0 B8R0.5 CC(C)OC(=O)\C=C/I F19580 [0,0,0,0,0,0|3,0,1]=4 1 B8R0.5 CCCC(=O)CC(C)=O 79568 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.5 CCC[C@H](C)CC(C)C F17729 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.5 CCOC(=O)CC(=O)[O-] C15698 [0,0,0,0,0,0|2,0,1]=3 4 B8R0.5 CCOC(=O)C[C@H](C)N H10190 [0,0,0,0,0,0|1,0,0]=1 5 B8R0.5 COCC(=O)OC(C)C C11794 [0,0,0,0,0,0|3,0,0]=3 6 B7R0.2 CC(C)NC(=O)CBr A12824 [1,0,0,0,0,0|2,0,0]=3 7 B7R0.2 CC(C)NC(=O)CI A11046 [1,0,0,0,0,0|2,0,0]=3 8 B7R0.2 CC(C)OC(=O)CN FD21588 [1,0,0,0,0,0|2,0,0]=3 9 B7R0.2 CC(C)OC(=O)NN A11099 [1,0,0,0,0,0|3,0,0]=4 10 B7R0.2 COC(=O)CC(=N)N AC2408 [1,0,0,0,0,0|2,0,1]=4 11 B7R0.2 COC(=O)C[C@H](C)N FD10418 [1,0,0,0,0,0|1,0,0]=2 12 B7R0.2 COC(=O)C[C@H](C)N S11691 [1,0,0,0,0,0|1,0,0]=2 13 B7R0.2 COC(C)CC(C)O 78061 [1,0,0,0,0,0|2,0,1]=4 14 B7R0.4 CC(C)CCCCBr C74820 [1,0,0,0,0,0|2,0,1]=4 15 B7R0.4 CCCNCC(C)C AC1640 [1,0,0,0,0,0|2,0,0]=3 16 B7R0.7 C=C=CC(=O)OCC T71774 [1,0,0,0,0,0|0,0,3]=4 17 B7R0.7 CCNC(=O)CCCl Y14703 [1,0,0,0,0,0|2,0,0]=3 18 B7R0.7 CCNC(=O)CNC A12930 [1,0,0,0,0,0|2,0,0]=3 19 B7R0.7 CCOC(=O)C#CBr C15771 [1,0,0,0,0,0|1,0,2]=4 20 B7R0.7 CCOP(C)OCC 28742 [1,0,0,0,0,0|3,0,0]=4 21 B7R0.7 COCC(=O)COC 36699 [1,0,0,0,0,0|3,0,0]=4 22 B9R0.4 CC(=O)CC(=O)NCCO A11018 [0,1,0,0,0,0|2,0,1]=4 23 B9R0.4 CC(C)NC(=O)NCCN AR2165 [0,1,0,0,0,0|2,0,0]=3 24 B9R0.6 CCOC(=O)C(=O)C(C)=O C15077 [0,1,0,0,0,0|1,0,2]=4 25 B9R0.6 CCOC(=O)C(=O)[C@H](C)Br C10122 [0,1,0,0,0,0|1,0,1]=3 26 B9R0.6 CCOC(=O)[C@@H](C)C(=O)[O-] AC8075 [0,1,0,0,0,0|2,0,1]=4 27 B9R0.6 CCOC(=O)[C@@H](C)C(N)=S W18275 [0,1,0,0,0,0|2,0,1]=4 28 B9R0.23 C=C(CC(C)C)C(=O)OC W19515 [0,1,0,0,0,0|3,0,0]=4 29 B9R0.23 CC(C)OC(=O)[C@@H](N)CO C13272 [0,1,0,0,0,0|3,0,0]=4 30 B9R0.23 COC(=O)C(=O)CC(C)C 29859 [0,1,0,0,0,0|2,0,0]=3 31 B9R0.34 CCOC(=O)CC(=N)NO Y14772 [0,1,0,0,0,0|2,0,1]=4 32 B9R0.34 CCOC(=O)C[C@@H](C)CC D78451 [0,1,0,0,0,0|0,0,0]=1 33 B9R0.34 CCOC(=O)C[C@H](C)NC AC6615 [0,1,0,0,0,0|0,0,0]=1 34 B9R0.34 CCOC(=O)C[C@H](O)CCl 32733 [0,1,0,0,0,0|1,0,0]=2 35 B9R0.34 CCOC(=O)NC(=O)CCl D75421 [0,1,0,0,0,0|2,0,1]=4 36 B9R0.44 CCC[C@H](C)CC(C)(C)C D92889 [0,1,0,0,0,0|2,0,1]=4 37 B9R0.44 CCOC(=O)CC(C)(C)O O11777 [0,1,0,0,0,0|0,0,0]=1 38 B9R0.44 CCOC(=O)CS(=O)(=O)Cl A12640 [0,1,0,0,0,0|3,0,0]=4 39 B9R0.44 CNNC(=O)OC(C)(C)C FD1328 [0,1,0,0,0,0|3,0,0]=4 40 B9R0.53 CC(C)OC(=O)OC(C)C C76030 [0,1,0,0,0,0|1,0,0]=2 41 B9R0.53 CC(Cl)OC(=O)OC(C)Cl A10514 [0,1,0,0,0,0|2,0,0]=3 42 B9R1.13 CN(C)C[C@H]1CCCO1 70867 [0,0,0,1,0,0|2,0,1]=4 43 B9R1.34 CC1CC(=O)CC(C)N1 32785 [0,0,0,1,0,0|2,0,0]=3 44 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)O1 P14153 [0,0,0,1,0,0|2,0,0]=3 45 B9R1.38 CC1(C)CC(=O)NC1=O AB9146 [0,0,0,1,0,0|2,0,1]=4 46 B9R1.48 C[C@H]1CC(=O)NCCN1 38322 [0,0,0,1,0,0|2,0,0]=3 47 B9R1.48 C[C@H]1CCCCC(=O)N1 W19298 [0,0,0,1,0,0|2,0,0]=3 48 B9R1.48 O=C1CCCNC(=O)C1 F12567 [0,0,0,1,0,0|2,0,1]=4 49 B9R1.66 CC1(C)CCCC(=O)N1 W17371 [0,0,0,1,0,0|2,0,0]=3 50 B9R1.66 CC1(C)CCC[C@H](N)C1 P17894 [0,0,0,1,0,0|2,0,1]=4 51 B9R1.66 CC1(C)CNCC(=O)N1 C91375 [0,0,0,1,0,0|3,0,0]=4 52 B7R0.5 CCOC(=O)C(=N)N W18562 [0,0,0,0,1,0|2,0,1]=4 53 B7R0.5 CCOC(=O)[C@H](C)O D75729 [0,0,0,0,1,0|1,0,0]=2 54 B7R0.5 CCSC(=O)[C@H](C)N C14826 [0,0,0,0,1,0|1,1,0]=3 55 B9R0.48 C=C(C)CCC(=O)OCC A11234 [0,0,0,0,0,1|0,0,2]=3 56 B9R0.48 CC(C)CNC(=O)CCN D86301 [0,0,0,0,0,1|2,0,0]=3 57 B9R0.48 CCOC(=O)CC[C@H](C)Br C77584 [0,0,0,0,0,1|1,0,0]=2 58 B9R0.48 CCOC(=O)CC[N+](=O)[O-] F11926 [0,0,0,0,0,1|3,0,0]=4 59 B9R0.48 CCOC(=O)NCC(=O)O D76651 [0,0,0,0,0,1|2,0,1]=4 60 B9R0.48 CCOC(=O)OCC(C)C A12452 [0,0,0,0,0,1|0,0,0]=1 61 B9R0.48 CCOC(=O)\C=C\C(C)=O 71109 [0,0,0,0,0,1|1,0,2]=4 62 B6R0.1 CCC[C@@H](Br)CC D78429 [2,0,0,0,0,0|1,0,1]=4 63 B6R0.1 CCNC(=O)CO 79517 [2,0,0,0,0,0|2,0,0]=4 64 B6R0.1 CNC(=O)CCN C75423 [2,0,0,0,0,0|2,0,0]=4 65 B6R0.1 CNC(=O)CCO AC6610 [2,0,0,0,0,0|2,0,0]=4 66 B6R0.1 CNC(=O)CCS A11187 [2,0,0,0,0,0|2,0,0]=4 67 B6R0.1 COC(=O)OCCl R10013 [2,0,0,0,0,0|2,0,0]=4 68 B6R0.2 CC(C)CC(N)=O C75541 [2,0,0,0,0,0|1,0,0]=3 69 B6R0.2 CC(C)NC(N)=O 44261 [2,0,0,0,0,0|2,0,0]=4 70 B6R0.2 C[C@H](O)CC(=O)O C10552 [2,0,0,0,0,0|1,0,0]=3 71 B6R0.4 CCOC[C@H](C)N 75202 [2,0,0,0,0,0|1,0,0]=3 72 B6R0.6 CCOCCCBr A11082 [2,0,0,0,0,0|1,0,1]=4 73 B6R0.6 CC\C=C/CCI 98107 [2,0,0,0,0,0|2,0,0]=4 74 B8R0.2 COC(=O)C(=O)C(C)C 30685 [1,1,0,0,0,0|0,0,1]=3 75 B8R0.2 COC(=O)[C@@H](N)C(C)=O C75090 [1,1,0,0,0,0|1,0,1]=4 76 B8R0.2 COC(=O)[C@@H](O)C(C)C N12468 [1,1,0,0,0,0|0,0,0]=2 77 B8R0.19 CC[C@H](N)CC(=O)OC N12944 [1,1,0,0,0,0|1,0,0]=3 78 B8R0.19 CC[C@H](O)CC(=O)OC C15791 [1,1,0,0,0,0|1,0,0]=3 79 B8R0.19 COC(=O)C[C@H](O)CCl A11858 [1,1,0,0,0,0|1,0,0]=3 80 B8R0.19 COC(=O)N[C@@H](C)CN D95526 [1,1,0,0,0,0|1,0,0]=3 81 B8R0.23 C=C(CC(C)C)C(C)=O H11904 [1,1,0,0,0,0|1,0,1]=4 82 B8R0.23 CC(=O)C(=O)OC(C)C C11673 [1,1,0,0,0,0|1,0,1]=4 83 B8R0.23 CC(C)OC(=O)N(C)C A11034 [1,1,0,0,0,0|2,0,0]=4 84 B8R0.23 CN(C)CC(=O)N(C)O T72789 [1,1,0,0,0,0|2,0,0]=4 85 B8R0.24 COC(=O)CC(C)(C)Br A11663 [1,1,0,0,0,0|0,0,0]=2 86 B8R0.24 COC(=O)CC(C)(C)O C75882 [1,1,0,0,0,0|0,0,0]=2 87 B8R0.24 COC(=O)CC(F)(F)F T71999 [1,1,0,0,0,0|2,0,0]=4 88 B8R0.24 COC(=O)NC(C)(C)C A12376 [1,1,0,0,0,0|1,0,0]=3 89 B8R0.34 CCS(=O)(=O)OC(C)C A12044 [1,1,0,0,0,0|2,0,0]=4 90 B8R0.7 CN(C)CCOCCO D77714 [1,1,0,0,0,0|1,0,1]=4 91 B8R0.28 CC(C)OCOC(C)C D93413 [1,1,0,0,0,0|1,0,1]=4 92 B8R0.1 CCCC(=O)OCCO D81566 [1,1,0,0,0,0|0,0,0]=2 93 B8R0.1 CCNC(=O)NCCN AR2426 [1,1,0,0,0,0|2,0,0]=4 94 B8R0.1 CCOC(=O)CCC#N 82565 [1,1,0,0,0,0|0,0,1]=3 95 B8R0.1 CCOC(=O)CCC=O AB9300 [1,1,0,0,0,0|0,0,1]=3 96 B8R0.1 CCOC(=O)CCCO C91677 [1,1,0,0,0,0|0,0,0]=2 97 B8R0.3 CCCC(=O)C(=O)OC T72754 [1,1,0,0,0,0|2,0,0]=4 98 B8R0.3 CCOC(=O)[C@@H](O)CC T72564 [1,1,0,0,0,0|0,0,0]=2 99 B10R0.108 CCCC(=O)OC[C@@H](O)CO A10828 [0,1,0,0,0,1|2,0,0]=4 100 B10R0.108 CCOC(=O)CCC(=O)CBr 79134 [0,1,0,0,0,1|1,0,1]=4 101 B10R0.108 CCOC(=O)CNC(=O)OC 74367 [0,1,0,0,0,1|1,0,1]=4 102 B10R0.108 CCOC(=O)NCC(=O)OC AB7223 [0,1,0,0,0,1|1,0,1]=4 103 B10R0.109 CCOC(=O)C#C[Si](C)(C)C D84547 [0,1,0,0,0,1|0,1,1]=4 104 B10R0.6 CC(=O)CC(=O)OCCC#N AC1591 [0,2,0,0,0,0|1,0,1]=4 105 B10R0.6 CC(C)NC(=O)NCCCN AR2456 [0,2,0,0,0,0|2,0,0]=4 106 B10R0.28 CC(C)(C)OC(=O)CCCCl D83903 [0,2,0,0,0,0|2,0,0]=4 107 B10R0.28 CC(C)(C)OC(=O)CCCN C13415 [0,2,0,0,0,0|2,0,0]=4 108 B10R0.28 CC(C)(C)OC(=O)NCCI A50737 [0,2,0,0,0,0|2,0,0]=4 109 B10R0.28 CCCNC(=O)OC(C)(C)C AB22355 [0,2,0,0,0,0|2,0,0]=4 110 B10R0.28 CCNCC(=O)OC(C)(C)C C10118 [0,2,0,0,0,0|2,0,0]=4 111 B10R0.81 CC(C)[C@H](N)C(=O)OCCO 43949 [0,2,0,0,0,0|0,0,0]=2 112 B10R0.35 CCOC(=O)[C@@H](C)C(=O)CC AB10080 [0,2,0,0,0,0|1,0,1]=4 113 B10R0.35 CCOC(=O)[C@@H](N)[C@H](C)CC AC2330 [0,2,0,0,0,0|0,0,0]=2 114 B10R0.36 CCOC(=O)C(C)(C)C(C)=O AB1430 [0,2,0,0,0,0|1,0,1]=4 115 B10R0.100 CCOC(=O)[C@@H](C)C(F)(F)F I10922 [0,2,0,0,0,0|2,0,0]=4 116 B10R0.70 CC(C)CN(CC(C)C)N=O D93202 [0,2,0,0,0,0|2,0,0]=4 117 B10R0.79 CCOC(CC(C)C)OCC D93100 [0,2,0,0,0,0|0,0,2]=4 118 B10R0.37 CC[C@H](O)C(=O)OC(C)(C)C C73921 [0,2,0,0,0,0|2,0,0]=4 119 B10R0.2 CCOC(=O)\C=C(/C)OCC AC2253 [0,2,0,0,0,0|0,0,2]=4 120 B10R0.31 CC(C)NC(=O)OC(C)(C)C W12431 [0,2,0,0,0,0|1,0,0]=3 121 B10R0.31 C[C@H](Cl)OC(=O)OC(C)(C)C A12961 [0,2,0,0,0,0|1,0,0]=3 122 B8R1.4 CC1=CC(=O)OCC1 D93039 [1,0,0,1,0,0|0,0,2]=4 123 B8R1.4 CN1CCCC(=O)C1 S10664 [1,0,0,1,0,0|1,0,0]=3 124 B8R1.4 C[C@@H]1CCC[C@H](N)C1 D84824 [1,0,0,1,0,0|1,0,1]=4 125 B8R1.4 C[C@H]1CC(=O)CCN1 37834 [1,0,0,1,0,0|1,0,0]=3 126 B8R1.4 C[C@H]1CC(=O)CCN1 37835 [1,0,0,1,0,0|1,0,0]=3 127 B8R1.4 C[C@H]1CC(=O)CCN1 37846 [1,0,0,1,0,0|1,0,0]=3 128 B8R1.4 C[C@H]1CC(=O)CCO1 P11761 [1,0,0,1,0,0|1,0,0]=3 129 B8R1.4 C[C@H]1CCNC(=O)C1 P11592 [1,0,0,1,0,0|1,0,0]=3 130 B8R1.4 C[C@H]1CCOC(=O)O1 W17381 [1,0,0,1,0,0|1,0,0]=3 131 B8R1.4 C[C@H]1CNCC(=O)N1 38273 [1,0,0,1,0,0|2,0,0]=4 132 B8R1.4 C[C@H]1CNCC(=O)N1 71648 [1,0,0,1,0,0|2,0,0]=4 133 B8R1.4 C[C@H]1CNCC(=O)N1 P10459 [1,0,0,1,0,0|2,0,0]=4 134 B8R1.4 N[C@H]1CCCC(=O)C1 20374 [1,0,0,1,0,0|1,0,0]=3 135 B8R1.4 N[C@H]1CCNC(=O)C1 27397 [1,0,0,1,0,0|2,0,0]=4 136 B8R1.4 O=C1C[C@@H](O)CCN1 68727 [1,0,0,1,0,0|2,0,0]=4 137 B8R1.4 O=C1C[C@@H](O)CCN1 68728 [1,0,0,1,0,0|2,0,0]=4 138 B8R1.18 CN1C[C@@H](N)CC1=O P10878 [1,0,0,1,0,0|2,0,0]=4 139 B8R1.40 COC(=O)CC1CC1 28012 [1,0,0,1,0,0|0,0,0]=2 140 B8R1.42 CC(C)CC1(N)CC1 F14584 [1,0,0,1,0,0|1,0,1]=4 141 B8R1.51 CC1(C)C=CC(=O)C1 S10959 [1,0,0,1,0,0|0,0,2]=4 142 B8R1.51 CC1(C)CCC(=O)C1 55299 [1,0,0,1,0,0|0,0,0]=2 143 B8R1.51 CC1(C)CCC(=O)N1 30720 [1,0,0,1,0,0|1,0,0]=3 144 B8R1.51 CC1(C)CCC(=O)O1 48435 [1,0,0,1,0,0|1,0,0]=3 145 B8R1.51 CC1(C)CC[C@H](N)C1 P16857 [1,0,0,1,0,0|1,0,1]=4 146 B8R1.51 CC1(C)CN=C(N)C1 D79278 [1,0,0,1,0,0|2,0,0]=4 147 B8R1.51 CC1(C)CNC(=O)O1 90053 [1,0,0,1,0,0|2,0,0]=4 148 B8R1.51 CC1(C)COC(=O)C1 82056 [1,0,0,1,0,0|0,0,0]=2 149 B8R1.51 CC1(C)COC(=O)N1 38028 [1,0,0,1,0,0|1,0,0]=3 150 B8R1.51 CC1(C)COC(=S)N1 24281 [1,0,0,1,0,0|1,1,0]=4 151 B8R1.51 C[C@@]1(O)CNC(=O)C1 F18103 [1,0,0,1,0,0|2,0,0]=4 152 B8R1.6 CCOC1CC(N)C1 P13631 [1,0,0,1,0,0|1,0,1]=4 153 B8R1.6 CCO[C@H]1C[C@@H](N)C1 P13633 [1,0,0,1,0,0|1,0,1]=4 154 B8R1.7 CC(C)[C@@H]1CCCN1 P15226 [1,0,0,1,0,0|2,0,0]=4 155 B8R1.7 CC(C)[C@@H]1CCCN1 P15234 [1,0,0,1,0,0|2,0,0]=4 156 B8R1.7 CC(C)[C@H]1CCNC1 P15823 [1,0,0,1,0,0|1,0,1]=4 157 B8R1.7 CC(C)[C@H]1CCNC1 P17781 [1,0,0,1,0,0|1,0,1]=4 158 B8R1.22 C[C@H]1CCCCNC1 72971 [1,0,0,1,0,0|2,0,0]=4 159 B8R1.35 CC(C)CNC1CC1 AC2517 [1,0,0,1,0,0|2,0,0]=4 160 B8R1.72 CC1(Br)CCOCC1 AC1905 [1,0,0,1,0,0|1,0,1]=4 161 B8R1.72 CC1(N)CCOCC1 P16590 [1,0,0,1,0,0|1,0,1]=4 162 B8R1.72 CC1(O)CCOCC1 69121 [1,0,0,1,0,0|1,0,1]=4 163 B8R1.72 C[N+]1(C)CCOCC1 AB10337 [1,0,0,1,0,0|1,0,1]=4 164 B8R1.11 NC[C@H]1CCCC1=O 33703 [1,0,0,1,0,0|2,0,0]=4 165 B8R1.11 O=C1CCC[C@@H]1CO C73905 [1,0,0,1,0,0|2,0,0]=4 166 B8R1.11 O=C1NCC[C@@H]1CO P12214 [1,0,0,1,0,0|2,0,0]=4 167 B8R1.37 CCCC(=O)C1CC1 P18081 [1,0,0,1,0,0|1,0,0]=3 168 B8R1.37 CCOC(=O)[C@@H]1CO1 20558 [1,0,0,1,0,0|1,0,0]=3 169 B8R1.5 C[C@@H]1OCCNC1=O AC4099 [0,0,0,1,1,0|2,0,0]=4 170 B8R1.5 C[C@H]1CCCCC1=O D77719 [0,0,0,1,1,0|1,0,0]=3 171 B8R1.5 C[C@H]1CCCOC1=O AB4082 [0,0,0,1,1,0|0,0,0]=2 172 B8R1.5 C[C@H]1COCCC1=O 27832 [0,0,0,1,1,0|2,0,0]=4 173 B8R1.5 C[C@H]1CSCCC1=O 70869 [0,0,0,1,1,0|2,0,0]=4 174 B8R1.5 N[C@H]1CCCCC1=O C16242 [0,0,0,1,1,0|2,0,0]=4 175 B8R1.5 N[C@H]1CCCNC1=O 11355 [0,0,0,1,1,0|2,0,0]=4 176 B8R1.5 N[C@H]1CCCNC1=O 51546 [0,0,0,1,1,0|2,0,0]=4 177 B8R1.5 O=C1NCCC[C@@H]1Br F30215 [0,0,0,1,1,0|2,0,0]=4 178 B8R1.5 O=C1NCCC[C@@H]1O 27231 [0,0,0,1,1,0|2,0,0]=4 179 B8R1.5 O=C1OCCC[C@@H]1O 27422 [0,0,0,1,1,0|1,0,0]=3 180 B8R1.54 C[C@H](Br)C(=O)C1CC1 P15980 [0,0,0,1,1,0|2,0,0]=4 181 B10R1.30 CCN1C[C@H](C)NCC1=O W17551 [0,0,0,1,0,1|1,0,0]=3 182 B10R1.30 CCN1C[C@H](C)NCC1=O W17552 [0,0,0,1,0,1|1,0,0]=3 183 B10R1.138 CCOC(=O)\C=C\C1CC1 W10675 [0,0,0,1,0,1|0,0,1]=3 184 B10R1.140 CCOC(=O)C1CC(Br)C1 P17727 [0,0,0,1,0,1|1,0,0]=3 185 B10R1.140 CCOC(=O)C1CC(N)C1 87719 [0,0,0,1,0,1|1,0,0]=3 186 B10R1.140 CCOC(=O)[C@H]1C[C@@H](N)C1 C77307 [0,0,0,1,0,1|1,0,0]=3 187 B10R1.140 CCOC(=O)[C@H]1C[C@@H](O)C1 P11948 [0,0,0,1,0,1|1,0,0]=3 188 B10R1.302 CC1(C)CCNC(=O)CC1 W16051 [0,0,0,1,0,1|1,0,0]=3 189 B10R1.18 CC(C)C[C@H]1COCCN1 77681 [0,1,0,1,0,0|1,0,1]=4 190 B10R1.61 CC(C)N1CCNCC1=O 29960 [0,1,0,1,0,0|2,0,0]=4 191 B10R1.61 CC(C)[C@@H]1CNCCC1=O 20254 [0,1,0,1,0,0|1,0,0]=3 192 B10R1.212 CCOC(=O)C(=O)C1CC1 D85551 [0,1,0,1,0,0|0,0,1]=3 193 B10R1.212 CCOC(=O)[C@@H](Br)C1CC1 38125 [0,1,0,1,0,0|0,0,0]=2 194 B10R1.135 CCOC(=O)C1CC1C#N A12647 [0,1,0,1,0,0|0,0,1]=3 195 B10R1.135 CCOC(=O)C1CC1CO F13437 [0,1,0,1,0,0|0,0,0]=2 196 B10R1.135 CCOC(=O)[C@@H]1C[C@@H]1C#N P16190 [0,1,0,1,0,0|0,0,1]=3 197 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1C#N P16387 [0,1,0,1,0,0|0,0,1]=3 198 B10R1.135 CCOC(=O)[C@H]1C[C@H]1CO F50050 [0,1,0,1,0,0|0,0,0]=2 199 B10R1.137 CCOC(=O)CC1CNC1 D80644 [0,1,0,1,0,0|0,0,0]=2 200 B10R1.137 CCOC(=O)CC1COC1 82536 [0,1,0,1,0,0|0,0,0]=2 201 B10R1.149 COC(=O)[C@@H]1CCOC1=O F31228 [0,1,0,1,0,0|1,0,1]=4 202 B10R1.181 CCOC(=O)CC1(N)CC1 P12553 [0,1,0,1,0,0|0,0,0]=2 203 B10R1.329 CC1CC(C)(C)OC(C)O1 D93509 [0,1,0,1,0,0|1,0,1]=4 204 B10R1.373 CC(C)(C)OC(=O)N1CC1 A10580 [0,1,0,1,0,0|2,0,0]=4 205 B10R1.272 CC1(C)O[PH](=O)OC1(C)C H11416 [0,1,0,1,0,0|2,0,0]=4 206 B10R2.71 O=C1CC2CCC(C1)C2 37889 [0,0,0,2,0,0|1,0,0]=3 207 B10R2.534 O=C1CCCC2(CC2)N1 82072 [0,0,0,2,0,0|2,0,0]=4 208 B10R2.534 O=C1CCNC2(CC2)C1 D78858 [0,0,0,2,0,0|2,0,0]=4 209 B6R0.3 CC(C)C(=O)CCl D94573 [1,0,0,0,1,0|1,0,0]=3 210 B6R0.3 CN(C)C(=O)CN FD21613 [1,0,0,0,1,0|2,0,0]=4 211 B6R0.3 CNC(=O)[C@H](C)N C78177 [1,0,0,0,1,0|2,0,0]=4 212 B6R0.3 CNC(=O)[C@H](C)N C78349 [1,0,0,0,1,0|2,0,0]=4 213 B6R0.3 CNC(=O)[C@H](C)N FD21069 [1,0,0,0,1,0|2,0,0]=4 214 B6R0.3 COC(=O)N(C)C D93880 [1,0,0,0,1,0|1,0,0]=3 215 B10R0.3 C=C(C)CCCC(=O)OCC C75004 [0,0,0,0,0,2|0,0,2]=4 216 B10R0.3 CCOC(=O)\C=C\CN(C)C D80188 [0,0,0,0,0,2|1,0,0]=3