0 B6R0.3 CC(C)C(=O)CCl D94573 [0,0,0,0,0,0|2,0,0]=2 1 B6R0.3 CC(C)[C@@H](C)CO D93394 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.3 CC[C@H](N)[C@@H](C)O N14663 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.3 CN(C)C(=O)CN FD21613 [0,0,0,0,0,0|3,0,0]=3 4 B6R0.3 CNC(=O)[C@H](C)N C78177 [0,0,0,0,0,0|2,0,0]=2 5 B6R0.3 CNC(=O)[C@H](C)N C78349 [0,0,0,0,0,0|2,0,0]=2 6 B6R0.3 CNC(=O)[C@H](C)N FD21069 [0,0,0,0,0,0|2,0,0]=2 7 B6R0.3 COC(=O)N(C)C D93880 [0,0,0,0,0,0|1,0,0]=1 8 B6R0.3 CSC(=S)N(C)C D93298 [0,0,0,0,0,0|1,2,0]=3 9 B6R0.3 NNC(=O)C(F)F A10612 [0,0,0,0,0,0|4,0,0]=4 10 B6R0.3 O=C(CBr)C(Br)Br F16018 [0,0,0,0,0,0|4,0,0]=4 11 B5R0.1 CCC[C@H](C)N P14575 [1,0,0,0,0,0|2,0,1]=4 12 B5R0.1 CCC[C@H](C)N Y10887 [1,0,0,0,0,0|2,0,1]=4 13 B5R0.1 CNC[C@H](C)O AC1157 [1,0,0,0,0,0|2,0,1]=4 14 B5R0.1 CNC[C@H](C)O N12528 [1,0,0,0,0,0|2,0,1]=4 15 B5R0.1 COC[C@H](C)Br 78860 [1,0,0,0,0,0|1,0,1]=3 16 B5R0.1 COC[C@H](C)N 25526 [1,0,0,0,0,0|1,0,1]=3 17 B5R0.1 COC[C@H](C)N D95458 [1,0,0,0,0,0|1,0,1]=3 18 B5R0.1 COC[C@H](C)N W17998 [1,0,0,0,0,0|1,0,1]=3 19 B5R0.1 C[C@H](O)CON O10313 [1,0,0,0,0,0|2,0,1]=4 20 B5R0.3 CCC(=O)CN S11993 [1,0,0,0,0,0|2,0,0]=3 21 B5R0.3 CC[PH](=O)CC C77650 [1,0,0,0,0,0|2,0,0]=3 22 B5R0.3 COC(=S)NN Y13479 [1,0,0,0,0,0|2,1,0]=4 23 B5R0.3 COC(=S)SC Y14680 [1,0,0,0,0,0|1,1,0]=3 24 B5R0.3 CO[C@@H](C)CN 91001 [1,0,0,0,0,0|2,0,1]=4 25 B5R0.3 CO[C@@H](C)CO 91002 [1,0,0,0,0,0|2,0,1]=4 26 B5R0.5 CC(=O)C(N)=S 93979 [1,0,0,0,0,0|2,0,1]=4 27 B5R0.5 CC(=O)[C@H](C)N D76571 [1,0,0,0,0,0|1,0,0]=2 28 B5R0.5 CC(=S)N(C)C 76921 [1,0,0,0,0,0|1,1,0]=3 29 B5R0.5 CN(C)C(=N)N 71417 [1,0,0,0,0,0|3,0,0]=4 30 B5R0.5 C[C@H](N)C(N)=O 25148 [1,0,0,0,0,0|2,0,0]=3 31 B5R0.5 C[C@H](O)C(=N)N 71516 [1,0,0,0,0,0|3,0,0]=4 32 B5R0.5 C[C@H](O)[C@H](C)O C91323 [1,0,0,0,0,0|1,0,2]=4 33 B7R0.5 CC(C)[C@@H](O)CCN 83602 [0,1,0,0,0,0|1,0,2]=4 34 B7R0.5 CCOC(=O)C(=N)N W18562 [0,1,0,0,0,0|2,0,1]=4 35 B7R0.5 CCOC(=O)[C@H](C)O D75729 [0,1,0,0,0,0|1,0,0]=2 36 B7R0.5 CCSC(=O)[C@H](C)N C14826 [0,1,0,0,0,0|1,1,0]=3 37 B7R0.10 C=C(CCl)C(=O)OC 36746 [0,1,0,0,0,0|0,0,2]=3 38 B7R0.10 C=CC(=O)N(C)OC AT20366 [0,1,0,0,0,0|2,0,1]=4 39 B7R0.10 CC[C@H](Br)C(=O)OC D86786 [0,1,0,0,0,0|1,0,0]=2 40 B7R0.10 CC[C@H](O)C(=O)OC 98375 [0,1,0,0,0,0|1,0,0]=2 41 B7R0.10 CN[C@@H](C)C(=O)OC D84514 [0,1,0,0,0,0|0,0,0]=1 42 B7R0.10 COC(=O)[C@@H](Br)CO AB21729 [0,1,0,0,0,0|1,0,0]=2 43 B7R0.10 COC(=O)[C@@H](C)CBr T71508 [0,1,0,0,0,0|0,0,0]=1 44 B7R0.10 COC(=O)[C@@H](Cl)CCl D77820 [0,1,0,0,0,0|1,0,0]=2 45 B7R0.10 COC(=O)[C@@H](N)CCl FD3044 [0,1,0,0,0,0|1,0,0]=2 46 B7R0.10 COC(=O)[C@@H](O)CN AC4978 [0,1,0,0,0,0|1,0,0]=2 47 B7R0.10 COC(=O)[C@@H](O)CN D97235 [0,1,0,0,0,0|1,0,0]=2 48 B7R0.10 COC(=O)[C@@H](O)CO FD9041 [0,1,0,0,0,0|1,0,0]=2 49 B7R0.14 CC(C)(C)C(=N)NO W12576 [0,1,0,0,0,0|3,0,0]=4 50 B7R0.14 CC(C)(C)C(=O)CN F11054 [0,1,0,0,0,0|2,0,0]=3 51 B7R0.14 CC(C)(C)C(=O)CO F50563 [0,1,0,0,0,0|2,0,0]=3 52 B7R0.14 CC(C)(O)C(=N)NO F18387 [0,1,0,0,0,0|3,0,0]=4 53 B7R0.14 CC(C)(O)C(=O)NN A10178 [0,1,0,0,0,0|2,0,0]=3 54 B7R0.14 CN[S@@](=O)C(C)(C)C D81167 [0,1,0,0,0,0|2,0,0]=3 55 B7R0.15 CC[C@@H](CO)C(C)C C74656 [0,1,0,0,0,0|1,0,2]=4 56 B7R0.15 COC(OC)C(C)C D93459 [0,1,0,0,0,0|0,0,2]=3 57 B7R0.15 COC(OC)[C@H](C)Br AC5914 [0,1,0,0,0,0|1,0,2]=4 58 B7R1.4 CC1=CCOC1=O T72100 [0,0,0,1,0,0|0,0,2]=3 59 B7R1.4 CN1CCN=C1N W16176 [0,0,0,1,0,0|3,0,0]=4 60 B7R1.4 CN1CCNC1=O 81682 [0,0,0,1,0,0|2,0,0]=3 61 B7R1.4 C[C@@H]1CCC[C@@H]1N 72991 [0,0,0,1,0,0|2,0,1]=4 62 B7R1.4 C[C@@H]1CCC[C@@H]1O 72407 [0,0,0,1,0,0|1,0,2]=4 63 B7R1.4 C[C@H]1CCC[C@@H]1O 71002 [0,0,0,1,0,0|1,0,2]=4 64 B7R1.4 NN1CCOC1=O S10190 [0,0,0,1,0,0|2,0,0]=3 65 B7R1.4 N[C@H]1CCNC1=O 51276 [0,0,0,1,0,0|2,0,0]=3 66 B7R1.4 N[C@H]1CCNC1=O 51277 [0,0,0,1,0,0|2,0,0]=3 67 B7R1.4 N[C@H]1CCNC1=O 51278 [0,0,0,1,0,0|2,0,0]=3 68 B7R1.4 N[C@H]1CCNC1=O F14678 [0,0,0,1,0,0|2,0,0]=3 69 B7R1.4 N[C@H]1CCSC1=O O10218 [0,0,0,1,0,0|1,1,0]=3 70 B7R1.4 N[C@H]1CONC1=O FD3007 [0,0,0,1,0,0|3,0,0]=4 71 B7R1.4 O=C1NCC[C@@H]1Br 78555 [0,0,0,1,0,0|2,0,0]=3 72 B7R1.4 O=C1OCC[C@@H]1O F14291 [0,0,0,1,0,0|1,0,0]=2 73 B7R1.4 O[C@H]1CCC=C1Br D79898 [0,0,0,1,0,0|3,0,0]=4 74 B7R1.17 CC1(C)CC[C@@H]1N AT10475 [0,0,0,1,0,0|2,0,1]=4 75 B7R1.19 CC(C)C1(O)CC1 P17163 [0,0,0,1,0,0|1,0,2]=4 76 B7R1.22 CNC(=O)C1CC1 F14269 [0,0,0,1,0,0|1,0,0]=2 77 B7R1.22 O=C(CO)C1CC1 E72699 [0,0,0,1,0,0|2,0,0]=3 78 B7R0.2 CC(C)NC(=O)CBr A12824 [0,0,0,0,0,1|2,0,0]=3 79 B7R0.2 CC(C)NC(=O)CI A11046 [0,0,0,0,0,1|2,0,0]=3 80 B7R0.2 CC(C)OC(=O)CN FD21588 [0,0,0,0,0,1|2,0,0]=3 81 B7R0.2 CC(C)OC(=O)NN A11099 [0,0,0,0,0,1|2,0,0]=3 82 B7R0.2 COC(=O)CC(=N)N AC2408 [0,0,0,0,0,1|2,0,1]=4 83 B7R0.2 COC(=O)C[C@H](C)N FD10418 [0,0,0,0,0,1|1,0,0]=2 84 B7R0.2 COC(=O)C[C@H](C)N S11691 [0,0,0,0,0,1|1,0,0]=2 85 B7R0.2 COC(C)CC(C)O 78061 [0,0,0,0,0,1|2,0,1]=4 86 B7R0.2 CO\C(C)=C/C(C)=O D93418 [0,0,0,0,0,1|2,0,1]=4 87 B4R0.1 C=C[C@H](C)N 81150 [2,0,0,0,0,0|1,0,1]=4 88 B4R0.1 C=C[C@H](C)N C77628 [2,0,0,0,0,0|1,0,1]=4 89 B4R0.1 C=C[C@H](C)N N11410 [2,0,0,0,0,0|1,0,1]=4 90 B4R0.1 CC(C)CBr P19652 [2,0,0,0,0,0|1,0,1]=4 91 B4R0.1 CC[C@H](C)N 74047 [2,0,0,0,0,0|1,0,1]=4 92 B4R0.1 C[C@H](Br)CO W17591 [2,0,0,0,0,0|1,0,1]=4 93 B4R0.1 C\C=C(\C)Br D93160 [2,0,0,0,0,0|1,0,1]=4 94 B4R0.1 NCC(=O)O A10882 [2,0,0,0,0,0|1,0,0]=3 95 B4R0.1 NCC(=O)O T72551 [2,0,0,0,0,0|1,0,0]=3 96 B4R0.1 O=C([O-])C[O-] 47204 [2,0,0,0,0,0|1,0,1]=4 97 B4R0.2 CCONC AT14498 [2,0,0,0,0,0|2,0,0]=4 98 B4R0.2 COCCI A50601 [2,0,0,0,0,0|1,0,1]=4 99 B6R0.1 CCO[C@@H](C)CO 91003 [1,1,0,0,0,0|2,0,0]=4 100 B6R0.1 COC[C@@H](O)CN 94767 [1,1,0,0,0,0|1,0,1]=4 101 B6R0.4 CC(C)OCCBr 33996 [1,1,0,0,0,0|2,0,0]=4 102 B6R0.4 CC(C)OCCN T71353 [1,1,0,0,0,0|2,0,0]=4 103 B6R0.4 CCOC[C@H](C)N 75202 [1,1,0,0,0,0|1,0,1]=4 104 B6R0.5 CC(C)(C)C=NO AR2360 [1,1,0,0,0,0|2,0,0]=4 105 B6R0.5 CC(C)(O)CON AC7988 [1,1,0,0,0,0|1,0,1]=4 106 B6R0.5 CNCC(C)(C)F 85781 [1,1,0,0,0,0|1,0,1]=4 107 B6R0.7 CC(=O)C(C)(C)N 71804 [1,1,0,0,0,0|0,0,0]=2 108 B6R0.7 CC(C)(C)C(=O)[O-] C71251 [1,1,0,0,0,0|0,0,1]=3 109 B6R0.7 CC(C)(Cl)C(=O)Cl S11011 [1,1,0,0,0,0|1,0,0]=3 110 B6R0.7 CC(C)(S)C(=O)O F17054 [1,1,0,0,0,0|0,0,0]=2 111 B6R0.7 CC(C)C(C)(C)Cl H10395 [1,1,0,0,0,0|1,0,1]=4 112 B6R0.7 C[C@H](N)C(C)(C)C F16897 [1,1,0,0,0,0|1,0,1]=4 113 B6R0.7 C[C@H](N)C(C)(C)C N11972 [1,1,0,0,0,0|1,0,1]=4 114 B6R0.7 C[C@H](N)C(C)(C)O 86272 [1,1,0,0,0,0|1,0,1]=4 115 B6R0.7 C[C@H](O)C(C)(C)C D93306 [1,1,0,0,0,0|0,0,2]=4 116 B6R0.7 C[C@H](O)C(C)(C)O D80869 [1,1,0,0,0,0|0,0,2]=4 117 B6R0.7 O=C(O)C(F)(F)F P14585 [1,1,0,0,0,0|2,0,0]=4 118 B6R0.7 O=C(O)C(F)(F)F P15049 [1,1,0,0,0,0|2,0,0]=4 119 B6R0.7 O=C(O)C(F)(F)F P17642 [1,1,0,0,0,0|2,0,0]=4 120 B6R0.7 O=C(O)C(F)(F)F P17643 [1,1,0,0,0,0|2,0,0]=4 121 B6R0.7 O=C(O)C(F)(F)F P18398 [1,1,0,0,0,0|2,0,0]=4 122 B6R0.7 O=C(O)C(F)(F)F P19732 [1,1,0,0,0,0|2,0,0]=4 123 B8R0.2 COC(=O)C(=O)C(C)C 30685 [0,1,0,0,0,1|0,0,0]=2 124 B8R0.2 COC(=O)[C@@H](N)C(C)=O C75090 [0,1,0,0,0,1|1,0,1]=4 125 B8R0.2 COC(=O)[C@@H](O)C(C)C N12468 [0,1,0,0,0,1|0,0,0]=2 126 B8R0.5 CC(C)OC(=O)\C=C/I F19580 [0,1,0,0,0,1|1,0,1]=4 127 B8R0.5 CCOC(=O)C[C@H](C)N H10190 [0,1,0,0,0,1|1,0,0]=3 128 B8R0.5 COCC(=O)OC(C)C C11794 [0,1,0,0,0,1|0,0,0]=2 129 B8R0.19 CC[C@H](N)CC(=O)OC N12944 [0,1,0,0,0,1|1,0,0]=3 130 B8R0.19 CC[C@H](O)CC(=O)OC C15791 [0,1,0,0,0,1|1,0,0]=3 131 B8R0.19 COC(=O)C[C@H](O)CCl A11858 [0,1,0,0,0,1|1,0,0]=3 132 B8R0.19 COC(=O)N[C@@H](C)CN D95526 [0,1,0,0,0,1|0,0,0]=2 133 B8R0.23 C=C(CC(C)C)C(C)=O H11904 [0,1,0,0,0,1|2,0,0]=4 134 B8R0.23 CC(=O)C(=O)OC(C)C C11673 [0,1,0,0,0,1|1,0,0]=3 135 B8R0.23 CC(C)OC(=O)N(C)C A11034 [0,1,0,0,0,1|1,0,0]=3 136 B8R0.23 CN(C)CC(=O)N(C)O T72789 [0,1,0,0,0,1|2,0,0]=4 137 B8R0.24 COC(=O)CC(C)(C)Br A11663 [0,1,0,0,0,1|0,0,0]=2 138 B8R0.24 COC(=O)CC(C)(C)O C75882 [0,1,0,0,0,1|0,0,0]=2 139 B8R0.24 COC(=O)CC(F)(F)F T71999 [0,1,0,0,0,1|2,0,0]=4 140 B8R0.24 COC(=O)NC(C)(C)C A12376 [0,1,0,0,0,1|0,0,0]=2 141 B8R0.34 CCS(=O)(=O)OC(C)C A12044 [0,1,0,0,0,1|2,0,0]=4 142 B8R0.3 C=CC[C@H](N)C(=O)OC 50494 [0,2,0,0,0,0|1,0,0]=3 143 B8R0.3 C=CC[C@H](N)C(=O)OC 78270 [0,2,0,0,0,0|1,0,0]=3 144 B8R0.3 CCCC(=O)C(=O)OC T72754 [0,2,0,0,0,0|1,0,1]=4 145 B8R0.3 CCOC(=O)[C@@H](O)CC T72564 [0,2,0,0,0,0|1,0,0]=3 146 B8R0.3 COC(=O)[C@@H](N)CCBr 52036 [0,2,0,0,0,0|1,0,0]=3 147 B8R0.3 COC(=O)[C@H](C)N=C=O T72257 [0,2,0,0,0,0|0,0,1]=3 148 B8R0.3 COCC(=O)N(C)OC W16959 [0,2,0,0,0,0|1,0,0]=3 149 B8R0.3 COC[C@H](N)C(=O)OC C73433 [0,2,0,0,0,0|1,0,0]=3 150 B8R0.3 CON(C)C(=O)CCBr W10377 [0,2,0,0,0,0|2,0,0]=4 151 B8R0.8 CCCCC(=O)[C@H](C)N C72970 [0,2,0,0,0,0|2,0,0]=4 152 B8R0.8 CN(C)C(=O)CCCCl S12226 [0,2,0,0,0,0|2,0,0]=4 153 B8R0.14 C\C=N\[S@@](=O)C(C)(C)C C90663 [0,2,0,0,0,0|2,0,0]=4 154 B8R0.13 C#CC(C)(C)C(=O)OC AB9700 [0,2,0,0,0,0|0,0,0]=2 155 B8R0.13 CCC(=O)C(C)(C)C=O 31867 [0,2,0,0,0,0|1,0,0]=3 156 B8R0.13 COC(=O)C(C)(C)C=O C72545 [0,2,0,0,0,0|0,0,0]=2 157 B8R0.13 COC(=O)[C@@](C)(N)CO D77168 [0,2,0,0,0,0|0,0,0]=2 158 B8R0.20 CC[C@@H](CO)C(=O)OC AB9727 [0,2,0,0,0,0|0,0,0]=2 159 B8R0.20 CC[C@H](C#N)C(=O)OC Y14710 [0,2,0,0,0,0|0,0,1]=3 160 B8R0.20 COC(=O)C(CN)CN N13257 [0,2,0,0,0,0|0,0,0]=2 161 B8R0.27 C[C@H](Br)C(=O)C(C)(C)C AC1895 [0,2,0,0,0,0|1,0,0]=3 162 B8R0.18 CC(C)N(N=O)C(C)C D77969 [0,2,0,0,0,0|2,0,0]=4 163 B6R1.2 C[C@H]1CCNC1 69327 [1,0,0,1,0,0|1,0,1]=4 164 B6R1.2 C[C@H]1CCSC1 70016 [1,0,0,1,0,0|0,1,1]=4 165 B6R1.2 Cl[C@H]1CCOC1 N12419 [1,0,0,1,0,0|1,0,1]=4 166 B6R1.2 IC1=COCC1 P19286 [1,0,0,1,0,0|1,0,1]=4 167 B6R1.2 I[C@H]1CCOC1 37310 [1,0,0,1,0,0|1,0,1]=4 168 B6R1.2 I[C@H]1CCOC1 37311 [1,0,0,1,0,0|1,0,1]=4 169 B6R1.3 CNCC1CC1 P11100 [1,0,0,1,0,0|1,0,1]=4 170 B6R1.3 NOCC1CC1 59190 [1,0,0,1,0,0|1,0,1]=4 171 B6R1.10 CC1(N)COC1 52948 [1,0,0,1,0,0|1,0,1]=4 172 B6R1.4 C[C@@H]1OCC1=O P16003 [1,0,0,1,0,0|2,0,0]=4 173 B6R1.4 C[C@H]1CCC1=O W18267 [1,0,0,1,0,0|1,0,0]=3 174 B6R1.4 C[C@H]1CNC1=O P20594 [1,0,0,1,0,0|1,0,0]=3 175 B6R1.4 O=C1CC[C@@H]1Br P18435 [1,0,0,1,0,0|2,0,0]=4 176 B8R1.4 CC1=CC(=O)OCC1 D93039 [0,0,0,1,0,1|0,0,1]=3 177 B8R1.4 CN1CCCC(=O)C1 S10664 [0,0,0,1,0,1|2,0,0]=4 178 B8R1.4 C[C@H]1CC(=O)CCN1 37834 [0,0,0,1,0,1|2,0,0]=4 179 B8R1.4 C[C@H]1CC(=O)CCN1 37835 [0,0,0,1,0,1|2,0,0]=4 180 B8R1.4 C[C@H]1CC(=O)CCN1 37846 [0,0,0,1,0,1|2,0,0]=4 181 B8R1.4 C[C@H]1CC(=O)CCO1 P11761 [0,0,0,1,0,1|2,0,0]=4 182 B8R1.4 C[C@H]1CCNC(=O)C1 P11592 [0,0,0,1,0,1|1,0,0]=3 183 B8R1.4 C[C@H]1CCOC(=O)O1 W17381 [0,0,0,1,0,1|0,0,0]=2 184 B8R1.4 C[C@H]1CNCC(=O)N1 38273 [0,0,0,1,0,1|2,0,0]=4 185 B8R1.4 C[C@H]1CNCC(=O)N1 71648 [0,0,0,1,0,1|2,0,0]=4 186 B8R1.4 C[C@H]1CNCC(=O)N1 P10459 [0,0,0,1,0,1|2,0,0]=4 187 B8R1.4 N[C@H]1CCCC(=O)C1 20374 [0,0,0,1,0,1|2,0,0]=4 188 B8R1.4 N[C@H]1CCNC(=O)C1 27397 [0,0,0,1,0,1|2,0,0]=4 189 B8R1.4 O=C1C[C@@H](O)CCN1 68727 [0,0,0,1,0,1|2,0,0]=4 190 B8R1.4 O=C1C[C@@H](O)CCN1 68728 [0,0,0,1,0,1|2,0,0]=4 191 B8R1.18 CN1C[C@@H](N)CC1=O P10878 [0,0,0,1,0,1|2,0,0]=4 192 B8R1.40 COC(=O)CC1CC1 28012 [0,0,0,1,0,1|0,0,0]=2 193 B8R1.51 CC1(C)C=CC(=O)C1 S10959 [0,0,0,1,0,1|1,0,1]=4 194 B8R1.51 CC1(C)CCC(=O)C1 55299 [0,0,0,1,0,1|1,0,0]=3 195 B8R1.51 CC1(C)CCC(=O)N1 30720 [0,0,0,1,0,1|1,0,0]=3 196 B8R1.51 CC1(C)CCC(=O)O1 48435 [0,0,0,1,0,1|1,0,0]=3 197 B8R1.51 CC1(C)CN=C(N)C1 D79278 [0,0,0,1,0,1|2,0,0]=4 198 B8R1.51 CC1(C)CNC(=O)O1 90053 [0,0,0,1,0,1|1,0,0]=3 199 B8R1.51 CC1(C)COC(=O)C1 82056 [0,0,0,1,0,1|0,0,0]=2 200 B8R1.51 CC1(C)COC(=O)N1 38028 [0,0,0,1,0,1|0,0,0]=2 201 B8R1.51 CC1(C)COC(=S)N1 24281 [0,0,0,1,0,1|0,1,0]=3 202 B8R1.51 C[C@@]1(O)CNC(=O)C1 F18103 [0,0,0,1,0,1|2,0,0]=4 203 B8R1.5 CC1NCCOC1C F12405 [0,1,0,1,0,0|1,0,1]=4 204 B8R1.5 C[C@@H]1OCCNC1=O AC4099 [0,1,0,1,0,0|1,0,0]=3 205 B8R1.5 C[C@H]1CCCCC1=O D77719 [0,1,0,1,0,0|1,0,0]=3 206 B8R1.5 C[C@H]1CCCOC1=O AB4082 [0,1,0,1,0,0|0,0,0]=2 207 B8R1.5 C[C@H]1COCCC1=O 27832 [0,1,0,1,0,0|1,0,0]=3 208 B8R1.5 C[C@H]1CSCCC1=O 70869 [0,1,0,1,0,0|1,0,0]=3 209 B8R1.5 N[C@H]1CCCCC1=O C16242 [0,1,0,1,0,0|2,0,0]=4 210 B8R1.5 N[C@H]1CCCNC1=O 11355 [0,1,0,1,0,0|2,0,0]=4 211 B8R1.5 N[C@H]1CCCNC1=O 51546 [0,1,0,1,0,0|2,0,0]=4 212 B8R1.5 O=C1CCOC[C@@H]1Br RB3241 [0,1,0,1,0,0|2,0,0]=4 213 B8R1.5 O=C1NCCC[C@@H]1Br F30215 [0,1,0,1,0,0|2,0,0]=4 214 B8R1.5 O=C1NCCC[C@@H]1O 27231 [0,1,0,1,0,0|2,0,0]=4 215 B8R1.5 O=C1OCCC[C@@H]1O 27422 [0,1,0,1,0,0|1,0,0]=3 216 B8R1.7 CC(C)C1=CC=CO1 81450 [0,1,0,1,0,0|1,0,1]=4 217 B8R1.7 CC(C)C1=NCCO1 T71548 [0,1,0,1,0,0|1,0,0]=3 218 B8R1.19 CC1(C)CCNC1=O 79628 [0,1,0,1,0,0|1,0,0]=3 219 B8R1.19 CC1(C)CCNC1=S W12656 [0,1,0,1,0,0|1,1,0]=4 220 B8R1.19 CC1(C)CONC1=O D73557 [0,1,0,1,0,0|0,0,0]=2 221 B8R1.19 CC1(C)OCCC1=O P18857 [0,1,0,1,0,0|1,0,0]=3 222 B8R1.37 CCCC(=O)C1CC1 P18081 [0,1,0,1,0,0|1,0,0]=3 223 B8R1.37 CCOC(=O)[C@@H]1CO1 20558 [0,1,0,1,0,0|1,0,0]=3 224 B8R1.37 COC[C@H](N)C1CC1 D87133 [0,1,0,1,0,0|1,0,1]=4 225 B8R1.54 C[C@H](Br)C(=O)C1CC1 P15980 [0,1,0,1,0,0|1,0,0]=3 226 B8R1.78 CC(C)C1(O)COC1 69108 [0,1,0,1,0,0|0,0,2]=4 227 B8R1.11 NC[C@H]1CCCC1=O 33703 [0,1,0,1,0,0|1,0,0]=3 228 B8R1.11 O=C1CCC[C@@H]1CO C73905 [0,1,0,1,0,0|1,0,0]=3 229 B8R1.11 O=C1NCC[C@@H]1CO P12214 [0,1,0,1,0,0|1,0,0]=3 230 B8R1.38 CCC(=O)C1COC1 D79147 [0,1,0,1,0,0|1,0,0]=3 231 B8R1.38 CNC(=O)C1CNC1 P20515 [0,1,0,1,0,0|1,0,0]=3 232 B8R1.38 COC(=O)C1COC1 81275 [0,1,0,1,0,0|0,0,0]=2 233 B8R1.38 COC(=O)[C@@H]1CCN1 38788 [0,1,0,1,0,0|0,0,0]=2 234 B8R1.38 CO[C@@H](C)C1CNC1 F20233 [0,1,0,1,0,0|1,0,1]=4 235 B8R1.39 O=C(CCl)C1(Cl)CC1 D88098 [0,1,0,1,0,0|2,0,0]=4 236 B8R1.50 CC1=C(Br)COC1=O W19136 [0,1,0,1,0,0|0,0,2]=4 237 B8R1.50 CN1CCN(C)C1=O D77693 [0,1,0,1,0,0|2,0,0]=4 238 B8R1.50 CN1CC[C@H](Br)C1=O C77641 [0,1,0,1,0,0|2,0,0]=4 239 B8R1.50 CN1CC[C@H](N)C1=O 51274 [0,1,0,1,0,0|2,0,0]=4 240 B8R2.38 O=C1CCC2CC12 P19135 [0,0,0,2,0,0|1,0,0]=3 241 B8R2.38 O=C1CCC2OC12 60057 [0,0,0,2,0,0|2,0,0]=4 242 B8R2.19 O=C1CCC12CC2 P10135 [0,0,0,2,0,0|1,0,0]=3