0 B10R0.74 CCC=CCCOC(=O)CC CSC020656764 [0,0,0,0,0,0|1,0,2]=3 1 B10R0.74 CCCCCCCC(=O)NN CSC000181853 [0,0,0,0,0,0|2,0,0]=2 2 B10R0.74 CCCCCCCC(=O)OC CSC011217195 [0,0,0,0,0,0|1,0,0]=1 3 B10R0.74 CCCCCCNC(=O)NC CSC000235370 [0,0,0,0,0,0|2,0,0]=2 4 B10R0.74 CCOCCCNC(=O)CC CSC000161224 [0,0,0,0,0,0|2,0,0]=2 5 B10R0.74 CCOCCSCC(=O)OC CSC000001124 [0,0,0,0,0,0|3,0,0]=3 6 B9R0.2 CCC=CCCOC(=O)C CSC015190845 [1,0,0,0,0,0|1,0,2]=4 7 B9R0.2 CCCCCCCC(=O)N CSC011216093 [1,0,0,0,0,0|1,0,0]=2 8 B9R0.2 CCCCCCOC(=O)C CSC000032130 [1,0,0,0,0,0|1,0,0]=2 9 B9R0.2 CCOCCCNC(=O)C CSC000161218 [1,0,0,0,0,0|2,0,0]=3 10 B9R0.45 CCCCCCSCCO CSC011304839 [1,0,0,0,0,0|2,0,1]=4 11 B9R0.45 CCCCSCCOCC CSC000053094 [1,0,0,0,0,0|2,0,0]=3 12 B9R0.45 CCSCCCCSCC CSC000116838 [1,0,0,0,0,0|2,0,0]=3 13 B9R0.45 CSCCCCCCSC CSC000036278 [1,0,0,0,0,0|2,0,1]=4 14 B9R0.46 CCC(=O)NCCCOC CSC000159236 [1,0,0,0,0,0|2,0,0]=3 15 B9R0.46 CCCCCCC(=O)NN CSC011221127 [1,0,0,0,0,0|2,0,0]=3 16 B9R0.46 CCCCCCC(=O)OC CSC011215249 [1,0,0,0,0,0|1,0,0]=2 17 B9R0.46 CCCCCNC(=O)CC CSC000157985 [1,0,0,0,0,0|1,0,0]=2 18 B9R0.46 CCCCCOC(=O)CC CSC000031694 [1,0,0,0,0,0|1,0,0]=2 19 B9R0.46 CNC(=O)NCCCOC CSC000235188 [1,0,0,0,0,0|3,0,0]=4 20 B11R0.4 CCCC(=O)OCCC=CCC CSC020647322 [0,1,0,0,0,0|1,0,2]=4 21 B11R0.4 CCCCCCOC(=O)CCC CSC000037829 [0,1,0,0,0,0|1,0,0]=2 22 B11R0.4 CCCCSCCC(=O)OCC CSC011325042 [0,1,0,0,0,0|1,0,0]=2 23 B11R0.4 CCNC(=O)NCCCCCO CSC012017630 [0,1,0,0,0,0|2,0,0]=3 24 B11R0.4 CCOCCCNC(=O)CNC CSC000213102 [0,1,0,0,0,0|2,0,0]=3 25 B11R0.4 CCOCCCNC(=O)COC CSC000161240 [0,1,0,0,0,0|2,0,0]=3 26 B11R0.40 CCCCCCCCC(=O)NN CSC011203378 [0,1,0,0,0,0|2,0,0]=3 27 B11R0.40 CCCCCCCCC(=O)OC CSC011215467 [0,1,0,0,0,0|1,0,0]=2 28 B11R0.40 CCCCCCCOC(=O)CC CSC000054044 [0,1,0,0,0,0|0,0,0]=1 29 B11R0.42 CCCCCCCC(=O)N(C)C CSC011221089 [0,1,0,0,0,0|1,0,0]=2 30 B11R0.42 CCCCCCOC(=O)C(C)C CSC000047476 [0,1,0,0,0,0|1,0,0]=2 31 B11R0.42 CCOCCCNC(=O)C(C)C CSC000242899 [0,1,0,0,0,0|2,0,0]=3 32 B11R0.49 CCOCCCNS(=O)(=O)CC CSC000169739 [0,1,0,0,0,0|3,0,0]=4 33 B11R0.70 COCCN(C)CCC(=O)OC CSC011397890 [0,1,0,0,0,0|3,0,0]=4 34 B11R0.106 CCC(=O)OCCOC(=O)CC CSC009881842 [0,1,0,0,0,0|2,0,1]=4 35 B11R0.111 CCC(=O)NCCCOC(C)C CSC000161843 [0,1,0,0,0,0|2,0,0]=3 36 B11R0.142 CCCCCCC(C)C(=O)OC CSC000076249 [0,1,0,0,0,0|1,0,0]=2 37 B11R0.142 CCCCCNC(=O)C(=O)NC CSC017399059 [0,1,0,0,0,0|2,0,1]=4 38 B11R0.154 CCCCCC(C)NC(=O)CC CSC000174102 [0,1,0,0,0,0|1,0,0]=2 39 B11R0.154 CCCCCC(O)CC(=O)OC CSC000074991 [0,1,0,0,0,0|1,0,0]=2 40 B11R1.1 CCCCN1CCC(CC1)C CSC000021023 [0,0,0,1,0,0|2,0,1]=4 41 B11R1.1 CCCCN1CCC(CC1)N CSC000746687 [0,0,0,1,0,0|2,0,1]=4 42 B11R1.1 FCCCN1CCS(=O)CC1 CSC015258420 [0,0,0,1,0,0|3,0,0]=4 43 B11R1.13 CC1N(CCNC1=O)CCN CSC000723484 [0,0,0,1,0,0|3,0,0]=4 44 B11R1.13 CC1N(CCNC1=O)CCO CSC046198574 [0,0,0,1,0,0|3,0,0]=4 45 B11R1.25 CCC(=O)NCC1CCCO1 CSC000158285 [0,0,0,1,0,0|2,0,0]=3 46 B11R1.25 CCC(=O)OCC1CCCO1 CSC000006213 [0,0,0,1,0,0|2,0,0]=3 47 B11R1.25 CNC(=O)NCC1CCCO1 CSC000235169 [0,0,0,1,0,0|3,0,0]=4 48 B11R1.25 NNC(=O)CCC1CCCC1 CSC000189796 [0,0,0,1,0,0|2,0,0]=3 49 B11R1.40 CCC(=O)NC1CCCCC1 CSC000158241 [0,0,0,1,0,0|1,0,0]=2 50 B11R1.40 CCC(C)NC1CCCCC1 CSC000199872 [0,0,0,1,0,0|2,0,1]=4 51 B11R1.40 CNC(=O)CC1CSCCN1 CSC012481271 [0,0,0,1,0,0|3,0,0]=4 52 B11R1.40 CNC(=O)CN1CCOCC1 CSC000174636 [0,0,0,1,0,0|3,0,0]=4 53 B11R1.40 CNC(=O)NC1CCCOC1 CSC011885672 [0,0,0,1,0,0|3,0,0]=4 54 B11R1.40 COC(=O)C=C1CCCCC1 CSC011528868 [0,0,0,1,0,0|1,0,2]=4 55 B11R1.40 COC(=O)CC1CCOCC1 CSC012001292 [0,0,0,1,0,0|2,0,0]=3 56 B11R1.40 COC(=O)CN1CCCCC1 CSC000188175 [0,0,0,1,0,0|2,0,0]=3 57 B11R1.40 COC(=O)CN1CCOCC1 CSC000188174 [0,0,0,1,0,0|3,0,0]=4 58 B11R1.40 COC(=O)NC1CCCCC1 CSC000235984 [0,0,0,1,0,0|2,0,0]=3 59 B11R1.40 NCC(=O)NC1CCCCC1 CSC000168466 [0,0,0,1,0,0|2,0,0]=3 60 B11R1.59 CCC(=O)N1CCCC1CN CSC011917856 [0,0,0,1,0,0|2,0,0]=3 61 B11R1.59 CCC(=O)N1CCCC1CO CSC011474038 [0,0,0,1,0,0|2,0,0]=3 62 B11R1.59 CCC(=O)N1CCC[C@@H]1CO CSC012446565 [0,0,0,1,0,0|2,0,0]=3 63 B11R1.59 CCC(=O)N1CCC[C@H]1CO CSC012003344 [0,0,0,1,0,0|2,0,0]=3 64 B11R1.59 CNC(=O)N1CCCC1CO CSC012074075 [0,0,0,1,0,0|3,0,0]=4 65 B11R1.59 CNC(=O)N1CCC[C@@H]1CO CSC012074071 [0,0,0,1,0,0|3,0,0]=4 66 B11R1.59 CNC(=O)N1CCC[C@H]1CO CSC012074066 [0,0,0,1,0,0|3,0,0]=4 67 B11R1.189 CCCC1CN(CCO1)CC CSC015951768 [0,0,0,1,0,0|3,0,0]=4 68 B11R1.189 CCN1CCCC(C1)CNC CSC011236291 [0,0,0,1,0,0|3,0,0]=4 69 B11R1.189 CCN1CCCC(C1)CSC CSC046562855 [0,0,0,1,0,0|3,0,0]=4 70 B11R1.222 CNC(=O)N1CCCCC1C CSC000235144 [0,0,0,1,0,0|2,0,0]=3 71 B11R1.222 COC(=O)C1CCCCC1C CSC023680028 [0,0,0,1,0,0|1,0,0]=2 72 B11R1.222 COC(=O)C1CCCCN1C CSC000234682 [0,0,0,1,0,0|2,0,0]=3 73 B11R1.222 C[C@@H]1COCCN1C(=O)CO CSC016133227 [0,0,0,1,0,0|3,0,0]=4 74 B11R1.852 CCC(=O)N1CCCCCC1 CSC000157761 [0,0,0,1,0,0|1,0,0]=2 75 B11R1.852 CNC(=O)C1CNCCOC1 CSC009876474 [0,0,0,1,0,0|3,0,0]=4 76 B11R1.852 CNC(=O)N1CCCOCC1 CSC011600321 [0,0,0,1,0,0|3,0,0]=4 77 B11R1.852 COC(=O)C1CCCCCC1 CSC000699111 [0,0,0,1,0,0|1,0,0]=2 78 B11R1.852 COC(=O)N1CCCNCC1 CSC000748934 [0,0,0,1,0,0|3,0,0]=4 79 B8R0.4 CCCCCCCSC CSC000033844 [2,0,0,0,0,0|1,0,0]=3 80 B8R0.4 CCCCCCSCC CSC000073868 [2,0,0,0,0,0|1,0,0]=3 81 B8R0.4 CCCCCSCCO CSC011215970 [2,0,0,0,0,0|2,0,0]=4 82 B8R0.4 CCCCSCCCC CSC000025195 [2,0,0,0,0,0|1,0,0]=3 83 B8R0.4 CSCCCCCCO CSC012179070 [2,0,0,0,0,0|2,0,0]=4 84 B8R0.4 CSCCCCCSC CSC009866234 [2,0,0,0,0,0|2,0,0]=4 85 B8R0.7 CCCCSCC(=C)C CSC000026947 [2,0,0,0,0,0|2,0,0]=4 86 B8R0.6 CCCSCC(=O)OC CSC000151543 [2,0,0,0,0,0|2,0,0]=4 87 B8R0.6 COC(=O)CCCSC CSC011216297 [2,0,0,0,0,0|2,0,0]=4 88 B10R0.3 CCOC(=O)CCCC(=O)C CSC000032325 [1,1,0,0,0,0|1,0,1]=4 89 B10R0.4 CC(=O)OCCCCCC=C CSC000037147 [1,1,0,0,0,0|0,0,2]=4 90 B10R0.4 CCCCCCCNC(=O)C CSC009862821 [1,1,0,0,0,0|0,0,0]=2 91 B10R0.4 CCCCCCCNC(=O)N CSC009878357 [1,1,0,0,0,0|1,0,0]=3 92 B10R0.4 CCCCCCCOC(=O)C CSC000036323 [1,1,0,0,0,0|0,0,0]=2 93 B10R0.4 CCCCOCCOC(=O)C CSC000032999 [1,1,0,0,0,0|1,0,0]=3 94 B10R0.4 COCCOCCOC(=O)C CSC000062832 [1,1,0,0,0,0|2,0,0]=4 95 B10R0.22 CCCCCCNS(=O)(=O)C CSC000171105 [1,1,0,0,0,0|2,0,0]=4 96 B10R0.97 CC(C)OCCCNC(=O)C CSC000161839 [1,1,0,0,0,0|2,0,0]=4 97 B10R0.1 CCCCCCC(=O)OCC CSC011219609 [1,1,0,0,0,0|1,0,1]=4 98 B10R0.71 CCCCCCCSCCO CSC011304838 [1,1,0,0,0,0|1,0,0]=3 99 B10R0.71 CCCCSCCOCCO CSC011409991 [1,1,0,0,0,0|2,0,0]=4 100 B10R0.62 CCCCCNS(=O)(=O)CC CSC000180710 [1,1,0,0,0,0|2,0,0]=4 101 B12R0.1 CCCCCCCCC(=O)OCC CSC011218606 [0,2,0,0,0,0|0,0,0]=2 102 B12R0.1 CCCCCCCCS(=O)CCO CSC009995003 [0,2,0,0,0,0|1,0,0]=3 103 B12R0.1 CCCCOCCOC(=O)CCC CSC000053117 [0,2,0,0,0,0|1,0,0]=3 104 B12R0.4 CCCCCCNC(=O)CC(C)C CSC017395171 [0,2,0,0,0,0|1,0,0]=3 105 B12R0.4 CCCCCCOC(=O)CC(C)C CSC000047473 [0,2,0,0,0,0|1,0,0]=3 106 B12R0.49 CCCCCCNC(=O)C(=O)NC CSC018968012 [0,2,0,0,0,0|1,0,1]=4 107 B12R0.49 CCCNCCNC(=O)C(C)SC CSC057354748 [0,2,0,0,0,0|2,0,0]=4 108 B12R0.206 CCCCCCCC(C)NCCO CSC000713784 [0,2,0,0,0,0|1,0,1]=4 109 B12R0.206 CCCCSCCC(=O)NCCN CSC057563660 [0,2,0,0,0,0|1,0,0]=3 110 B12R0.206 CCCNC(=O)NCCCOCC CSC000181040 [0,2,0,0,0,0|2,0,0]=4 111 B12R0.239 CCSCCC(C)NC(=O)CCN CSC012918467 [0,2,0,0,0,0|2,0,0]=4 112 B12R0.239 CCSCCC(C)NC(=O)CNC CSC012933041 [0,2,0,0,0,0|2,0,0]=4 113 B12R0.277 CNCC(=O)NCCCOC(C)C CSC000225790 [0,2,0,0,0,0|2,0,0]=4 114 B12R0.277 COCC(=O)NCCCOC(C)C CSC000161849 [0,2,0,0,0,0|2,0,0]=4 115 B12R0.285 CCOC(=O)CCCC(=O)OCC CSC000034583 [0,2,0,0,0,0|1,0,1]=4 116 B12R0.57 CCN(CC)CCCCCCCN CSC011233305 [0,2,0,0,0,0|2,0,0]=4 117 B12R0.183 COC(=O)CCCCCC(=O)OC CSC000032064 [0,2,0,0,0,0|1,0,1]=4 118 B12R0.248 CCCCCCCCCC(=O)NN CSC011221126 [0,2,0,0,0,0|2,0,0]=4 119 B12R0.248 CCCCCCCCCC(=O)OC CSC011215519 [0,2,0,0,0,0|1,0,0]=3 120 B12R0.248 CCCCCCCCOC(=O)CC CSC000054043 [0,2,0,0,0,0|0,0,0]=2 121 B12R0.248 CCCCCCCSCC(=O)OC CSC000048336 [0,2,0,0,0,0|1,0,0]=3 122 B12R0.251 CCCCCCCOC(=O)C(C)C CSC000053816 [0,2,0,0,0,0|0,0,0]=2 123 B12R0.42 CC(C)OCCCNC(=O)C(C)C CSC000242903 [0,2,0,0,0,0|2,0,0]=4 124 B12R0.123 CCSCCC(C)NC(=O)[C@H](C)N CSC012918465 [0,2,0,0,0,0|2,0,0]=4 125 B12R0.237 CCCCCCOC(=O)C(C)(C)C CSC000053815 [0,2,0,0,0,0|1,0,0]=3 126 B12R0.237 CCOCCCNC(=O)C(C)(C)C CSC011197887 [0,2,0,0,0,0|2,0,0]=4 127 B12R0.328 CCCCS(=O)(=O)NCC(=O)CC CSC017051177 [0,2,0,0,0,0|2,0,0]=4 128 B12R0.657 CCCCCS(=O)(=O)CC(=O)NC CSC017406319 [0,2,0,0,0,0|2,0,0]=4 129 B10R1.18 CC(=O)CN1CCCCC1 CSC000180294 [1,0,0,1,0,0|1,0,0]=3 130 B10R1.18 CC(=O)CN1CCOCC1 CSC000180433 [1,0,0,1,0,0|2,0,0]=4 131 B10R1.18 CC(=O)NC1CCCCC1 CSC000158227 [1,0,0,1,0,0|1,0,0]=3 132 B10R1.18 CC(=O)NC1CCCOC1 CSC011884898 [1,0,0,1,0,0|2,0,0]=4 133 B10R1.18 CC(=O)NC1CCSCC1 CSC011670947 [1,0,0,1,0,0|2,0,0]=4 134 B10R1.18 CC(=O)OC1CCCCC1 CSC000026541 [1,0,0,1,0,0|1,0,0]=3 135 B10R1.18 NC(=O)CC1CCCCO1 CSC000725203 [1,0,0,1,0,0|2,0,0]=4 136 B10R1.18 NC(=O)OC1CCCCC1 CSC000123476 [1,0,0,1,0,0|2,0,0]=4 137 B10R1.39 CC(=O)N1CCCC1CN CSC000706156 [1,0,0,1,0,0|2,0,0]=4 138 B10R1.39 CC(=O)N1CCCC1CO CSC011474066 [1,0,0,1,0,0|2,0,0]=4 139 B10R1.39 CC(=O)N1CCC[C@H]1CO CSC012003343 [1,0,0,1,0,0|2,0,0]=4 140 B10R1.39 CCC1CCCN1C(=O)N CSC011386413 [1,0,0,1,0,0|2,0,0]=4 141 B10R1.39 CCC1NCCC1C(=O)N CSC015706231 [1,0,0,1,0,0|2,0,0]=4 142 B10R1.39 CCN1CCC[C@H]1C(=O)N CSC015708101 [1,0,0,1,0,0|2,0,0]=4 143 B10R1.61 CC1CCCCN1C(=O)N CSC000238911 [1,0,0,1,0,0|2,0,0]=4 144 B10R1.61 CC1CNCCN1C(=O)C CSC011725993 [1,0,0,1,0,0|2,0,0]=4 145 B10R1.61 CC1NCCCC1C(=O)N CSC012079615 [1,0,0,1,0,0|2,0,0]=4 146 B10R1.61 CC1OCCCC1C(=O)N CSC016159393 [1,0,0,1,0,0|2,0,0]=4 147 B10R1.61 C[C@@H]1CNCCN1C(=O)C CSC012025876 [1,0,0,1,0,0|2,0,0]=4 148 B10R1.61 C[C@@H]1COCCN1C(=O)C CSC014106315 [1,0,0,1,0,0|2,0,0]=4 149 B10R1.61 C[C@H]1CNCCN1C(=O)C CSC012025909 [1,0,0,1,0,0|2,0,0]=4 150 B10R1.64 CC1OCCC1NC(=O)C CSC013100664 [1,0,0,1,0,0|2,0,0]=4 151 B10R1.66 CC(=O)NCC1CCCN1 CSC011696608 [1,0,0,1,0,0|2,0,0]=4 152 B10R1.66 CC(=O)NCC1CCCO1 CSC000158280 [1,0,0,1,0,0|2,0,0]=4 153 B10R1.66 CC(=O)NCC1CCSC1 CSC014215000 [1,0,0,1,0,0|2,0,0]=4 154 B10R1.66 CC(=O)OCC1CCCO1 CSC000006207 [1,0,0,1,0,0|2,0,0]=4 155 B10R1.66 NC(=O)CCC1CCCC1 CSC000162258 [1,0,0,1,0,0|1,0,0]=3 156 B10R1.66 NC(=O)COC1CCCC1 CSC011347441 [1,0,0,1,0,0|2,0,0]=4 157 B10R1.348 CC(=O)N1CCCCCC1 CSC000157747 [1,0,0,1,0,0|1,0,0]=3 158 B10R1.348 NC(=O)C1CCCCCC1 CSC011707493 [1,0,0,1,0,0|1,0,0]=3 159 B10R1.4 CCCN1CCCCC1C CSC046166745 [1,0,0,1,0,0|1,0,1]=4 160 B10R1.5 CCCN1CCCC1CC CSC047626652 [1,0,0,1,0,0|1,0,1]=4 161 B10R1.5 CCN1CCCC1CSC CSC048120051 [1,0,0,1,0,0|2,0,0]=4 162 B10R1.5 CCNC1CCCC1CC CSC011467320 [1,0,0,1,0,0|1,0,0]=3 163 B10R1.17 CCCCN1CCCCC1 CSC000223645 [1,0,0,1,0,0|1,0,1]=4 164 B10R1.17 CCCCN1CCNCC1 CSC011194250 [1,0,0,1,0,0|2,0,0]=4 165 B10R1.17 CCCCN1CCOCC1 CSC000224583 [1,0,0,1,0,0|2,0,0]=4 166 B10R1.17 CCCCN1CCSCC1 CSC015913980 [1,0,0,1,0,0|2,0,0]=4 167 B10R1.17 CCCNC1CCOCC1 CSC000714517 [1,0,0,1,0,0|2,0,0]=4 168 B10R1.17 CCNCC1CCCCC1 CSC000201244 [1,0,0,1,0,0|1,0,0]=3 169 B10R1.17 CCSCC1CCCCO1 CSC015326925 [1,0,0,1,0,0|2,0,0]=4 170 B10R1.19 CCN1CCSCCC1C CSC046211526 [1,0,0,1,0,0|2,0,0]=4 171 B10R1.20 CCC1CCCCN1CC CSC046242840 [1,0,0,1,0,0|1,0,0]=3 172 B10R1.21 CCCCNC1CCCC1 CSC000200677 [1,0,0,1,0,0|1,0,1]=4 173 B10R1.29 CCCCN1CCCC1C CSC016237178 [1,0,0,1,0,0|1,0,1]=4 174 B10R1.29 CCCNC1CCCC1C CSC011467334 [1,0,0,1,0,0|1,0,1]=4 175 B10R1.29 CCCSC1CCOC1C CSC015237125 [1,0,0,1,0,0|2,0,0]=4 176 B10R1.85 CCCN1CCCCCC1 CSC000238004 [1,0,0,1,0,0|1,0,1]=4 177 B10R1.85 CCNC1CCCCCC1 CSC000201170 [1,0,0,1,0,0|1,0,0]=3 178 B10R1.15 CCC(=O)N1CCCCC1 CSC000157697 [1,0,0,1,0,0|1,0,0]=3 179 B10R1.15 CCC(=O)N1CCCOC1 CSC015458340 [1,0,0,1,0,0|2,0,0]=4 180 B10R1.15 CCC(=O)N1CCOCC1 CSC000158654 [1,0,0,1,0,0|2,0,0]=4 181 B10R1.15 CCN(C)C1CCCCC1 CSC046083630 [1,0,0,1,0,0|2,0,0]=4 182 B10R1.15 CCS(=O)C1CCCOC1 CSC015420257 [1,0,0,1,0,0|2,0,0]=4 183 B10R1.15 CNC(=O)C1CCCCC1 CSC000159838 [1,0,0,1,0,0|1,0,0]=3 184 B10R1.15 CNC(=O)C1CCCCO1 CSC012026083 [1,0,0,1,0,0|2,0,0]=4 185 B10R1.15 CNC(=O)C1CCCOC1 CSC000698928 [1,0,0,1,0,0|2,0,0]=4 186 B10R1.15 CNC(=O)C1CCSCC1 CSC016062598 [1,0,0,1,0,0|2,0,0]=4 187 B10R1.15 COC(=O)C1CCCCC1 CSC000148678 [1,0,0,1,0,0|1,0,0]=3 188 B10R1.15 COC(=O)C1CCCCO1 CSC011625642 [1,0,0,1,0,0|2,0,0]=4 189 B10R1.15 COC(=O)C1CCCOC1 CSC011744426 [1,0,0,1,0,0|2,0,0]=4 190 B10R1.15 COC(=O)C1CCOCC1 CSC000193737 [1,0,0,1,0,0|2,0,0]=4 191 B10R1.15 COC(=O)C1CCSCC1 CSC000070458 [1,0,0,1,0,0|2,0,0]=4 192 B10R1.15 COC(=O)N1CCCCC1 CSC000235962 [1,0,0,1,0,0|2,0,0]=4 193 B10R1.15 OCC(=O)N1CCCCC1 CSC011315646 [1,0,0,1,0,0|2,0,0]=4 194 B10R1.27 CCC(=O)NC1CCCC1 CSC000160926 [1,0,0,1,0,0|1,0,0]=3 195 B10R1.27 CCN(C)CC1CCCC1 CSC046197611 [1,0,0,1,0,0|2,0,0]=4 196 B10R1.27 CNC(=O)CC1CCCN1 CSC011463786 [1,0,0,1,0,0|2,0,0]=4 197 B10R1.27 CNC(=O)CC1CCCO1 CSC011295658 [1,0,0,1,0,0|2,0,0]=4 198 B10R1.27 CNC(=O)NC1CCCC1 CSC000235269 [1,0,0,1,0,0|2,0,0]=4 199 B10R1.27 COC(=O)CC1CCCC1 CSC000148925 [1,0,0,1,0,0|1,0,0]=3 200 B10R1.27 COC(=O)CC1CCCO1 CSC000244803 [1,0,0,1,0,0|2,0,0]=4 201 B10R1.27 ClCC(=O)NC1CCCC1 CSC000183512 [1,0,0,1,0,0|2,0,0]=4 202 B10R1.27 NCC(=O)NC1CCCC1 CSC000168434 [1,0,0,1,0,0|2,0,0]=4 203 B10R1.149 CNC(=O)C1CCCN1C CSC000054904 [1,0,0,1,0,0|2,0,0]=4 204 B10R1.149 CNC(=O)C1CCOC1C CSC012638678 [1,0,0,1,0,0|2,0,0]=4 205 B10R1.149 CNC(=O)[C@H]1CNC[C@@H]1C [1,0,0,1,0,0|2,0,0]=4 206 B10R1.149 COC(=O)C1CCCC1C CSC013347292 [1,0,0,1,0,0|1,0,0]=3 207 B10R1.172 CCC1CCCN(C1)CC CSC046135315 [1,0,0,1,0,0|2,0,0]=4 208 B12R1.32 CCCC(=O)OC1CCCCC1 CSC000026545 [0,1,0,1,0,0|1,0,0]=3 209 B12R1.32 CCNC(=O)CN1CCNCC1 CSC000245842 [0,1,0,1,0,0|2,0,0]=4 210 B12R1.32 CCNC(=O)NC1CCOCC1 CSC011406943 [0,1,0,1,0,0|2,0,0]=4 211 B12R1.32 CCOC(=O)CC1=CCCCC1 CSC011899744 [0,1,0,1,0,0|0,0,2]=4 212 B12R1.32 CCOC(=O)CC1CCCCC1 CSC000171474 [0,1,0,1,0,0|0,0,0]=2 213 B12R1.32 CCOC(=O)CC1CCOCC1 CSC011218914 [0,1,0,1,0,0|1,0,0]=3 214 B12R1.32 CCOC(=O)CN1CCOCC1 CSC000188100 [0,1,0,1,0,0|2,0,0]=4 215 B12R1.32 CCOC(=O)CN1CCSCC1 CSC011247055 [0,1,0,1,0,0|2,0,0]=4 216 B12R1.32 CNCC(=O)NC1CCCCC1 CSC000168119 [0,1,0,1,0,0|1,0,0]=3 217 B12R1.32 COCC(=O)NC1CCCCC1 CSC000158260 [0,1,0,1,0,0|1,0,0]=3 218 B12R1.32 O=C(CC#N)NC1CCCCC1 CSC000182395 [0,1,0,1,0,0|1,0,1]=4 219 B12R1.51 CCCC(=O)NCC1CCCO1 CSC000158282 [0,1,0,1,0,0|2,0,0]=4 220 B12R1.51 CCCC(=O)OCC1CCCO1 CSC000006210 [0,1,0,1,0,0|2,0,0]=4 221 B12R1.51 CCNC(=O)CCC1CCCC1 CSC000160163 [0,1,0,1,0,0|0,0,0]=2 222 B12R1.51 CCOC(=O)CCC1CCCC1 CSC000170312 [0,1,0,1,0,0|0,0,0]=2 223 B12R1.51 CNCC(=O)NCC1CCCO1 CSC000178247 [0,1,0,1,0,0|2,0,0]=4 224 B12R1.51 COCC(=O)NCC1CCCO1 CSC000158294 [0,1,0,1,0,0|2,0,0]=4 225 B12R1.308 CC1CCCCC1N(C)CCN CSC011508919 [0,1,0,1,0,0|2,0,0]=4 226 B12R1.308 CC1CCCCC1N(C)CCO CSC011509091 [0,1,0,1,0,0|2,0,0]=4 227 B12R1.308 CC1CNCCN1C(=O)CCN CSC046217803 [0,1,0,1,0,0|2,0,0]=4 228 B12R1.308 CCNC(=O)[C@H]1NCCO[C@@H]1C CSC046167690 [0,1,0,1,0,0|2,0,0]=4 229 B12R1.308 CNCC(=O)N1CCNCC1C CSC046092090 [0,1,0,1,0,0|2,0,0]=4 230 B12R1.308 CNCC(=O)N1CCNC[C@@H]1C CSC046090799 [0,1,0,1,0,0|2,0,0]=4 231 B12R1.308 CNCC(=O)N1CCNC[C@H]1C CSC046138935 [0,1,0,1,0,0|2,0,0]=4 232 B12R1.308 C[C@@H]1CNCCN1C(=O)CCN CSC046110455 [0,1,0,1,0,0|2,0,0]=4 233 B12R1.308 C[C@H]1CNCCN1C(=O)CCN CSC046217872 [0,1,0,1,0,0|2,0,0]=4 234 B12R1.923 CCOCCCNC(=O)C1CC1 CSC000161226 [0,1,0,1,0,0|2,0,0]=4 235 B12R1.1564 CCCC(=O)N1CCCNCC1 CSC000743687 [0,1,0,1,0,0|2,0,0]=4 236 B12R1.1564 CCNC(=O)C1CCCCCC1 CSC011750764 [0,1,0,1,0,0|0,0,0]=2 237 B12R1.1564 CCOC(=O)C1CCCCCC1 CSC011707495 [0,1,0,1,0,0|0,0,0]=2 238 B12R1.1564 CN(CCN)C1CCCCCC1 CSC000719583 [0,1,0,1,0,0|2,0,0]=4 239 B12R1.1564 CN(CCO)C1CCCCCC1 CSC011324929 [0,1,0,1,0,0|2,0,0]=4 240 B12R1.1564 CNCC(=O)N1CCCCCC1 CSC000180253 [0,1,0,1,0,0|1,0,0]=3 241 B12R1.1564 COCC(=O)N1CCCCCC1 CSC000157780 [0,1,0,1,0,0|1,0,0]=3 242 B12R1.1564 COCC(=O)N1CCCNCC1 CSC011193471 [0,1,0,1,0,0|2,0,0]=4 243 B12R1.1564 O=C(CC#N)N1CCCCCC1 CSC011222978 [0,1,0,1,0,0|1,0,1]=4 244 B12R1.1 CCCCNC1CCN(CC1)C CSC000200678 [0,1,0,1,0,0|2,0,0]=4 245 B12R1.25 CCCCN1CCCC(C1C)O CSC011033792 [0,1,0,1,0,0|0,0,2]=4 246 B12R1.27 CCC(=O)NCC1CCNCC1 CSC011207001 [0,1,0,1,0,0|1,0,0]=3 247 B12R1.27 CCC(C)NCC1CCCCC1 CSC000199897 [0,1,0,1,0,0|1,0,1]=4 248 B12R1.27 CNC(=O)CCC1CCCNC1 CSC011533958 [0,1,0,1,0,0|1,0,0]=3 249 B12R1.27 CNC(=O)CCN1CCOCC1 CSC011255422 [0,1,0,1,0,0|2,0,0]=4 250 B12R1.27 CNC(=O)NCC1CCCOC1 CSC011407004 [0,1,0,1,0,0|2,0,0]=4 251 B12R1.27 CNC(=O)NCC1CCOCC1 CSC011653241 [0,1,0,1,0,0|2,0,0]=4 252 B12R1.27 COC(=O)CCN1CCOCC1 CSC000177612 [0,1,0,1,0,0|2,0,0]=4 253 B12R1.27 COC(=O)CSC1CCCCC1 CSC000173156 [0,1,0,1,0,0|1,0,0]=3 254 B12R1.27 NNC(=O)CCC1CCCCC1 CSC000186192 [0,1,0,1,0,0|2,0,0]=4 255 B12R1.77 CCC(O)C1CCCCN1CC CSC046167499 [0,1,0,1,0,0|0,0,2]=4 256 B12R1.77 CCC1CCCCC1C(=O)NC CSC015914215 [0,1,0,1,0,0|1,0,0]=3 257 B12R1.77 CCC1COCCN1C(=O)CN CSC011324800 [0,1,0,1,0,0|2,0,0]=4 258 B12R1.77 NCC1CCCCN1C(=O)CN CSC046240825 [0,1,0,1,0,0|2,0,0]=4 259 B12R1.291 CNC(=O)N1CCCC1CCO CSC013726346 [0,1,0,1,0,0|2,0,0]=4 260 B12R1.291 COCC1CCCN1C(=O)CN CSC010278140 [0,1,0,1,0,0|2,0,0]=4 261 B12R1.353 CN1CCCC1CNC(=O)CN CSC011598846 [0,1,0,1,0,0|2,0,0]=4 262 B12R1.353 CNC(=O)NCC1CCCC1C CSC014234560 [0,1,0,1,0,0|1,0,0]=3 263 B12R1.371 CC1NCCCC1NC(=O)CN CSC040907872 [0,1,0,1,0,0|2,0,0]=4 264 B12R1.371 CCC(=O)NC1CCCCC1C CSC000161644 [0,1,0,1,0,0|0,0,0]=2 265 B12R1.371 CCC(O)CN1CCCCC1C CSC011366114 [0,1,0,1,0,0|0,0,2]=4 266 B12R1.371 CC[C@H](O)CN1CCCCC1C CSC014600984 [0,1,0,1,0,0|0,0,2]=4 267 B12R1.371 CNC(=O)CC1CCCCC1C CSC015366596 [0,1,0,1,0,0|1,0,0]=3 268 B12R1.371 CNC(=O)CN1CCNCC1C CSC015925670 [0,1,0,1,0,0|2,0,0]=4 269 B12R1.371 CNC(=O)CN1CCNC[C@@H]1C CSC013103483 [0,1,0,1,0,0|2,0,0]=4 270 B12R1.371 CNC(=O)CN1CCNC[C@H]1C CSC013103667 [0,1,0,1,0,0|2,0,0]=4 271 B12R1.371 CNC(=O)CN1CCOC[C@H]1C CSC015352531 [0,1,0,1,0,0|2,0,0]=4 272 B12R1.371 CNC(=O)NC1CCCCC1C CSC000235251 [0,1,0,1,0,0|1,0,0]=3 273 B12R1.371 COC(=O)CN1CCCCC1C CSC000227854 [0,1,0,1,0,0|1,0,0]=3 274 B12R1.371 NCC(=O)N[C@H]1CCCC[C@@H]1N [0,1,0,1,0,0|2,0,0]=4 275 B12R1.371 OCC(=O)N[C@@H]1CCCC[C@H]1O CSC015480343 [0,1,0,1,0,0|2,0,0]=4 276 B12R1.371 OCC(=O)N[C@H]1CCCC[C@@H]1O CSC016157977 [0,1,0,1,0,0|2,0,0]=4 277 B12R1.477 COC(=O)CCCN1CCCC1 CSC011293840 [0,1,0,1,0,0|1,0,0]=3 278 B12R1.1659 COC(=O)C1CCCCCCC1 CSC012181116 [0,1,0,1,0,0|1,0,0]=3 279 B12R1.1748 CCC(=O)NC1CCCCCC1 CSC000161071 [0,1,0,1,0,0|0,0,0]=2 280 B12R1.1748 CCC(=O)NC1CCCOCC1 CSC015415222 [0,1,0,1,0,0|1,0,0]=3 281 B12R1.1748 CCC(O)CN1CCCCCC1 CSC011366127 [0,1,0,1,0,0|0,0,2]=4 282 B12R1.1748 CC[C@H](O)CN1CCCCCC1 CSC014600988 [0,1,0,1,0,0|0,0,2]=4 283 B12R1.1748 CNC(=O)CC1CCCCCC1 CSC012651756 [0,1,0,1,0,0|1,0,0]=3 284 B12R1.1748 CNC(=O)CC1CCCNCC1 CSC015248807 [0,1,0,1,0,0|1,0,0]=3 285 B12R1.1748 CNC(=O)NC1CCCCCC1 CSC000235309 [0,1,0,1,0,0|1,0,0]=3 286 B12R1.1748 CNC(=O)NC1CCCOCC1 CSC015310950 [0,1,0,1,0,0|2,0,0]=4 287 B12R1.1748 COC(=O)CN1CCCCCC1 CSC000223722 [0,1,0,1,0,0|1,0,0]=3 288 B12R1.43 CC(C)C(=O)NC1CCCCC1 CSC000173418 [0,1,0,1,0,0|1,0,0]=3 289 B12R1.43 CC(C)C(=O)OC1CCCCC1 CSC000026543 [0,1,0,1,0,0|1,0,0]=3 290 B12R1.43 CC(O)C(=O)NC1CCCOC1 CSC016092644 [0,1,0,1,0,0|2,0,0]=4 291 B12R1.43 CN(C)C(=O)CC1CCNCC1 CSC000707012 [0,1,0,1,0,0|2,0,0]=4 292 B12R1.43 C[C@@H](O)C(=O)NC1CCCOC1 CSC015755108 [0,1,0,1,0,0|2,0,0]=4 293 B12R1.43 C[C@@H](O)C(=O)NC1CCSCC1 CSC015917286 [0,1,0,1,0,0|2,0,0]=4 294 B12R1.43 C[C@H](O)C(=O)NC1CCCOC1 CSC015957066 [0,1,0,1,0,0|2,0,0]=4 295 B12R1.43 C[C@H](O)C(=O)NC1CCSCC1 CSC015312625 [0,1,0,1,0,0|2,0,0]=4 296 B12R1.80 CC(C)C(=O)N1CCCC1CO CSC011474029 [0,1,0,1,0,0|2,0,0]=4 297 B12R1.80 CC(C)C(=O)N1CCC[C@@H]1CO CSC012446592 [0,1,0,1,0,0|2,0,0]=4 298 B12R1.80 CC(C)C(=O)N1CCC[C@H]1CO CSC012003346 [0,1,0,1,0,0|2,0,0]=4 299 B12R1.80 CC(O)C(=O)N1CCCC1CO CSC010886473 [0,1,0,1,0,0|2,0,0]=4 300 B12R1.80 CC(O)C(=O)N1CCC[C@H]1CO CSC016092643 [0,1,0,1,0,0|2,0,0]=4 301 B12R1.80 C[C@@H](O)C(=O)N1CCCC1CO CSC015631906 [0,1,0,1,0,0|2,0,0]=4 302 B12R1.80 C[C@@H](O)C(=O)N1CCC[C@@H]1CO CSC016206378 [0,1,0,1,0,0|2,0,0]=4 303 B12R1.80 C[C@@H](O)C(=O)N1CCC[C@H]1CO CSC016108596 [0,1,0,1,0,0|2,0,0]=4 304 B12R1.80 C[C@H](O)C(=O)N1CCCC1CO CSC015266282 [0,1,0,1,0,0|2,0,0]=4 305 B12R1.80 C[C@H](O)C(=O)N1CCC[C@@H]1CO CSC015771181 [0,1,0,1,0,0|2,0,0]=4 306 B12R1.80 C[C@H](O)C(=O)N1CCC[C@H]1CO CSC015901733 [0,1,0,1,0,0|2,0,0]=4 307 B12R1.124 CC(N)C(=O)N1CCNCC1C CSC037794512 [0,1,0,1,0,0|2,0,0]=4 308 B12R1.124 CC(N)C(=O)N1CCNC[C@@H]1C CSC040371055 [0,1,0,1,0,0|2,0,0]=4 309 B12R1.124 CC(N)C(=O)N1CCNC[C@H]1C CSC046190137 [0,1,0,1,0,0|2,0,0]=4 310 B12R1.124 C[C@@H](N)C(=O)N1CCNCC1C CSC046112638 [0,1,0,1,0,0|2,0,0]=4 311 B12R1.124 C[C@@H](N)C(=O)N1CCNC[C@@H]1C CSC046175791 [0,1,0,1,0,0|2,0,0]=4 312 B12R1.124 C[C@@H](N)C(=O)N1CCNC[C@H]1C CSC046181278 [0,1,0,1,0,0|2,0,0]=4 313 B12R1.124 C[C@H](N)C(=O)N1CCNCC1C CSC046155929 [0,1,0,1,0,0|2,0,0]=4 314 B12R1.124 C[C@H](N)C(=O)N1CCNC[C@@H]1C CSC046242918 [0,1,0,1,0,0|2,0,0]=4 315 B12R1.124 C[C@H](N)C(=O)N1CCNC[C@H]1C CSC046193903 [0,1,0,1,0,0|2,0,0]=4 316 B12R1.264 CC(C)C(=O)NCC1CCCO1 CSC000242874 [0,1,0,1,0,0|2,0,0]=4 317 B12R1.2197 CC(C)C(=O)N1CCCCCC1 CSC000171293 [0,1,0,1,0,0|1,0,0]=3 318 B12R1.2197 CC(C)C(=O)N1CCCOCC1 CSC011599041 [0,1,0,1,0,0|2,0,0]=4 319 B12R1.2197 CC(O)C(=O)N1CCCCCC1 CSC011315614 [0,1,0,1,0,0|1,0,0]=3 320 B12R1.194 CCS(=O)(=O)NC1CCCCC1 CSC000169552 [0,1,0,1,0,0|2,0,0]=4 321 B12R1.1161 CCS(=O)(=O)N1CCCCCC1 CSC000169502 [0,1,0,1,0,0|2,0,0]=4 322 B12R1.26 CNC(=O)NCC1CCC(C1)C CSC014233728 [0,1,0,1,0,0|2,0,0]=4 323 B12R1.1657 CCC(=O)N1CCCOC(C1)C CSC011788125 [0,1,0,1,0,0|2,0,0]=4 324 B12R1.1677 CNC(=O)NCC1(CCCC1)C CSC011930005 [0,1,0,1,0,0|2,0,0]=4 325 B12R1.49 CCC(=O)NC1CCN(CC1)C CSC000203664 [0,1,0,1,0,0|2,0,0]=4 326 B12R1.49 CCC(=O)N[C@H]1CC[C@@H](CC1)C [0,1,0,1,0,0|1,0,0]=3 327 B12R1.49 CCC(O)CN1CCS(=O)CC1 CSC011498455 [0,1,0,1,0,0|2,0,0]=4 328 B12R1.49 CC[C@H](O)CN1CCS(=O)CC1 CSC014601133 [0,1,0,1,0,0|2,0,0]=4 329 B12R1.49 CNC(=O)CC1CCN(CC1)C CSC010272828 [0,1,0,1,0,0|2,0,0]=4 330 B12R1.49 CNC(=O)CN1CCC(CC1)C CSC000006996 [0,1,0,1,0,0|2,0,0]=4 331 B12R1.49 CNC(=O)N[C@H]1CC[C@@H](CC1)C [0,1,0,1,0,0|2,0,0]=4 332 B12R1.49 COC(=O)CN1CCC(CC1)C CSC000188176 [0,1,0,1,0,0|2,0,0]=4 333 B12R1.49 COC(=O)CN1CCC(CC1)N CSC011193518 [0,1,0,1,0,0|2,0,0]=4 334 B12R1.435 CCC(=O)N1CCCC(C1)NC CSC011696138 [0,1,0,1,0,0|2,0,0]=4 335 B12R1.435 CCC1CC(CCO1)C(=O)NC CSC016164863 [0,1,0,1,0,0|2,0,0]=4 336 B12R1.1658 CCC(=O)N1CCCN(CC1)C CSC000161551 [0,1,0,1,0,0|2,0,0]=4 337 B12R1.50 CCC(=O)NC1CCCC(C1)C CSC011236953 [0,1,0,1,0,0|1,0,0]=3 338 B12R1.50 CCC(=O)NC1CCNC(C1)C CSC014149061 [0,1,0,1,0,0|2,0,0]=4 339 B12R1.50 CCC(=O)NC1CCOC(C1)C CSC013164502 [0,1,0,1,0,0|2,0,0]=4 340 B12R1.50 CNC(=O)CC1CCCC(C1)C CSC015438458 [0,1,0,1,0,0|1,0,0]=3 341 B12R1.50 CNC(=O)CN1CCCC(C1)N CSC011448242 [0,1,0,1,0,0|2,0,0]=4 342 B12R1.50 CNC(=O)CN1CCC[C@H](C1)N CSC013924324 [0,1,0,1,0,0|2,0,0]=4 343 B12R1.50 CNC(=O)NC1CCCC(C1)C CSC011256138 [0,1,0,1,0,0|2,0,0]=4 344 B12R1.50 COC(=O)CN1CCCC(C1)C CSC000224321 [0,1,0,1,0,0|2,0,0]=4 345 B12R1.50 COC(=O)CN1CCCC(C1)N CSC011448299 [0,1,0,1,0,0|2,0,0]=4 346 B12R1.366 COC(=O)C1CCCCC1(F)F CSC010961397 [0,1,0,1,0,0|2,0,0]=4 347 B12R1.34 CN(C1CCCCC1)C(=O)CN CSC000766916 [0,1,0,1,0,0|2,0,0]=4 348 B12R1.34 COC(=O)C(C)N1CCCCC1 CSC000216032 [0,1,0,1,0,0|2,0,0]=4 349 B12R1.1731 CNC(=O)C1(CCCCCC1)C CSC015439064 [0,1,0,1,0,0|1,0,0]=3 350 B12R1.3524 CCC(=O)NC1(CCCCC1)C CSC011431649 [0,1,0,1,0,0|1,0,0]=3 351 B12R1.3524 CCC(=O)NC1(CCNCC1)C CSC013719111 [0,1,0,1,0,0|2,0,0]=4 352 B12R1.3524 CCC(=O)NC1(CCOCC1)C CSC013022105 [0,1,0,1,0,0|2,0,0]=4 353 B12R1.3524 CCS(=O)CC1(CCCCC1)C CSC047398230 [0,1,0,1,0,0|1,0,0]=3 354 B12R1.3524 CNC(=O)CC1(CCCCC1)C CSC015439065 [0,1,0,1,0,0|1,0,0]=3 355 B12R1.3524 CNC(=O)NC1(CCCCC1)C CSC012047697 [0,1,0,1,0,0|2,0,0]=4 356 B12R1.16 CCCC(=O)N1CCC(=O)CC1 CSC000162424 [0,1,0,1,0,0|1,0,1]=4 357 B12R2.294 C=C1CCN(CC1)CC2CC2 CSC046244933 [0,0,0,2,0,0|2,0,0]=4 358 B12R2.295 COC(=O)C1CC12CCCC2 CSC015323421 [0,0,0,2,0,0|1,0,0]=3 359 B12R2.1596 COC(=O)C1CC2CCC1C2 CSC000222203 [0,0,0,2,0,0|1,0,0]=3 360 B12R2.1596 NNC(=O)C1CC2CCC1C2 CSC000233534 [0,0,0,2,0,0|2,0,0]=4 361 B12R2.1596 OCC(=O)N1CC2CCC1C2 CSC015375244 [0,0,0,2,0,0|2,0,0]=4 362 B12R2.29 CCN1CC2CCCC(C2)C1 CSC046109115 [0,0,0,2,0,0|2,0,0]=4 363 B12R2.32 CCN1CC2CCCCC2C1 CSC046415530 [0,0,0,2,0,0|2,0,0]=4 364 B12R2.32 CCN1C[C@H]2CCCC[C@H]2C1 [0,0,0,2,0,0|2,0,0]=4 365 B12R2.3511 COC(=O)C1C2C1CCCC2 CSC000765033 [0,0,0,2,0,0|1,0,0]=3 366 B12R2.3511 NNC(=O)C1C2C1CCCC2 CSC012951966 [0,0,0,2,0,0|2,0,0]=4 367 B12R2.315 CCN1CCCC2C1CCC2 CSC046515009 [0,0,0,2,0,0|2,0,0]=4 368 B12R2.43 CCN1CCCC(C1)C2CC2 CSC016159350 [0,0,0,2,0,0|2,0,0]=4