0,0]=3 6511 B9R1.40 C[C@H]1CCNC[C@@]1(C)O MCULE-1130241051 [0,1,0,1,0,0|2,0,0]=4 6512 B9R1.40 C[C@H]1CCNC[C@@]1(C)O MCULE-3222740777 [0,1,0,1,0,0|2,0,0]=4 6513 B9R1.40 C[C@H]1CCNC[C@]1(C)O MCULE-1911925525 [0,1,0,1,0,0|2,0,0]=4 6514 B9R1.40 C[C@H]1CCNC[C@]1(C)O MCULE-9810022632 [0,1,0,1,0,0|2,0,0]=4 6515 B9R1.40 C[C@]1(CCNC[C@@H]1F)O MCULE-4175201190 [0,1,0,1,0,0|2,0,0]=4 6516 B9R1.40 FC1(CCCCC1Cl)F MCULE-5840190873 [0,1,0,1,0,0|2,0,0]=4 6517 B9R1.40 NC1CCCCC1(F)F MCULE-6087305147 [0,1,0,1,0,0|2,0,0]=4 6518 B9R1.40 NC1CCCCC1(F)F MCULE-7710786653 [0,1,0,1,0,0|2,0,0]=4 6519 B9R1.40 N[C@@H]1CCCCC1(F)F MCULE-3305282256 [0,1,0,1,0,0|2,0,0]=4 6520 B9R1.40 N[C@@H]1CCCCC1(F)F MCULE-5464520416 [0,1,0,1,0,0|2,0,0]=4 6521 B9R1.40 N[C@@H]1CCCCC1(F)F MCULE-6396604034 [0,1,0,1,0,0|2,0,0]=4 6522 B9R1.40 N[C@@H]1CCCCC1(F)F MCULE-9996787741 [0,1,0,1,0,0|2,0,0]=4 6523 B9R1.40 N[C@H]1CCCCC1(F)F MCULE-2339284258 [0,1,0,1,0,0|2,0,0]=4 6524 B9R1.40 N[C@H]1CCCCC1(F)F MCULE-2735093239 [0,1,0,1,0,0|2,0,0]=4 6525 B9R1.40 N[C@H]1CCCCC1(F)F MCULE-8769925997 [0,1,0,1,0,0|2,0,0]=4 6526 B9R1.40 N[C@H]1CCCCC1(F)F MCULE-9241412975 [0,1,0,1,0,0|2,0,0]=4 6527 B9R1.40 OC1(CCOCC1F)O MCULE-5129581737 [0,1,0,1,0,0|2,0,0]=4 6528 B9R1.40 OC1(CCOC[C@@H]1F)O MCULE-4768109328 [0,1,0,1,0,0|2,0,0]=4 6529 B9R1.40 OC1CCCCC1(F)F MCULE-9041568076 [0,1,0,1,0,0|1,0,0]=3 6530 B9R1.40 OC1CCNCC1(F)F MCULE-2653306722 [0,1,0,1,0,0|2,0,0]=4 6531 B9R1.40 OC1CCNCC1(F)F MCULE-6821825882 [0,1,0,1,0,0|2,0,0]=4 6532 B9R1.40 OC1CNCCC1(F)F MCULE-2464888566 [0,1,0,1,0,0|2,0,0]=4 6533 B9R1.40 OC1CNCCC1(F)F MCULE-2778317793 [0,1,0,1,0,0|2,0,0]=4 6534 B9R1.40 O[C@H]1CCNCC1(F)F MCULE-1473883066 [0,1,0,1,0,0|2,0,0]=4 6535 B9R1.40 O[C@H]1CCNCC1(F)F MCULE-3857910088 [0,1,0,1,0,0|2,0,0]=4 6536 B9R1.40 O[C@H]1CNCCC1(F)F MCULE-8170371753 [0,1,0,1,0,0|2,0,0]=4 6537 B9R1.40 O[C@H]1CNCCC1(F)F MCULE-9576895417 [0,1,0,1,0,0|2,0,0]=4 6538 B9R1.40 [C@@H]1(CNCC[C@@]1(C)O)F MCULE-9928833237 [0,1,0,1,0,0|2,0,0]=4 6539 B9R1.59 CCCC1CC1C(=O)O MCULE-5011491615 [0,1,0,1,0,0|1,0,1]=4 6540 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O MCULE-8208745989 [0,1,0,1,0,0|1,0,1]=4 6541 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O MCULE-1448060038 [0,1,0,1,0,0|1,0,1]=4 6542 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O MCULE-6634735984 [0,1,0,1,0,0|1,0,1]=4 6543 B9R1.93 CCC1CC1(N)C(=O)O MCULE-5139419329 [0,1,0,1,0,0|1,0,1]=4 6544 B9R1.95 CC(C)C1CC(C1)CO MCULE-8967711451 [0,1,0,1,0,0|1,0,0]=3 6545 B9R1.95 CCC1CC(C1)C(=O)O MCULE-4399154195 [0,1,0,1,0,0|1,0,1]=4 6546 B9R1.95 CCC1CC(C1)C(=O)O MCULE-6408590394 [0,1,0,1,0,0|1,0,1]=4 6547 B9R1.95 CN(C)[C@H]1C[C@@H](C1)CO MCULE-4038858650 [0,1,0,1,0,0|2,0,0]=4 6548 B9R1.95 CN(C)[C@H]1C[C@H](C1)CO MCULE-2465080011 [0,1,0,1,0,0|2,0,0]=4 6549 B9R1.107 CO[C@@H]1C[C@@H](C1(C)C)O MCULE-7055913941 [0,1,0,1,0,0|2,0,0]=4 6550 B9R1.110 C(N)(C(=O)O)C1CCC1 MCULE-9659994288 [0,1,0,1,0,0|1,0,1]=4 6551 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-1352377374 [0,1,0,1,0,0|1,0,1]=4 6552 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-3278183132 [0,1,0,1,0,0|1,0,1]=4 6553 B9R1.110 CC(C)C(N)C1CCC1 MCULE-3337597801 [0,1,0,1,0,0|2,0,0]=4 6554 B9R1.110 NC(C(=O)O)C1CCC1 MCULE-3775442501 [0,1,0,1,0,0|1,0,1]=4 6555 B9R1.110 NC(C(=O)O)C1CCC1 MCULE-4685141546 [0,1,0,1,0,0|1,0,1]=4 6556 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-2214697836 [0,1,0,1,0,0|1,0,1]=4 6557 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-7786634114 [0,1,0,1,0,0|1,0,1]=4 6558 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-8265180180 [0,1,0,1,0,0|1,0,1]=4 6559 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-9469768507 [0,1,0,1,0,0|1,0,1]=4 6560 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-4701147798 [0,1,0,1,0,0|1,0,1]=4 6561 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-5196473423 [0,1,0,1,0,0|1,0,1]=4 6562 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-8882106256 [0,1,0,1,0,0|1,0,1]=4 6563 B9R1.110 O=C(O)C(Br)C1CCC1 MCULE-4353551170 [0,1,0,1,0,0|1,0,1]=4 6564 B9R1.110 O=C(O)C(F)C1CCC1 MCULE-8989287343 [0,1,0,1,0,0|1,0,1]=4 6565 B9R1.110 O=C(O)C(O)C1CCC1 MCULE-8720651836 [0,1,0,1,0,0|0,0,1]=3 6566 B9R1.110 O=C(O)[C@@H](O)C1CCC1 MCULE-7295025986 [0,1,0,1,0,0|0,0,1]=3 6567 B9R1.110 O=C(O)[C@H](O)C1CCC1 MCULE-7776940136 [0,1,0,1,0,0|0,0,1]=3 6568 B9R1.112 CC(CC1CC1)C(=O)O MCULE-6769587353 [0,1,0,1,0,0|1,0,1]=4 6569 B9R1.112 NC(CC1CC1)C(=O)O MCULE-2093088646 [0,1,0,1,0,0|1,0,1]=4 6570 B9R1.112 NC(CC1CC1)C(=O)O MCULE-2184599799 [0,1,0,1,0,0|1,0,1]=4 6571 B9R1.112 NC(CC1CC1)C(=O)O MCULE-6147797529 [0,1,0,1,0,0|1,0,1]=4 6572 B9R1.112 N[C@@H](CC1CC1)C(=O)O MCULE-6048291861 [0,1,0,1,0,0|1,0,1]=4 6573 B9R1.112 N[C@@H](CC1CC1)C(=O)O MCULE-9266785362 [0,1,0,1,0,0|1,0,1]=4 6574 B9R1.112 N[C@H](CC1CC1)C(=O)O MCULE-5333410932 [0,1,0,1,0,0|1,0,1]=4 6575 B9R1.112 N[C@H](CC1CC1)C(=O)O MCULE-6150609140 [0,1,0,1,0,0|1,0,1]=4 6576 B9R1.112 O=C(O)C(F)CC1CC1 MCULE-2152276709 [0,1,0,1,0,0|1,0,1]=4 6577 B9R1.112 O=C(O)C(O)CC1CC1 MCULE-7898828154 [0,1,0,1,0,0|0,0,1]=3 6578 B9R1.112 O=C(O)[C@H](O)CC1CC1 MCULE-3864076940 [0,1,0,1,0,0|0,0,1]=3 6579 B9R1.112 O=C(O)[C@H](O)CC1CC1 MCULE-5498784709 [0,1,0,1,0,0|0,0,1]=3 6580 B9R1.163 CC(=O)C1(CCCC1)O MCULE-4607553416 [0,1,0,1,0,0|0,0,2]=4 6581 B9R1.163 CC(C)C1(CCCC1)O MCULE-6047423621 [0,1,0,1,0,0|1,0,0]=3 6582 B9R1.163 CC(C)C1(CCNC1)O MCULE-1839843772 [0,1,0,1,0,0|2,0,0]=4 6583 B9R1.163 CC(C)C1(CCNC1)O MCULE-9992573361 [0,1,0,1,0,0|2,0,0]=4 6584 B9R1.163 CC(O)C1(CCCO1)C MCULE-8176746692 [0,1,0,1,0,0|2,0,0]=4 6585 B9R1.163 CC1(CCCC1)C(=O)O MCULE-8150530718 [0,1,0,1,0,0|1,0,1]=4 6586 B9R1.163 C[C@@H](O)C1(CCCO1)C MCULE-7551769191 [0,1,0,1,0,0|2,0,0]=4 6587 B9R1.163 NC(=O)C1(CCCC1)O MCULE-7750018506 [0,1,0,1,0,0|0,0,2]=4 6588 B9R1.163 NC1(CCCC1)C(=O)O MCULE-6366286422 [0,1,0,1,0,0|1,0,1]=4 6589 B9R1.163 NC1(CCCC1)C(F)F MCULE-1697400122 [0,1,0,1,0,0|2,0,0]=4 6590 B9R1.163 NC1(CCCC1)C(F)F MCULE-9463138858 [0,1,0,1,0,0|2,0,0]=4 6591 B9R1.163 O=C(O)C1(CCCC1)Br MCULE-3131005284 [0,1,0,1,0,0|1,0,1]=4 6592 B9R1.163 O=C(O)C1(CCCC1)F MCULE-4282263280 [0,1,0,1,0,0|1,0,1]=4 6593 B9R1.163 O=C(O)C1(CCCC1)O MCULE-2147028492 [0,1,0,1,0,0|0,0,1]=3 6594 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5890399768 [0,1,0,1,0,0|1,0,1]=4 6595 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5910869185 [0,1,0,1,0,0|1,0,1]=4 6596 B9R1.163 O=C(O)C1(CCOC1)O MCULE-8834969992 [0,1,0,1,0,0|1,0,1]=4 6597 B9R1.163 O=C(O)C1(CCSC1)O MCULE-7477879136 [0,1,0,1,0,0|1,0,1]=4 6598 B9R1.163 OC1(CCNC1)C(F)F MCULE-4618649624 [0,1,0,1,0,0|2,0,0]=4 6599 B9R1.163 OC1(CCNC1)C(F)F MCULE-5422212434 [0,1,0,1,0,0|2,0,0]=4 6600 B9R1.10 CC1(CCC(CC1)Br)Br MCULE-7212826404 [0,1,0,1,0,0|2,0,0]=4 6601 B9R1.10 CC1(CCC(CC1)N)C MCULE-3619630171 [0,1,0,1,0,0|2,0,0]=4 6602 B9R1.10 CC1(CCC(CC1)N)C MCULE-7750018047 [0,1,0,1,0,0|2,0,0]=4 6603 B9R1.10 CC1(CCC(CC1)N)O MCULE-1681425429 [0,1,0,1,0,0|2,0,0]=4 6604 B9R1.10 CC1(CCC(CC1)N)O MCULE-1957680403 [0,1,0,1,0,0|2,0,0]=4 6605 B9R1.10 CC1(CCC(CC1)O)C MCULE-7277990161 [0,1,0,1,0,0|1,0,0]=3 6606 B9R1.10 CC1(CCC(CC1)O)N MCULE-1833594604 [0,1,0,1,0,0|1,0,0]=3 6607 B9R1.10 CC1(CCC(CC1)O)N MCULE-6900445969 [0,1,0,1,0,0|1,0,0]=3 6608 B9R1.10 CC1(CCC(CC1)O)O MCULE-9281543263 [0,1,0,1,0,0|1,0,0]=3 6609 B9R1.10 CC1(CCC(CC1)S)C MCULE-9326980019 [0,1,0,1,0,0|1,1,0]=4 6610 B9R1.10 CC1(CCC(CN1)N)C MCULE-1073119315 [0,1,0,1,0,0|2,0,0]=4 6611 B9R1.10 CC1(CCC(CN1)N)C MCULE-6366517054 [0,1,0,1,0,0|2,0,0]=4 6612 B9R1.10 CC1(CCC(CO1)N)C MCULE-4655676422 [0,1,0,1,0,0|1,0,0]=3 6613 B9R1.10 CC1(CC[C@@H](CN1)N)C MCULE-1655362239 [0,1,0,1,0,0|2,0,0]=4 6614 B9R1.10 CC1(CC[C@@H](CN1)N)C MCULE-3842010885 [0,1,0,1,0,0|2,0,0]=4 6615 B9R1.10 CC1(CC[C@@H](CN1)N)C MCULE-4840366464 [0,1,0,1,0,0|2,0,0]=4 6616 B9R1.10 CC1(CC[C@@H](CN1)N)C MCULE-9273219397 [0,1,0,1,0,0|2,0,0]=4 6617 B9R1.10 CC1(CC[C@@H](CN1)N)C MCULE-9863762934 [0,1,0,1,0,0|2,0,0]=4 6618 B9R1.10 CC1(OCC(CO1)N)C MCULE-4321880581 [0,1,0,1,0,0|2,0,0]=4 6619 B9R1.10 CC1(OCC(CO1)O)C MCULE-6093182014 [0,1,0,1,0,0|1,0,0]=3 6620 B9R1.10 CC1CCC(CC1)(C)C MCULE-6477834218 [0,1,0,1,0,0|2,0,0]=4 6621 B9R1.10 CC1CCC(CC1)(C)N MCULE-4115245938 [0,1,0,1,0,0|2,0,0]=4 6622 B9R1.10 CC1CCC(CC1)(C)N MCULE-9306597063 [0,1,0,1,0,0|2,0,0]=4 6623 B9R1.10 CC1CCC(CC1)(F)F MCULE-2893199518 [0,1,0,1,0,0|2,0,0]=4 6624 B9R1.10 CC1CCC(CN1)(F)F MCULE-5606059037 [0,1,0,1,0,0|2,0,0]=4 6625 B9R1.10 CC1CCC(CN1)(F)F MCULE-9266488951 [0,1,0,1,0,0|2,0,0]=4 6626 B9R1.10 CC1CNC(CO1)(C)C MCULE-3156726410 [0,1,0,1,0,0|2,0,0]=4 6627 B9R1.10 CN1CCC(CC1)(C)O MCULE-6214950867 [0,1,0,1,0,0|2,0,0]=4 6628 B9R1.10 C[C@@H]1COC(CN1)(C)C MCULE-8875030186 [0,1,0,1,0,0|2,0,0]=4 6629 B9R1.10 C[C@@]1(CC[C@@H](CC1)N)O MCULE-7329013205 [0,1,0,1,0,0|2,0,0]=4 6630 B9R1.10 C[C@@]1(CC[C@@H](CC1)N)O MCULE-8018632586 [0,1,0,1,0,0|2,0,0]=4 6631 B9R1.10 C[C@@]1(CC[C@@H](CC1)O)N MCULE-3087940747 [0,1,0,1,0,0|1,0,0]=3 6632 B9R1.10 C[C@@]1(CC[C@@H](CC1)O)N MCULE-7156866787 [0,1,0,1,0,0|1,0,0]=3 6633 B9R1.10 C[C@@]1(CC[C@@H](CC1)O)O MCULE-9357645329 [0,1,0,1,0,0|1,0,0]=3 6634 B9R1.10 C[C@@]1(CC[C@H](CC1)N)O MCULE-6289246957 [0,1,0,1,0,0|2,0,0]=4 6635 B9R1.10 C[C@@]1(CC[C@H](CC1)O)N MCULE-3485238443 [0,1,0,1,0,0|1,0,0]=3 6636 B9R1.10 C[C@@]1(CC[C@H](CC1)O)N MCULE-9383956927 [0,1,0,1,0,0|1,0,0]=3 6637 B9R1.10 C[C@@]1(CC[C@H](CC1)O)O MCULE-8566504105 [0,1,0,1,0,0|1,0,0]=3 6638 B9R1.10 C[C@H]1CC[C@@](CC1)(C)N MCULE-4326912639 [0,1,0,1,0,0|2,0,0]=4 6639 B9R1.10 C[C@H]1CC[C@@](CC1)(C)N MCULE-9419290134 [0,1,0,1,0,0|2,0,0]=4 6640 B9R1.10 C[C@H]1CC[C@](CC1)(C)N MCULE-2138350789 [0,1,0,1,0,0|2,0,0]=4 6641 B9R1.10 C[C@H]1CC[C@](CC1)(C)N MCULE-7723329915 [0,1,0,1,0,0|2,0,0]=4 6642 B9R1.10 C[C@H]1COC(CN1)(C)C MCULE-5091919764 [0,1,0,1,0,0|2,0,0]=4 6643 B9R1.10 OC1CCC(CC1)(F)F MCULE-7530113152 [0,1,0,1,0,0|2,0,0]=4 6644 B9R1.125 CC1(CC(CN1)O)CO MCULE-2899118253 [0,1,0,1,0,0|2,0,0]=4 6645 B9R1.125 CC1(CC(CN1)O)CO MCULE-8954323319 [0,1,0,1,0,0|2,0,0]=4 6646 B9R1.125 CCP1(=S)CCC(O1)C MCULE-9914334269 [0,1,0,1,0,0|2,0,0]=4 6647 B9R1.125 CN1CCC(C1)(O)CN MCULE-3427949328 [0,1,0,1,0,0|2,0,0]=4 6648 B9R1.133 C1(CCC(C1)(F)F)CO MCULE-3059311962 [0,1,0,1,0,0|2,0,0]=4 6649 B9R1.133 C1(COC(O1)(C)C)CN MCULE-6764790908 [0,1,0,1,0,0|2,0,0]=4 6650 B9R1.133 CC1(CC(CO1)CO)C MCULE-2082777480 [0,1,0,1,0,0|2,0,0]=4 6651 B9R1.133 CC1(CCC(C1)CBr)C MCULE-6516555782 [0,1,0,1,0,0|2,0,0]=4 6652 B9R1.133 CC1(CCC(C1)CN)C MCULE-3947571035 [0,1,0,1,0,0|2,0,0]=4 6653 B9R1.133 CC1(CCC(C1)CN)C MCULE-9482404028 [0,1,0,1,0,0|2,0,0]=4 6654 B9R1.133 CC1(CCC(O1)CBr)C MCULE-7975653586 [0,1,0,1,0,0|1,0,0]=3 6655 B9R1.133 CC1(CCC(O1)CN)C MCULE-7867684034 [0,1,0,1,0,0|1,0,0]=3 6656 B9R1.133 CC1(CCC(O1)CN)C MCULE-9199821671 [0,1,0,1,0,0|1,0,0]=3 6657 B9R1.133 CC1(CCC(O1)CO)C MCULE-1774872507 [0,1,0,1,0,0|0,0,0]=2 6658 B9R1.133 CC1(CC[C@@H](O1)CN)C MCULE-1087286567 [0,1,0,1,0,0|1,0,0]=3 6659 B9R1.133 CC1(CC[C@@H](O1)CO)C MCULE-5585962757 [0,1,0,1,0,0|0,0,0]=2 6660 B9R1.133 CC1(CC[C@H](O1)CO)C MCULE-2305370714 [0,1,0,1,0,0|0,0,0]=2 6661 B9R1.133 CC1(CC[C@H](O1)CO)C MCULE-8266167352 [0,1,0,1,0,0|0,0,0]=2 6662 B9R1.133 CC1(CNC(C1)CO)C MCULE-2739458307 [0,1,0,1,0,0|2,0,0]=4 6663 B9R1.133 CC1(CNC(C1)CO)C MCULE-7568309276 [0,1,0,1,0,0|2,0,0]=4 6664 B9R1.133 CC1(CNC(C1)CO)C MCULE-9200652792 [0,1,0,1,0,0|2,0,0]=4 6665 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-4354389531 [0,1,0,1,0,0|2,0,0]=4 6666 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-5413661873 [0,1,0,1,0,0|2,0,0]=4 6667 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-6122345231 [0,1,0,1,0,0|2,0,0]=4 6668 B9R1.133 CC1(CN[C@@H](C1)CO)C MCULE-6219822782 [0,1,0,1,0,0|2,0,0]=4 6669 B9R1.133 CC1(CN[C@H](C1)CO)C MCULE-5894469523 [0,1,0,1,0,0|2,0,0]=4 6670 B9R1.133 CC1(CN[C@H](C1)CO)C MCULE-8665542622 [0,1,0,1,0,0|2,0,0]=4 6671 B9R1.133 CC1(COC(C1)CBr)C MCULE-8366378827 [0,1,0,1,0,0|2,0,0]=4 6672 B9R1.133 CC1(COC(C1)CI)C MCULE-3770266551 [0,1,0,1,0,0|2,0,0]=4 6673 B9R1.133 CC1(COC(C1)CN)C MCULE-2314291032 [0,1,0,1,0,0|2,0,0]=4 6674 B9R1.133 CC1(COC(C1)CN)C MCULE-3842057505 [0,1,0,1,0,0|2,0,0]=4 6675 B9R1.133 CC1(COC(C1)CO)C MCULE-6114837538 [0,1,0,1,0,0|2,0,0]=4 6676 B9R1.133 CC1(OCC(O1)CBr)C MCULE-7375610898 [0,1,0,1,0,0|2,0,0]=4 6677 B9R1.133 CC1(OCC(O1)CCl)C MCULE-4712243532 [0,1,0,1,0,0|2,0,0]=4 6678 B9R1.133 CC1(OCC(O1)CCl)C MCULE-6615919946 [0,1,0,1,0,0|2,0,0]=4 6679 B9R1.133 CC1(OCC(O1)CF)C MCULE-8830666520 [0,1,0,1,0,0|2,0,0]=4 6680 B9R1.133 CC1(OCC(O1)CI)C MCULE-2987707152 [0,1,0,1,0,0|2,0,0]=4 6681 B9R1.133 CC1(OCC(O1)CI)C MCULE-3829113477 [0,1,0,1,0,0|2,0,0]=4 6682 B9R1.133 CC1(OCC(O1)CN)C MCULE-1132642473 [0,1,0,1,0,0|2,0,0]=4 6683 B9R1.133 CC1(OCC(O1)CN)C MCULE-6296299980 [0,1,0,1,0,0|2,0,0]=4 6684 B9R1.133 CC1(OCC(O1)CO)C MCULE-4394573653 [0,1,0,1,0,0|1,0,0]=3 6685 B9R1.133 CC1(OCC(O1)CO)C MCULE-8717487705 [0,1,0,1,0,0|1,0,0]=3 6686 B9R1.133 CC1(OC[C@@H](O1)CBr)C MCULE-3713885280 [0,1,0,1,0,0|2,0,0]=4 6687 B9R1.133 CC1(OC[C@@H](O1)CCl)C MCULE-7915415776 [0,1,0,1,0,0|2,0,0]=4 6688 B9R1.133 CC1(OC[C@@H](O1)CCl)C MCULE-9710736285 [0,1,0,1,0,0|2,0,0]=4 6689 B9R1.133 CC1(OC[C@@H](O1)CI)C MCULE-4406404364 [0,1,0,1,0,0|2,0,0]=4 6690 B9R1.133 CC1(OC[C@@H](O1)CI)C MCULE-7375020273 [0,1,0,1,0,0|2,0,0]=4 6691 B9R1.133 CC1(OC[C@@H](O1)CN)C MCULE-3780024433 [0,1,0,1,0,0|2,0,0]=4 6692 B9R1.133 CC1(OC[C@@H](O1)CN)C MCULE-8885822788 [0,1,0,1,0,0|2,0,0]=4 6693 B9R1.133 CC1(OC[C@@H](O1)CO)C MCULE-6178929923 [0,1,0,1,0,0|1,0,0]=3 6694 B9R1.133 CC1(OC[C@@H](O1)CO)C MCULE-8130693910 [0,1,0,1,0,0|1,0,0]=3 6695 B9R1.133 CC1(OC[C@H](O1)CBr)C MCULE-2047735690 [0,1,0,1,0,0|2,0,0]=4 6696 B9R1.133 CC1(OC[C@H](O1)CCl)C MCULE-5535440339 [0,1,0,1,0,0|2,0,0]=4 6697 B9R1.133 CC1(OC[C@H](O1)CCl)C MCULE-8951156765 [0,1,0,1,0,0|2,0,0]=4 6698 B9R1.133 CC1(OC[C@H](O1)CF)C MCULE-3270227158 [0,1,0,1,0,0|2,0,0]=4 6699 B9R1.133 CC1(OC[C@H](O1)CF)C MCULE-8794641528 [0,1,0,1,0,0|2,0,0]=4 6700 B9R1.133 CC1(OC[C@H](O1)CN)C MCULE-2241895330 [0,1,0,1,0,0|2,0,0]=4 6701 B9R1.133 CC1(OC[C@H](O1)CN)C MCULE-4335373558 [0,1,0,1,0,0|2,0,0]=4 6702 B9R1.133 CC1(OC[C@H](O1)CO)C MCULE-1400149271 [0,1,0,1,0,0|1,0,0]=3 6703 B9R1.133 CC1(OC[C@H](O1)CO)C MCULE-1405058977 [0,1,0,1,0,0|1,0,0]=3 6704 B9R1.133 CC1(SCC(S1)CO)C MCULE-2240931125 [0,1,0,1,0,0|1,1,0]=4 6705 B9R1.133 FC1(COC(C1)CI)F MCULE-6356743478 [0,1,0,1,0,0|2,0,0]=4 6706 B9R1.133 NCC1CC(CO1)(F)F MCULE-2793514202 [0,1,0,1,0,0|2,0,0]=4 6707 B9R1.133 OCC1CCC(C1)(F)F MCULE-8781082263 [0,1,0,1,0,0|2,0,0]=4 6708 B9R1.133 OC[C@@H]1CCC(C1)(F)F MCULE-7426418890 [0,1,0,1,0,0|2,0,0]=4 6709 B9R1.133 OC[C@@H]1CCC(C1)(F)F MCULE-8900624650 [0,1,0,1,0,0|2,0,0]=4 6710 B9R1.133 OC[C@H]1CCC(C1)(F)F MCULE-3509868652 [0,1,0,1,0,0|2,0,0]=4 6711 B9R1.133 OC[C@H]1CCC(C1)(F)F MCULE-8973296049 [0,1,0,1,0,0|2,0,0]=4 6712 B9R1.147 CC(C)CCC1(CC1)N MCULE-4376060119 [0,1,0,1,0,0|2,0,0]=4 6713 B9R1.70 COC(CBr)C1CCC1 MCULE-6497400619 [0,1,0,1,0,0|1,0,0]=3 6714 B9R1.70 COC(CN)C1CCC1 MCULE-8917947705 [0,1,0,1,0,0|1,0,0]=3 6715 B9R1.70 COC(CO)C1CCC1 MCULE-6598157025 [0,1,0,1,0,0|0,0,0]=2 6716 B9R1.70 NCC(CO)C1CCC1 MCULE-5699600966 [0,1,0,1,0,0|1,0,0]=3 6717 B9R1.70 OCC(CO)C1CCC1 MCULE-1317295718 [0,1,0,1,0,0|0,0,0]=2 6718 B9R1.72 NCC(CO)CC1CC1 MCULE-2870204877 [0,1,0,1,0,0|1,0,0]=3 6719 B9R1.72 NCC(CO)NC1CC1 MCULE-4464199502 [0,1,0,1,0,0|2,0,0]=4 6720 B9R1.94 C=CC1CC1(CO)CO MCULE-8545390173 [0,1,0,1,0,0|0,0,2]=4 6721 B9R1.120 CC1CCC1(CO)CO MCULE-7776828217 [0,1,0,1,0,0|0,0,0]=2 6722 B9R1.204 BrCC1(CCCC1)CBr MCULE-3057305224 [0,1,0,1,0,0|2,0,0]=4 6723 B9R1.204 CCC1(CCCC1)C#N MCULE-2200864610 [0,1,0,1,0,0|2,0,0]=4 6724 B9R1.204 CCC1(CCCC1)CN MCULE-6844969961 [0,1,0,1,0,0|2,0,0]=4 6725 B9R1.204 CCC1(CCCN1)CO MCULE-2291730213 [0,1,0,1,0,0|2,0,0]=4 6726 B9R1.204 CCC1(CCNC1)CO MCULE-6824082536 [0,1,0,1,0,0|2,0,0]=4 6727 B9R1.204 CNC1(CCCC1)CO MCULE-1687582141 [0,1,0,1,0,0|1,0,0]=3 6728 B9R1.204 CNC1(CCOC1)CO MCULE-1597439940 [0,1,0,1,0,0|2,0,0]=4 6729 B9R1.204 CNC1(CCSC1)CO MCULE-8777175880 [0,1,0,1,0,0|2,0,0]=4 6730 B9R1.204 COC1(CCCC1)C#N MCULE-6265915902 [0,1,0,1,0,0|1,0,1]=4 6731 B9R1.204 COC1(CCCC1)C=O MCULE-4867100992 [0,1,0,1,0,0|0,0,2]=4 6732 B9R1.204 COC1(CCCC1)CBr MCULE-4708934914 [0,1,0,1,0,0|1,0,0]=3 6733 B9R1.204 COC1(CCCC1)CN MCULE-4479422270 [0,1,0,1,0,0|1,0,0]=3 6734 B9R1.204 COC1(CCCC1)CO MCULE-4347741831 [0,1,0,1,0,0|0,0,0]=2 6735 B9R1.204 COC1(CCCC1)OC MCULE-6668149614 [0,1,0,1,0,0|2,0,0]=4 6736 B9R1.204 COC1(CCOC1)CN MCULE-5586905334 [0,1,0,1,0,0|2,0,0]=4 6737 B9R1.204 COC1(CCOC1)CN MCULE-8109669152 [0,1,0,1,0,0|2,0,0]=4 6738 B9R1.204 COC1(CCOC1)CO MCULE-5882769438 [0,1,0,1,0,0|1,0,0]=3 6739 B9R1.204 COC1(CCSC1)CN MCULE-1499865376 [0,1,0,1,0,0|2,0,0]=4 6740 B9R1.204 N#CC1(CCCC1)CBr MCULE-7851751780 [0,1,0,1,0,0|2,0,0]=4 6741 B9R1.204 N#CC1(CCCC1)CN MCULE-6000167794 [0,1,0,1,0,0|2,0,0]=4 6742 B9R1.204 N#CC1(CCCC1)CN MCULE-8405117603 [0,1,0,1,0,0|2,0,0]=4 6743 B9R1.204 N#CC1(CCCC1)CO MCULE-8187436672 [0,1,0,1,0,0|1,0,0]=3 6744 B9R1.204 N#CC1(CCOC1)CO MCULE-5011960218 [0,1,0,1,0,0|2,0,0]=4 6745 B9R1.204 NCC1(CCCC1)CN MCULE-6782705408 [0,1,0,1,0,0|2,0,0]=4 6746 B9R1.204 NCC1(CCCC1)CO MCULE-5764013495 [0,1,0,1,0,0|1,0,0]=3 6747 B9R1.204 NCC1(CCCC1)CO MCULE-8669848799 [0,1,0,1,0,0|1,0,0]=3 6748 B9R1.204 NCC1(CCOC1)CO MCULE-2011513032 [0,1,0,1,0,0|2,0,0]=4 6749 B9R1.204 OCC1(CC=CC1)CO MCULE-7429277981 [0,1,0,1,0,0|0,0,2]=4 6750 B9R1.204 OCC1(CCCC1)CO MCULE-6896331863 [0,1,0,1,0,0|0,0,0]=2 6751 B9R1.204 OCC1(CCCN1)CO MCULE-8513711939 [0,1,0,1,0,0|1,0,0]=3 6752 B9R1.204 OCC1(CCCO1)CO MCULE-2056655928 [0,1,0,1,0,0|1,0,0]=3 6753 B9R1.204 OCC1(CCNC1)CO MCULE-5448294830 [0,1,0,1,0,0|1,0,0]=3 6754 B9R1.62 CC(C)(CN)C1CCC1 MCULE-8259290025 [0,1,0,1,0,0|2,0,0]=4 6755 B9R1.62 CC(C)(CN)C1CCC1 MCULE-9714003350 [0,1,0,1,0,0|2,0,0]=4 6756 B9R1.62 CC(C)(CO)C1CCC1 MCULE-4617502237 [0,1,0,1,0,0|1,0,0]=3 6757 B9R1.62 NCC(F)(F)C1CCC1 MCULE-6280734801 [0,1,0,1,0,0|2,0,0]=4 6758 B9R1.62 NCC(F)(F)C1CCC1 MCULE-7407442959 [0,1,0,1,0,0|2,0,0]=4 6759 B9R1.64 CC(C)(CN)CC1CC1 MCULE-1177615720 [0,1,0,1,0,0|2,0,0]=4 6760 B9R1.64 CC(C)(CN)CC1CC1 MCULE-6841506234 [0,1,0,1,0,0|2,0,0]=4 6761 B9R1.64 CC(C)(CO)NC1CC1 MCULE-4552805137 [0,1,0,1,0,0|2,0,0]=4 6762 B9R1.64 NCC(F)(F)CC1CC1 MCULE-7461929707 [0,1,0,1,0,0|2,0,0]=4 6763 B9R1.64 NCC(F)(F)CC1CC1 MCULE-7705988575 [0,1,0,1,0,0|2,0,0]=4 6764 B9R1.148 CC1(CCCCCC1)N MCULE-1779116362 [0,1,0,1,0,0|2,0,0]=4 6765 B9R1.148 CC1(CCCCCC1)N MCULE-5391477735 [0,1,0,1,0,0|2,0,0]=4 6766 B9R1.148 CC1(CCCCCC1)O MCULE-5108307354 [0,1,0,1,0,0|1,0,0]=3 6767 B9R1.148 CC1(CCCCNC1)C MCULE-5568533519 [0,1,0,1,0,0|2,0,0]=4 6768 B9R1.148 CC1(CCCCNC1)F MCULE-2828709987 [0,1,0,1,0,0|2,0,0]=4 6769 B9R1.148 CC1(CCCCNC1)F MCULE-5791441123 [0,1,0,1,0,0|2,0,0]=4 6770 B9R1.148 CC1(CCCCNC1)O MCULE-3442956887 [0,1,0,1,0,0|1,0,0]=3 6771 B9R1.148 CC1(CCCCNC1)O MCULE-8578810557 [0,1,0,1,0,0|1,0,0]=3 6772 B9R1.148 CC1(CCCNCC1)O MCULE-5871089190 [0,1,0,1,0,0|2,0,0]=4 6773 B9R1.148 CC1(CCCNCC1)O MCULE-9618304213 [0,1,0,1,0,0|2,0,0]=4 6774 B9R1.148 CC1(CNCCOC1)F MCULE-7259207969 [0,1,0,1,0,0|2,0,0]=4 6775 B9R1.148 CC1(CNCCOC1)F MCULE-7617569908 [0,1,0,1,0,0|2,0,0]=4 6776 B9R1.148 CC1(CNCCOC1)O MCULE-5821906686 [0,1,0,1,0,0|1,0,0]=3 6777 B9R1.148 CC1(CNCCOC1)O MCULE-7620136387 [0,1,0,1,0,0|1,0,0]=3 6778 B9R1.148 CC1(COCCCN1)C MCULE-6655013218 [0,1,0,1,0,0|2,0,0]=4 6779 B9R1.148 C[C@@]1(CCCNCC1)O MCULE-2380155794 [0,1,0,1,0,0|2,0,0]=4 6780 B9R1.148 C[C@@]1(CCCNCC1)O MCULE-8167005767 [0,1,0,1,0,0|2,0,0]=4 6781 B9R1.148 FC1(CCCCNC1)F MCULE-7965030318 [0,1,0,1,0,0|2,0,0]=4 6782 B9R1.148 FC1(CCCCNC1)F MCULE-9370596007 [0,1,0,1,0,0|2,0,0]=4 6783 B9R1.148 FC1(CNCCOC1)F MCULE-2790324109 [0,1,0,1,0,0|2,0,0]=4 6784 B9R1.148 FC1(CNCCOC1)F MCULE-7054694890 [0,1,0,1,0,0|2,0,0]=4 6785 B9R2.39 BrC1CC2CCC1C2 MCULE-2525306417 [0,0,0,2,0,0|2,0,0]=4 6786 B9R2.39 BrC1C[C@H]2CC[C@@H]1C2 MCULE-5339713795 [0,0,0,2,0,0|2,0,0]=4 6787 B9R2.39 ClC1CC2CCC1C2 MCULE-2627012901 [0,0,0,2,0,0|2,0,0]=4 6788 B9R2.39 NC1CC2CCC1C2 MCULE-1646830516 [0,0,0,2,0,0|2,0,0]=4 6789 B9R2.39 NC1CC2CCC1C2 MCULE-4489292957 [0,0,0,2,0,0|2,0,0]=4 6790 B9R2.39 NC1CC2CCC1O2 MCULE-7005194127 [0,0,0,2,0,0|1,0,0]=3 6791 B9R2.39 NC1CC2CCC1O2 MCULE-9938013447 [0,0,0,2,0,0|1,0,0]=3 6792 B9R2.39 NC1C[C@@H]2CC[C@H]1C2 MCULE-4406518687 [0,0,0,2,0,0|2,0,0]=4 6793 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-1907155621 [0,0,0,2,0,0|2,0,0]=4 6794 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-3506388726 [0,0,0,2,0,0|2,0,0]=4 6795 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-3640859726 [0,0,0,2,0,0|2,0,0]=4 6796 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-4236102525 [0,0,0,2,0,0|2,0,0]=4 6797 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1O2 MCULE-1567634529 [0,0,0,2,0,0|1,0,0]=3 6798 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1O2 MCULE-3673875552 [0,0,0,2,0,0|1,0,0]=3 6799 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-3600979102 [0,0,0,2,0,0|2,0,0]=4 6800 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-4880538936 [0,0,0,2,0,0|2,0,0]=4 6801 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-5004847824 [0,0,0,2,0,0|2,0,0]=4 6802 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-5227933535 [0,0,0,2,0,0|2,0,0]=4 6803 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-5286948756 [0,0,0,2,0,0|2,0,0]=4 6804 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-7553153313 [0,0,0,2,0,0|2,0,0]=4 6805 B9R2.39 O=C1CC2CCC1O2 MCULE-3122768457 [0,0,0,2,0,0|0,0,2]=4 6806 B9R2.39 OC1CC2CC1CN2 MCULE-1326051035 [0,0,0,2,0,0|2,0,0]=4 6807 B9R2.39 OC1CC2CC1CN2 MCULE-9945384104 [0,0,0,2,0,0|2,0,0]=4 6808 B9R2.39 OC1CC2CCC1C2 MCULE-6414891759 [0,0,0,2,0,0|1,0,0]=3 6809 B9R2.39 OC1CC2CCC1N2 MCULE-1605436075 [0,0,0,2,0,0|1,0,0]=3 6810 B9R2.39 OC1CC2CCC1N2 MCULE-1761281414 [0,0,0,2,0,0|1,0,0]=3 6811 B9R2.39 OC1CC2CCC1O2 MCULE-3124193235 [0,0,0,2,0,0|0,0,0]=2 6812 B9R2.39 OC1CC2CNC1C2 MCULE-2749316886 [0,0,0,2,0,0|2,0,0]=4 6813 B9R2.39 OC1CC2CNC1C2 MCULE-4966948452 [0,0,0,2,0,0|2,0,0]=4 6814 B9R2.39 OC1C[C@@H]2CC[C@H]1C2 MCULE-9639323400 [0,0,0,2,0,0|1,0,0]=3 6815 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-4979276205 [0,0,0,2,0,0|1,0,0]=3 6816 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 MCULE-3144398733 [0,0,0,2,0,0|1,0,0]=3 6817 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 MCULE-7894832313 [0,0,0,2,0,0|1,0,0]=3 6818 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CN2 MCULE-6890871381 [0,0,0,2,0,0|2,0,0]=4 6819 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CN2 MCULE-9981789594 [0,0,0,2,0,0|2,0,0]=4 6820 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1C2 MCULE-6071426979 [0,0,0,2,0,0|1,0,0]=3 6821 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 MCULE-1633391346 [0,0,0,2,0,0|1,0,0]=3 6822 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 MCULE-9461548760 [0,0,0,2,0,0|1,0,0]=3 6823 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 MCULE-1159886921 [0,0,0,2,0,0|2,0,0]=4 6824 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 MCULE-6982071164 [0,0,0,2,0,0|2,0,0]=4 6825 B9R2.39 O[C@H]1C[C@@H]2C[C@H]1CN2 MCULE-2620883448 [0,0,0,2,0,0|2,0,0]=4 6826 B9R2.39 O[C@H]1C[C@@H]2C[C@H]1CN2 MCULE-8888575594 [0,0,0,2,0,0|2,0,0]=4 6827 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 MCULE-4495352435 [0,0,0,2,0,0|2,0,0]=4 6828 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 MCULE-6073992216 [0,0,0,2,0,0|2,0,0]=4 6829 B9R2.39 [C@@H]1(C[C@@H]2CC[C@H]1C2)O MCULE-6218681459 [0,0,0,2,0,0|1,0,0]=3 6830 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-3428651950 [0,0,0,2,0,0|1,0,0]=3 6831 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-5974580174 [0,0,0,2,0,0|1,0,0]=3 6832 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-6305413134 [0,0,0,2,0,0|1,0,0]=3 6833 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-7062654568 [0,0,0,2,0,0|1,0,0]=3 6834 B9R2.39 [C@@H]12CC[C@@H](N1)[C@H](C2)O MCULE-4291985781 [0,0,0,2,0,0|1,0,0]=3 6835 B9R2.39 [C@@H]12CC[C@@H](N1)[C@H](C2)O MCULE-8663774893 [0,0,0,2,0,0|1,0,0]=3 6836 B9R2.39 [C@@H]12CC[C@@H](O1)[C@@H](C2)N MCULE-3840560284 [0,0,0,2,0,0|1,0,0]=3 6837 B9R2.39 [C@@H]12CC[C@@H](O1)[C@@H](C2)N MCULE-6488455225 [0,0,0,2,0,0|1,0,0]=3 6838 B9R2.39 [C@@H]12CC[C@@H](O1)[C@H](C2)O MCULE-2630669259 [0,0,0,2,0,0|0,0,0]=2 6839 B9R2.39 [C@H]12CCN(C1)C[C@@H]2O MCULE-9304924445 [0,0,0,2,0,0|2,0,0]=4 6840 B9R2.39 [C@H]12CC[C@H](C1)CC2N MCULE-3255653886 [0,0,0,2,0,0|2,0,0]=4 6841 B9R2.39 [C@H]12CC[C@H](C1)CC2O MCULE-7175651186 [0,0,0,2,0,0|1,0,0]=3 6842 B9R2.39 [C@H]12CC[C@H](C1)C[C@@H]2Br MCULE-5055207580 [0,0,0,2,0,0|2,0,0]=4 6843 B9R2.39 [C@H]12CC[C@H](C1)C[C@@H]2Br MCULE-6523129084 [0,0,0,2,0,0|2,0,0]=4 6844 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-6992871131 [0,0,0,2,0,0|2,0,0]=4 6845 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-7207127845 [0,0,0,2,0,0|2,0,0]=4 6846 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-7451668129 [0,0,0,2,0,0|2,0,0]=4 6847 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-9963967295 [0,0,0,2,0,0|2,0,0]=4 6848 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-4118507960 [0,0,0,2,0,0|1,0,0]=3 6849 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-9141970579 [0,0,0,2,0,0|1,0,0]=3 6850 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)N MCULE-9389098423 [0,0,0,2,0,0|2,0,0]=4 6851 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)N MCULE-9481703506 [0,0,0,2,0,0|2,0,0]=4 6852 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-4746309717 [0,0,0,2,0,0|1,0,0]=3 6853 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-5454625797 [0,0,0,2,0,0|1,0,0]=3 6854 B9R2.47 BrCC1CC2CC2C1 MCULE-1009635949 [0,0,0,2,0,0|2,0,0]=4 6855 B9R2.47 NCC1CC2CC2C1 MCULE-3288031959 [0,0,0,2,0,0|2,0,0]=4 6856 B9R2.47 SCC1CC2CC2C1 MCULE-2301311247 [0,0,0,2,0,0|1,1,0]=4 6857 B9R2.61 BrCC12CCC(C1)C2 MCULE-7363232922 [0,0,0,2,0,0|2,0,0]=4 6858 B9R2.61 ICC12CC(C1)CO2 MCULE-8496119270 [0,0,0,2,0,0|2,0,0]=4 6859 B9R2.61 NCC12CC(C1)CO2 MCULE-5539586158 [0,0,0,2,0,0|2,0,0]=4 6860 B9R2.61 NCC12CC(C1)CO2 MCULE-7026364577 [0,0,0,2,0,0|2,0,0]=4 6861 B9R2.61 NCC12CCC(C1)C2 MCULE-7223297645 [0,0,0,2,0,0|2,0,0]=4 6862 B9R2.61 NCC12CCC(C1)C2 MCULE-8500655631 [0,0,0,2,0,0|2,0,0]=4 6863 B9R2.61 OCC12CC(C1)CN2 MCULE-5338704221 [0,0,0,2,0,0|2,0,0]=4 6864 B9R2.61 OCC12CC(C1)CN2 MCULE-9335953299 [0,0,0,2,0,0|2,0,0]=4 6865 B9R2.61 OCC12CC(C1)CO2 MCULE-8012284802 [0,0,0,2,0,0|2,0,0]=4 6866 B9R2.61 OCC12CCC(C1)C2 MCULE-9561970787 [0,0,0,2,0,0|1,0,0]=3 6867 B9R2.61 OCC12COC(C1)C2 MCULE-1603753975 [0,0,0,2,0,0|2,0,0]=4 6868 B9R2.68 C1CC2CC(N1)CO2 MCULE-5096438735 [0,0,0,2,0,0|1,0,0]=3 6869 B9R2.68 C1CC2CC(N1)CO2 MCULE-5132857424 [0,0,0,2,0,0|1,0,0]=3 6870 B9R2.68 C1CC2CC(O1)CN2 MCULE-3865024029 [0,0,0,2,0,0|1,0,0]=3 6871 B9R2.68 C1CC2CC(O1)CN2 MCULE-8660013017 [0,0,0,2,0,0|1,0,0]=3 6872 B9R2.68 C1CC2CCC(C1)N2 MCULE-4168667116 [0,0,0,2,0,0|2,0,0]=4 6873 B9R2.68 C1CC2CCC(C1)N2 MCULE-7236821450 [0,0,0,2,0,0|2,0,0]=4 6874 B9R2.68 C1CC2CCC(C2)N1 MCULE-4183302228 [0,0,0,2,0,0|2,0,0]=4 6875 B9R2.68 C1CC2CNC(C1)C2 MCULE-9303917223 [0,0,0,2,0,0|2,0,0]=4 6876 B9R2.68 C1CC2CNCC1C2 MCULE-4832064037 [0,0,0,2,0,0|2,0,0]=4 6877 B9R2.68 C1CC2CNCC1C2 MCULE-5527128917 [0,0,0,2,0,0|2,0,0]=4 6878 B9R2.68 C1CC2CNCC1N2 MCULE-6758551830 [0,0,0,2,0,0|2,0,0]=4 6879 B9R2.68 C1CC2CNCC1N2 MCULE-9309176741 [0,0,0,2,0,0|2,0,0]=4 6880 B9R2.68 C1CC2CNCC1O2 MCULE-4093579653 [0,0,0,2,0,0|1,0,0]=3 6881 B9R2.68 C1CC2CNCC1O2 MCULE-7085546243 [0,0,0,2,0,0|1,0,0]=3 6882 B9R2.68 C1CC2COCC1N2 MCULE-4364135558 [0,0,0,2,0,0|1,0,0]=3 6883 B9R2.68 C1CC2COCC1N2 MCULE-4651198099 [0,0,0,2,0,0|1,0,0]=3 6884 B9R2.68 C1CC2COCC1N2 MCULE-6438572612 [0,0,0,2,0,0|1,0,0]=3 6885 B9R2.68 C1CC2CSCC1N2 MCULE-3835664527 [0,0,0,2,0,0|1,1,0]=4 6886 B9R2.68 C1CC2CSCC1N2 MCULE-7790056871 [0,0,0,2,0,0|1,1,0]=4 6887 B9R2.68 C1C[C@@H]2CC[C@@H](C1)N2 MCULE-5766645012 [0,0,0,2,0,0|2,0,0]=4 6888 B9R2.68 C1C[C@@H]2CC[C@@H](C1)N2 MCULE-7351504566 [0,0,0,2,0,0|2,0,0]=4 6889 B9R2.68 C1C[C@@H]2CNC[C@H]1N2 MCULE-9979738536 [0,0,0,2,0,0|2,0,0]=4 6890 B9R2.68 C1C[C@@H]2CNC[C@H]1O2 MCULE-4494116231 [0,0,0,2,0,0|1,0,0]=3 6891 B9R2.68 C1C[C@@H]2COC[C@H]1N2 MCULE-3233873038 [0,0,0,2,0,0|1,0,0]=3 6892 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 MCULE-3223751153 [0,0,0,2,0,0|2,0,0]=4 6893 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 MCULE-9016762675 [0,0,0,2,0,0|2,0,0]=4 6894 B9R2.68 C1NCC2CC1CO2 MCULE-4813815121 [0,0,0,2,0,0|2,0,0]=4 6895 B9R2.68 C1NCC2CC1CO2 MCULE-9557401424 [0,0,0,2,0,0|2,0,0]=4 6896 B9R2.68 [C@@H]12CCC[C@@H](N1)CC2 MCULE-7591609146 [0,0,0,2,0,0|2,0,0]=4 6897 B9R2.68 [C@@H]12CC[C@@H](N1)COC2 MCULE-3554003344 [0,0,0,2,0,0|1,0,0]=3 6898 B9R2.68 [C@@H]12CC[C@@H](N1)COC2 MCULE-3809152526 [0,0,0,2,0,0|1,0,0]=3 6899 B9R2.68 [C@@H]12CC[C@@H](O1)CNC2 MCULE-9999049079 [0,0,0,2,0,0|1,0,0]=3 6900 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-1467331283 [0,0,0,2,0,0|2,0,0]=4 6901 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-2418052547 [0,0,0,2,0,0|2,0,0]=4 6902 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-6209165116 [0,0,0,2,0,0|2,0,0]=4 6903 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-8532594937 [0,0,0,2,0,0|2,0,0]=4 6904 B9R2.70 C12CNC(C1C2)CO MCULE-4394798761 [0,0,0,2,0,0|1,0,0]=3 6905 B9R2.70 C12CNC(C1C2)CO MCULE-8368311568 [0,0,0,2,0,0|1,0,0]=3 6906 B9R2.70 [C@@H]1(NC[C@H]2[C@@H]1C2)CO MCULE-3868037858 [0,0,0,2,0,0|1,0,0]=3 6907 B9R2.70 [C@@H]1(NC[C@H]2[C@@H]1C2)CO MCULE-9214226537 [0,0,0,2,0,0|1,0,0]=3 6908 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-1920097396 [0,0,0,2,0,0|1,0,0]=3 6909 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-2926228582 [0,0,0,2,0,0|1,0,0]=3 6910 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-4595239988 [0,0,0,2,0,0|1,0,0]=3 6911 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-7784163101 [0,0,0,2,0,0|1,0,0]=3 6912 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-8164622872 [0,0,0,2,0,0|1,0,0]=3 6913 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-9132252654 [0,0,0,2,0,0|1,0,0]=3 6914 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-2610856714 [0,0,0,2,0,0|1,0,0]=3 6915 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-5772132528 [0,0,0,2,0,0|1,0,0]=3 6916 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-8152584888 [0,0,0,2,0,0|1,0,0]=3 6917 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-8708552456 [0,0,0,2,0,0|1,0,0]=3 6918 B9R2.110 CC12CCC(C1)CN2 MCULE-3007748342 [0,0,0,2,0,0|2,0,0]=4 6919 B9R2.110 CC12CNC(C1)CO2 MCULE-8579051024 [0,0,0,2,0,0|2,0,0]=4 6920 B9R2.110 NC12CCC(C1)CC2 MCULE-2150882814 [0,0,0,2,0,0|2,0,0]=4 6921 B9R2.110 NC12CCC(C1)CC2 MCULE-3949026685 [0,0,0,2,0,0|2,0,0]=4 6922 B9R2.110 OC12CCC(C1)CC2 MCULE-6779700955 [0,0,0,2,0,0|1,0,0]=3 6923 B9R2.139 CC1CNC2(C1)CC2 MCULE-4569176091 [0,0,0,2,0,0|2,0,0]=4 6924 B9R2.139 CC1CNC2(C1)CC2 MCULE-7509060734 [0,0,0,2,0,0|2,0,0]=4 6925 B9R2.139 NC1CCC2(C1)CC2 MCULE-3679199184 [0,0,0,2,0,0|2,0,0]=4 6926 B9R2.139 NC1CCC2(C1)CC2 MCULE-5017569224 [0,0,0,2,0,0|2,0,0]=4 6927 B9R2.139 NC1COC2(C1)CC2 MCULE-8441993595 [0,0,0,2,0,0|1,0,0]=3 6928 B9R2.139 OC1CCC2(C1)CC2 MCULE-7469775678 [0,0,0,2,0,0|1,0,0]=3 6929 B9R2.139 OC1COC2(C1)CC2 MCULE-8380013040 [0,0,0,2,0,0|0,0,0]=2 6930 B9R2.24 BrC1C2CCC1NC2 MCULE-9633334883 [0,0,0,2,0,0|2,0,0]=4 6931 B9R2.24 OC1C2CCC1NC2 MCULE-3410343986 [0,0,0,2,0,0|1,0,0]=3 6932 B9R2.24 OC1C2CCC1NC2 MCULE-7793208491 [0,0,0,2,0,0|1,0,0]=3 6933 B9R2.49 C12CCC(CC1)NC2 MCULE-5378947956 [0,0,0,2,0,0|2,0,0]=4 6934 B9R2.49 C1CC2CCC1CN2 MCULE-1608637741 [0,0,0,2,0,0|2,0,0]=4 6935 B9R2.49 C1CC2CCC1CN2 MCULE-7057871790 [0,0,0,2,0,0|2,0,0]=4 6936 B9R2.49 C1CC2CCC1NO2 MCULE-4140193508 [0,0,0,2,0,0|2,0,0]=4 6937 B9R2.49 C1CC2CCC1NO2 MCULE-8213101233 [0,0,0,2,0,0|2,0,0]=4 6938 B9R2.49 C1CC2CNC1CN2 MCULE-3482699463 [0,0,0,2,0,0|2,0,0]=4 6939 B9R2.49 C1CC2CNC1CN2 MCULE-6647994953 [0,0,0,2,0,0|2,0,0]=4 6940 B9R2.49 C1CC2CNC1CO2 MCULE-3206976699 [0,0,0,2,0,0|1,0,0]=3 6941 B9R2.49 C1CC2CNC1CO2 MCULE-7670526515 [0,0,0,2,0,0|1,0,0]=3 6942 B9R2.49 C1CC2CNC1CO2 MCULE-8543856318 [0,0,0,2,0,0|1,0,0]=3 6943 B9R2.49 C1C[C@@H]2CN[C@H]1CN2 MCULE-3835733951 [0,0,0,2,0,0|2,0,0]=4 6944 B9R2.49 C1C[C@@H]2CN[C@H]1CO2 MCULE-2948541450 [0,0,0,2,0,0|1,0,0]=3 6945 B9R2.49 C1C[C@@H]2CN[C@H]1CO2 MCULE-7453970603 [0,0,0,2,0,0|1,0,0]=3 6946 B9R2.49 C1C[C@H]2CN[C@@H]1CO2 MCULE-3527188077 [0,0,0,2,0,0|1,0,0]=3 6947 B9R2.49 C1C[C@H]2CN[C@@H]1CO2 MCULE-4776793272 [0,0,0,2,0,0|1,0,0]=3 6948 B9R2.49 C1C[C@H]2CN[C@@H]1CO2 MCULE-7279586694 [0,0,0,2,0,0|1,0,0]=3 6949 B9R2.49 C1C[C@H]2CN[C@@H]1CO2 MCULE-7746905535 [0,0,0,2,0,0|1,0,0]=3 6950 B9R2.49 [C@@H]12CC[C@@H](CN1)NC2 MCULE-2373259985 [0,0,0,2,0,0|2,0,0]=4 6951 B9R2.49 [C@@H]12CC[C@@H](CN1)OC2 MCULE-1116503015 [0,0,0,2,0,0|1,0,0]=3 6952 B9R2.49 [C@H]12CC[C@H](CN1)NC2 MCULE-7729828200 [0,0,0,2,0,0|2,0,0]=4 6953 B9R2.49 [C@H]12CC[C@H](CN1)OC2 MCULE-2654811800 [0,0,0,2,0,0|1,0,0]=3 6954 B9R2.49 [C@H]12CC[C@H](CN1)OC2 MCULE-3318924162 [0,0,0,2,0,0|1,0,0]=3 6955 B9R2.50 C1CCC2NCC2C1 MCULE-8742032434 [0,0,0,2,0,0|2,0,0]=4 6956 B9R2.50 C1CC[C@H]2NC[C@H]2C1 MCULE-6463847774 [0,0,0,2,0,0|2,0,0]=4 6957 B9R2.50 C1CNC2CNC2C1 MCULE-1682568819 [0,0,0,2,0,0|2,0,0]=4 6958 B9R2.53 OC1C2CNCC1C2 MCULE-3720434836 [0,0,0,2,0,0|2,0,0]=4 6959 B9R2.53 OC1C2CNCC1C2 MCULE-9173593961 [0,0,0,2,0,0|2,0,0]=4 6960 B9R2.53 O[C@@H]1[C@@H]2CNC[C@H]1C2 MCULE-4636094600 [0,0,0,2,0,0|2,0,0]=4 6961 B9R2.53 O[C@@H]1[C@@H]2CNC[C@H]1C2 MCULE-5175095450 [0,0,0,2,0,0|2,0,0]=4 6962 B9R2.56 OCC12CNCC1C2 MCULE-2183499557 [0,0,0,2,0,0|2,0,0]=4 6963 B9R2.56 OCC12CNCC1C2 MCULE-9347935345 [0,0,0,2,0,0|2,0,0]=4 6964 B9R2.56 OCC12COCC1C2 MCULE-7115607299 [0,0,0,2,0,0|2,0,0]=4 6965 B9R2.56 OC[C@]12CNC[C@H]1C2 MCULE-3314930374 [0,0,0,2,0,0|2,0,0]=4 6966 B9R2.56 [C@@H]12CNC[C@@]1(C2)CO MCULE-6677000826 [0,0,0,2,0,0|2,0,0]=4 6967 B9R2.56 [C@@H]12COC[C@@]1(C2)CO MCULE-3925746673 [0,0,0,2,0,0|2,0,0]=4 6968 B9R2.56 [C@@H]12COC[C@@]1(C2)CO MCULE-6112691555 [0,0,0,2,0,0|2,0,0]=4 6969 B9R2.56 [C@H]12COC[C@]1(C2)CO MCULE-8930198647 [0,0,0,2,0,0|2,0,0]=4 6970 B9R2.56 [C@H]12COC[C@]1(C2)CO MCULE-9519595251 [0,0,0,2,0,0|2,0,0]=4 6971 B9R2.65 BrCC1C2C1CCC2 MCULE-1566888527 [0,0,0,2,0,0|2,0,0]=4 6972 B9R2.65 C12CNCC1C2CO MCULE-3637270093 [0,0,0,2,0,0|2,0,0]=4 6973 B9R2.65 OCC1C2C1CCC2 MCULE-2478919102 [0,0,0,2,0,0|1,0,0]=3 6974 B9R2.65 OCC1C2C1COC2 MCULE-3515133004 [0,0,0,2,0,0|2,0,0]=4 6975 B9R2.65 OCC1C2C1OCC2 MCULE-4265471603 [0,0,0,2,0,0|2,0,0]=4 6976 B9R2.65 OC[C@@H]1[C@@H]2[C@H]1CNC2 MCULE-2490334390 [0,0,0,2,0,0|2,0,0]=4 6977 B9R2.65 OC[C@H]1[C@H]2[C@@H]1COC2 MCULE-5292935289 [0,0,0,2,0,0|2,0,0]=4 6978 B9R2.65 [C@@H]12CNC[C@@H]1[C@@H]2CO MCULE-2062269688 [0,0,0,2,0,0|2,0,0]=4 6979 B9R2.65 [C@@H]12CNC[C@@H]1[C@@H]2CO MCULE-9553916790 [0,0,0,2,0,0|2,0,0]=4 6980 B9R2.65 [C@@H]12COC[C@@H]1[C@@H]2CO MCULE-1025661355 [0,0,0,2,0,0|2,0,0]=4 6981 B9R2.65 [C@H]12COC[C@@H]1C2CO MCULE-6464801319 [0,0,0,2,0,0|2,0,0]=4 6982 B9R2.123 NC1C2C1CCCC2 MCULE-2802976465 [0,0,0,2,0,0|2,0,0]=4 6983 B9R2.123 NC1C2C1CCCC2 MCULE-4346059274 [0,0,0,2,0,0|2,0,0]=4 6984 B9R2.174 C1CC2(CCN1)CO2 MCULE-1611522907 [0,0,0,2,0,0|2,0,0]=4 6985 B9R2.174 C1CC2(CCN1)CO2 MCULE-8533391372 [0,0,0,2,0,0|2,0,0]=4 6986 B9R2.174 C1CC2(CCN1)CO2 MCULE-9637758697 [0,0,0,2,0,0|2,0,0]=4 6987 B9R2.174 C1CC2(CCO1)CO2 MCULE-1214465124 [0,0,0,2,0,0|2,0,0]=4 6988 B9R2.174 C1CC2(CCS1)CO2 MCULE-2030536003 [0,0,0,2,0,0|2,0,0]=4 6989 B9R2.174 C1CCC2(CC1)CO2 MCULE-8052721660 [0,0,0,2,0,0|1,0,0]=3 6990 B9R2.174 C1CCC2(CC2)NC1 MCULE-5869251937 [0,0,0,2,0,0|2,0,0]=4 6991 B9R2.174 C1CCC2(CC2)NC1 MCULE-7736659784 [0,0,0,2,0,0|2,0,0]=4 6992 B9R2.174 C1CNCC2(C1)CO2 MCULE-5050858433 [0,0,0,2,0,0|2,0,0]=4 6993 B9R2.174 C1CNCC2(C1)CO2 MCULE-8571267197 [0,0,0,2,0,0|2,0,0]=4 6994 B9R2.174 C1COC2(CC2)CN1 MCULE-1915298816 [0,0,0,2,0,0|2,0,0]=4 6995 B9R2.174 C1COC2(CC2)CN1 MCULE-2047063394 [0,0,0,2,0,0|2,0,0]=4 6996 B9R2.174 C1COCC2(C1)CO2 MCULE-9485375628 [0,0,0,2,0,0|2,0,0]=4 6997 B9R2.21 CC1CCC2OC2C1 MCULE-6465413460 [0,0,0,2,0,0|1,0,0]=3 6998 B9R2.21 NC1CCC2CC2C1 MCULE-2346030070 [0,0,0,2,0,0|2,0,0]=4 6999 B9R2.21 NC1CCC2CC2C1 MCULE-9769014300 [0,0,0,2,0,0|2,0,0]=4 7000 B9R2.6 CC12CCCCC1O2 MCULE-1483489668 [0,0,0,2,0,0|1,0,0]=3 7001 B9R2.6 NC12CCCCC1C2 MCULE-3557350963 [0,0,0,2,0,0|2,0,0]=4 7002 B9R2.6 NC12CCCCC1C2 MCULE-6590814117 [0,0,0,2,0,0|2,0,0]=4 7003 B9R2.6 OC12CCNCC1C2 MCULE-1458272289 [0,0,0,2,0,0|2,0,0]=4 7004 B9R2.6 OC12CCNCC1C2 MCULE-1870414348 [0,0,0,2,0,0|2,0,0]=4 7005 B9R2.6 OC12CNCCC1C2 MCULE-1156780909 [0,0,0,2,0,0|1,0,0]=3 7006 B9R2.6 OC12CNCCC1C2 MCULE-8827702128 [0,0,0,2,0,0|1,0,0]=3 7007 B9R2.109 FC1CNCC2C1C2 MCULE-9479301847 [0,0,0,2,0,0|2,0,0]=4 7008 B9R2.109 NC1CCCC2C1C2 MCULE-4068109415 [0,0,0,2,0,0|2,0,0]=4 7009 B9R2.109 NC1CCCC2C1C2 MCULE-5773759079 [0,0,0,2,0,0|2,0,0]=4 7010 B9R2.109 O=C1CCCC2C1O2 MCULE-6955178123 [0,0,0,2,0,0|0,0,2]=4 7011 B9R2.109 OC1CNCC2C1C2 MCULE-8630940027 [0,0,0,2,0,0|1,0,0]=3 7012 B9R2.109 O[C@@H]1CNC[C@@H]2[C@H]1C2 MCULE-5120334185 [0,0,0,2,0,0|1,0,0]=3 7013 B9R2.109 O[C@H]1CNC[C@@H]2[C@H]1C2 MCULE-8865546015 [0,0,0,2,0,0|1,0,0]=3 7014 B9R2.109 [C@H]12C[C@H]1CNC[C@@H]2F MCULE-6032554002 [0,0,0,2,0,0|2,0,0]=4 7015 B9R2.109 [C@H]12C[C@H]1CNC[C@H]2F MCULE-7975261263 [0,0,0,2,0,0|2,0,0]=4 7016 B9R2.1 NC1CC12CCCC2 MCULE-8491243046 [0,0,0,2,0,0|2,0,0]=4 7017 B9R2.1 NC1CC12CCCC2 MCULE-8564439908 [0,0,0,2,0,0|2,0,0]=4 7018 B9R2.52 C1CCC2OC2CC1 MCULE-7174861520 [0,0,0,2,0,0|1,0,0]=3 7019 B9R2.52 C1CNCC2CC2C1 MCULE-9824117173 [0,0,0,2,0,0|2,0,0]=4 7020 B9R2.51 C1CC2CC(N2)CS1 MCULE-4729108885 [0,0,0,2,0,0|1,1,0]=4 7021 B9R2.51 C1CCC2CC(C1)N2 MCULE-2798841539 [0,0,0,2,0,0|2,0,0]=4 7022 B9R2.51 C1CCC2CC(C1)N2 MCULE-8141319530 [0,0,0,2,0,0|2,0,0]=4 7023 B9R2.91 C1CC(C1)C2CCN2 MCULE-3402483441 [0,0,0,2,0,0|2,0,0]=4 7024 B9R2.91 C1CC(C1)C2CCN2 MCULE-9442810167 [0,0,0,2,0,0|2,0,0]=4 7025 B9R2.91 C1CC(C1)C2CNC2 MCULE-2460548441 [0,0,0,2,0,0|2,0,0]=4 7026 B9R2.91 C1CC(C1)C2CNC2 MCULE-2487746813 [0,0,0,2,0,0|2,0,0]=4 7027 B9R2.91 C1NCC1C2COC2 MCULE-1906409664 [0,0,0,2,0,0|2,0,0]=4 7028 B9R2.91 C1NCC1C2COC2 MCULE-6645087871 [0,0,0,2,0,0|2,0,0]=4 7029 B9R2.140 CC1CCC12CNC2 MCULE-5084303075 [0,0,0,2,0,0|2,0,0]=4 7030 B9R2.140 CC1CCC12CNC2 MCULE-9942116613 [0,0,0,2,0,0|2,0,0]=4 7031 B9R2.140 NC1CCC12CCC2 MCULE-3510185463 [0,0,0,2,0,0|2,0,0]=4 7032 B9R2.140 NC1CCC12CCC2 MCULE-5334555168 [0,0,0,2,0,0|2,0,0]=4 7033 B9R2.140 O=C1COC12CCC2 MCULE-7119377731 [0,0,0,2,0,0|0,0,2]=4 7034 B9R2.140 OC1CCC12CCC2 MCULE-4886802881 [0,0,0,2,0,0|1,0,0]=3 7035 B9R2.140 OC1CCC12CNC2 MCULE-2751329725 [0,0,0,2,0,0|2,0,0]=4 7036 B9R2.140 OC1CCC12CNC2 MCULE-5543992162 [0,0,0,2,0,0|2,0,0]=4 7037 B9R2.140 OC1CCC12CNC2 MCULE-6981202255 [0,0,0,2,0,0|2,0,0]=4 7038 B9R2.140 OC1CCC12COC2 MCULE-5757589077 [0,0,0,2,0,0|2,0,0]=4 7039 B9R2.140 OC1COC12CCC2 MCULE-1719734089 [0,0,0,2,0,0|0,0,0]=2 7040 B9R2.140 O[C@H]1CCC12COC2 MCULE-6567729778 [0,0,0,2,0,0|2,0,0]=4 7041 B9R2.153 NCC1CC12CCC2 MCULE-2371481990 [0,0,0,2,0,0|2,0,0]=4 7042 B9R2.153 OCC1CC12CCC2 MCULE-2729278824 [0,0,0,2,0,0|1,0,0]=3 7043 B9R2.157 C1CC1CC2CNC2 MCULE-1323771673 [0,0,0,2,0,0|2,0,0]=4 7044 B9R2.157 C1CC1CC2CNC2 MCULE-6820174598 [0,0,0,2,0,0|2,0,0]=4 7045 B9R2.157 C1CC1NC2COC2 MCULE-1568553938 [0,0,0,2,0,0|2,0,0]=4 7046 B9R2.173 C1CC2(CCO2)CN1 MCULE-1720750359 [0,0,0,2,0,0|2,0,0]=4 7047 B9R2.173 C1CC2(CCO2)CN1 MCULE-2495295466 [0,0,0,2,0,0|2,0,0]=4 7048 B9R2.173 C1CC2(CCO2)CN1 MCULE-5054538636 [0,0,0,2,0,0|2,0,0]=4 7049 B9R2.173 C1CC2(CCO2)CN1 MCULE-9596716587 [0,0,0,2,0,0|2,0,0]=4 7050 B9R2.173 C1CC2(CN1)COC2 MCULE-3188736961 [0,0,0,2,0,0|2,0,0]=4 7051 B9R2.173 C1CC2(CN1)COC2 MCULE-7590763300 [0,0,0,2,0,0|2,0,0]=4 7052 B9R2.173 C1CC2(CN1)COC2 MCULE-7792797142 [0,0,0,2,0,0|2,0,0]=4 7053 B9R2.173 C1CCC2(C1)CCN2 MCULE-1090935645 [0,0,0,2,0,0|2,0,0]=4 7054 B9R2.173 C1CCC2(C1)CCN2 MCULE-4332970866 [0,0,0,2,0,0|2,0,0]=4 7055 B9R2.173 C1CCC2(C1)CNC2 MCULE-3850643476 [0,0,0,2,0,0|2,0,0]=4 7056 B9R2.173 C1CCC2(C1)CNC2 MCULE-7942322454 [0,0,0,2,0,0|2,0,0]=4 7057 B9R2.173 C1CCC2(C1)CNC2 MCULE-8226199584 [0,0,0,2,0,0|2,0,0]=4 7058 B9R2.173 C1CNC2(C1)COC2 MCULE-2288409763 [0,0,0,2,0,0|2,0,0]=4 7059 B9R2.173 C1CNC2(C1)COC2 MCULE-3038869574 [0,0,0,2,0,0|2,0,0]=4 7060 B9R2.173 C1CNC2(C1)COC2 MCULE-5748904856 [0,0,0,2,0,0|2,0,0]=4 7061 B9R2.173 C1CNC2(C1)COC2 MCULE-5940304165 [0,0,0,2,0,0|2,0,0]=4 7062 B9R2.7 NC1CC2C1CCC2 MCULE-1766749220 [0,0,0,2,0,0|2,0,0]=4 7063 B9R2.7 NC1CC2C1CCC2 MCULE-4720445583 [0,0,0,2,0,0|2,0,0]=4 7064 B9R2.7 NC1CC2C1OCC2 MCULE-9987634072 [0,0,0,2,0,0|1,0,0]=3 7065 B9R2.7 O=C1CC2C1OCC2 MCULE-9845403948 [0,0,0,2,0,0|0,0,2]=4 7066 B9R2.7 O=C1C[C@H]2[C@@H]1OCC2 MCULE-7616272357 [0,0,0,2,0,0|0,0,2]=4 7067 B9R2.7 OC1CC2C1CCN2 MCULE-1875106894 [0,0,0,2,0,0|2,0,0]=4 7068 B9R2.7 OC1CC2C1CCN2 MCULE-5530554744 [0,0,0,2,0,0|2,0,0]=4 7069 B9R2.7 OC1CC2C1CNC2 MCULE-6123020535 [0,0,0,2,0,0|2,0,0]=4 7070 B9R2.7 OC1CC2C1CNC2 MCULE-6145264990 [0,0,0,2,0,0|2,0,0]=4 7071 B9R2.7 OC1CC2C1NCC2 MCULE-1724056091 [0,0,0,2,0,0|1,0,0]=3 7072 B9R2.7 OC1CC2C1NCC2 MCULE-4088023944 [0,0,0,2,0,0|1,0,0]=3 7073 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CCN2 MCULE-5150400350 [0,0,0,2,0,0|2,0,0]=4 7074 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CCN2 MCULE-7322559182 [0,0,0,2,0,0|2,0,0]=4 7075 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-1183667109 [0,0,0,2,0,0|2,0,0]=4 7076 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-2697058127 [0,0,0,2,0,0|2,0,0]=4 7077 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-9205223064 [0,0,0,2,0,0|2,0,0]=4 7078 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-9459444695 [0,0,0,2,0,0|2,0,0]=4 7079 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CCN2 MCULE-2081667277 [0,0,0,2,0,0|2,0,0]=4 7080 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CCN2 MCULE-3236594496 [0,0,0,2,0,0|2,0,0]=4 7081 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CNC2 MCULE-4765047696 [0,0,0,2,0,0|2,0,0]=4 7082 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CNC2 MCULE-8087349478 [0,0,0,2,0,0|2,0,0]=4 7083 B9R2.7 [C@@H]12CCO[C@@H]1C(=O)C2 MCULE-8869936364 [0,0,0,2,0,0|0,0,2]=4 7084 B9R2.7 [C@@H]12CNC[C@@H]1C[C@@H]2O MCULE-2617041228 [0,0,0,2,0,0|2,0,0]=4 7085 B9R2.7 [C@@H]12CNC[C@@H]1C[C@@H]2O MCULE-3794611955 [0,0,0,2,0,0|2,0,0]=4 7086 B9R2.7 [C@@H]12CNC[C@@H]1C[C@H]2O MCULE-8722541506 [0,0,0,2,0,0|2,0,0]=4 7087 B9R2.7 [C@@H]12CNC[C@@H]1C[C@H]2O MCULE-9165377590 [0,0,0,2,0,0|2,0,0]=4 7088 B9R2.7 [C@@H]12CNC[C@@H]1[C@@H](C2)O MCULE-3033237914 [0,0,0,2,0,0|2,0,0]=4 7089 B9R2.7 [C@@H]12CNC[C@@H]1[C@@H](C2)O MCULE-3748787889 [0,0,0,2,0,0|2,0,0]=4 7090 B9R2.7 [C@@H]12C[C@@H]([C@@H]1CCN2)O MCULE-5782413728 [0,0,0,2,0,0|2,0,0]=4 7091 B9R2.7 [C@@H]12C[C@@H]([C@@H]1CCN2)O MCULE-9662765768 [0,0,0,2,0,0|2,0,0]=4 7092 B9R2.14 FC12CCC1CNC2 MCULE-2816224011 [0,0,0,2,0,0|2,0,0]=4 7093 B9R2.14 FC12CCC1CNC2 MCULE-9772415215 [0,0,0,2,0,0|2,0,0]=4 7094 B9R2.36 NC1CCC1C2CC2 MCULE-4508470674 [0,0,0,2,0,0|2,0,0]=4 7095 B9R2.36 NC1CCC1C2CC2 MCULE-9914186076 [0,0,0,2,0,0|2,0,0]=4 7096 B9R2.36 OC1CCC1C2CC2 MCULE-7989017274 [0,0,0,2,0,0|1,0,0]=3 7097 B9R2.79 NCC1CC1C2CC2 MCULE-1102348820 [0,0,0,2,0,0|2,0,0]=4 7098 B9R2.79 NC[C@@H]1C[C@H]1C2CC2 MCULE-8489759375 [0,0,0,2,0,0|2,0,0]=4 7099 B9R2.79 NC[C@@H]1C[C@H]1C2CC2 MCULE-9453887544 [0,0,0,2,0,0|2,0,0]=4 7100 B9R2.187 NC1(CC1)C2CCC2 MCULE-1385394442 [0,0,0,2,0,0|2,0,0]=4 7101 B9R2.187 NC1(CC1)C2CCC2 MCULE-4772823026 [0,0,0,2,0,0|2,0,0]=4 7102 B9R2.156 BrCC1CC2(C1)CC2 MCULE-5044404808 [0,0,0,2,0,0|2,0,0]=4 7103 B9R2.156 NCC1CC2(C1)CC2 MCULE-4776856241 [0,0,0,2,0,0|2,0,0]=4 7104 B9R2.156 NCC1CC2(C1)CC2 MCULE-4941463914 [0,0,0,2,0,0|2,0,0]=4 7105 B9R2.156 OCC1CC2(C1)CC2 MCULE-3153759630 [0,0,0,2,0,0|1,0,0]=3 7106 B9R2.192 NC1(CC1)CC2CC2 MCULE-4315995423 [0,0,0,2,0,0|2,0,0]=4 7107 B9R2.192 NC1(CC1)CC2CC2 MCULE-8053176087 [0,0,0,2,0,0|2,0,0]=4