0 B6R0.6 C=CCNCCO W12833 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.6 CCOCCCBr A11082 [0,0,0,0,0,0|2,0,2]=4 2 B6R0.6 CCOCCON W15834 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.6 CC\C=C/CCI 98107 [0,0,0,0,0,0|1,0,1]=2 4 B6R0.6 O=NCNCCO D93315 [0,0,0,0,0,0|3,0,1]=4 5 B5R0.2 C#CCCC=O 89357 [1,0,0,0,0,0|0,0,3]=4 6 B5R0.2 C#CCOCC C90311 [1,0,0,0,0,0|2,0,1]=4 7 B5R0.2 C=CCCNC W16107 [1,0,0,0,0,0|2,0,1]=4 8 B5R0.2 CCCCON 31644 [1,0,0,0,0,0|2,0,1]=4 9 B5R0.2 NC\C=C\CN E70437 [1,0,0,0,0,0|2,0,0]=3 10 B5R0.2 O=CCCCO 55817 [1,0,0,0,0,0|1,0,1]=3 11 B7R0.1 C=CCCCCNC R10008 [0,1,0,0,0,0|1,0,2]=4 12 B7R0.1 COCOCCC=O 32199 [0,1,0,0,0,0|1,0,1]=3 13 B7R0.3 C=CCCC(=O)OC AT23749 [0,1,0,0,0,0|2,0,1]=4 14 B7R0.3 CCC(=O)OCCO A11774 [0,1,0,0,0,0|1,0,2]=4 15 B7R0.4 CC(=O)CCCCBr O11558 [0,1,0,0,0,0|1,0,2]=4 16 B7R0.4 CCCOCC(=O)O AC1647 [0,1,0,0,0,0|1,0,1]=3 17 B7R0.4 CCNCCC(N)=O AT24732 [0,1,0,0,0,0|1,0,1]=3 18 B7R0.4 CNCCCC(N)=O 21232 [0,1,0,0,0,0|1,0,2]=4 19 B7R0.4 COCCCC(=O)O 78063 [0,1,0,0,0,0|1,0,2]=4 20 B7R0.4 C\C=C/C=C/C(=O)O D86563 [0,1,0,0,0,0|0,0,2]=3 21 B7R0.4 NCCNCC(=O)O FD21628 [0,1,0,0,0,0|2,0,1]=4 22 B7R0.4 O=C([O-])COCCO A11454 [0,1,0,0,0,0|2,0,1]=4 23 B7R0.7 CCNC(=O)CCCl Y14703 [0,1,0,0,0,0|2,0,1]=4 24 B7R0.7 CCNC(=O)CNC A12930 [0,1,0,0,0,0|3,0,0]=4 25 B7R1.1 BrCC1=CCCC1 37275 [0,0,0,1,0,0|2,0,1]=4 26 B7R1.1 BrCC1=CN=CO1 92893 [0,0,0,1,0,0|2,0,1]=4 27 B7R1.1 BrCC1=COC=N1 70925 [0,0,0,1,0,0|3,0,0]=4 28 B7R1.1 BrCC1=CSC=N1 73558 [0,0,0,1,0,0|3,0,0]=4 29 B7R1.1 C=CC1CCCC1 T72385 [0,0,0,1,0,0|1,0,2]=4 30 B7R1.1 CCC1=CNN=C1 72604 [0,0,0,1,0,0|3,0,0]=4 31 B7R1.1 CCC1=NN=CO1 C10407 [0,0,0,1,0,0|2,0,1]=4 32 B7R1.1 CCN1C=NC=N1 29522 [0,0,0,1,0,0|3,0,0]=4 33 B7R1.1 COC1=CCCC1 D93350 [0,0,0,1,0,0|2,0,1]=4 34 B7R1.1 CSC1=CN=CN1 W17049 [0,0,0,1,0,0|3,0,0]=4 35 B7R1.1 ClCC1=CC=CS1 79790 [0,0,0,1,0,0|1,1,1]=4 36 B7R1.1 ClCC1=CN=CO1 RB3366 [0,0,0,1,0,0|2,0,1]=4 37 B7R1.1 ClCC1=COC=N1 D97597 [0,0,0,1,0,0|3,0,0]=4 38 B7R1.1 NCC1=CC=CN1 25931 [0,0,0,1,0,0|2,0,1]=4 39 B7R1.1 NCC1=CN=CS1 24148 [0,0,0,1,0,0|2,1,0]=4 40 B7R1.1 NCC1=CNC=C1 F12967 [0,0,0,1,0,0|3,0,0]=4 41 B7R1.1 NCC1=CNC=N1 26566 [0,0,0,1,0,0|3,0,0]=4 42 B7R1.1 NCC1=COC=N1 25090 [0,0,0,1,0,0|3,0,0]=4 43 B7R1.1 NCC1=CSC=N1 24147 [0,0,0,1,0,0|3,0,0]=4 44 B7R1.1 NCC1=CSC=N1 Y14444 [0,0,0,1,0,0|3,0,0]=4 45 B7R1.1 O=CC1=CC=C[Se]1 T72165 [0,0,0,1,0,0|1,0,2]=4 46 B7R1.1 O=CC1=CC=NS1 62852 [0,0,0,1,0,0|2,0,1]=4 47 B7R1.1 O=CC1=CCC=C1 77835 [0,0,0,1,0,0|0,0,2]=3 48 B7R1.1 O=CC1=CCCC1 26227 [0,0,0,1,0,0|0,0,2]=3 49 B7R1.1 O=CC1=CCCO1 D79895 [0,0,0,1,0,0|1,0,2]=4 50 B7R1.1 O=CC1=NOC=C1 P10400 [0,0,0,1,0,0|2,0,1]=4 51 B7R1.3 C=C1CCNCC1 88914 [0,0,0,1,0,0|2,0,1]=4 52 B7R1.3 C=C1CCOCC1 84295 [0,0,0,1,0,0|2,0,1]=4 53 B7R1.3 N[C@@H]1C=CCCC1 D84435 [0,0,0,1,0,0|2,0,1]=4 54 B7R1.3 O=C1C=CCCN1 88830 [0,0,0,1,0,0|1,0,2]=4 55 B7R1.3 O=C1C=CCOC1 O10790 [0,0,0,1,0,0|1,0,2]=4 56 B7R1.3 O=C1CCCCS1 D95162 [0,0,0,1,0,0|1,0,2]=4 57 B7R1.3 O=C1CNCCO1 RB3226 [0,0,0,1,0,0|2,0,1]=4 58 B7R1.3 O=C1CSCCN1 23643 [0,0,0,1,0,0|2,0,1]=4 59 B7R1.3 O[C@@H]1C=CCNC1 S11183 [0,0,0,1,0,0|3,0,0]=4 60 B7R1.4 CC1=C(C)NC=C1 F20873 [0,0,0,1,0,0|2,0,1]=4 61 B7R1.4 CC1=CCOC1=O T72100 [0,0,0,1,0,0|1,0,2]=4 62 B7R1.4 CN1C=CN=C1I 23828 [0,0,0,1,0,0|3,0,0]=4 63 B7R1.4 CN1C=CNC1=O F12570 [0,0,0,1,0,0|2,0,0]=3 64 B7R1.6 O=CCC1CCC1 55432 [0,0,0,1,0,0|0,0,2]=3 65 B7R1.6 O=CCC1COC1 CS2316 [0,0,0,1,0,0|1,0,2]=4 66 B7R1.8 CO[C@H]1CCC1=O P17941 [0,0,0,1,0,0|1,0,2]=4 67 B7R1.8 O=C1CC[C@@H]1CO P13853 [0,0,0,1,0,0|1,0,2]=4 68 B4R0.2 C=CCNN D79874 [2,0,0,0,0,0|2,0,0]=4 69 B4R0.2 C=C\C=C/C T71862 [2,0,0,0,0,0|0,0,1]=3 70 B4R0.2 CCCCN T70838 [2,0,0,0,0,0|1,0,1]=4 71 B4R0.2 CCONC AT14498 [2,0,0,0,0,0|2,0,0]=4 72 B4R0.2 N\C=C\C=O W10858 [2,0,0,0,0,0|1,0,0]=3 73 B6R0.1 C=C=CC(=O)OC F20885 [1,1,0,0,0,0|1,0,1]=4 74 B6R0.1 CCNC(=O)CO 79517 [1,1,0,0,0,0|1,0,1]=4 75 B6R0.1 COC(=O)\C=C\I C10406 [1,1,0,0,0,0|2,0,0]=4 76 B6R0.4 C=CCCC(=O)Cl F16765 [1,1,0,0,0,0|0,0,2]=4 77 B6R0.4 CC(=O)CCC=O P17049 [1,1,0,0,0,0|0,0,1]=3 78 B6R0.4 CC(=O)CCCBr 25631 [1,1,0,0,0,0|1,0,1]=4 79 B6R0.4 CC(C)CCC=O 31143 [1,1,0,0,0,0|0,0,1]=3 80 B6R0.4 CCOCC(=O)O D73862 [1,1,0,0,0,0|1,0,0]=3 81 B6R0.4 COC=CC(=O)O D97266 [1,1,0,0,0,0|1,0,0]=3 82 B6R0.4 NCCCC(N)=O C72206 [1,1,0,0,0,0|1,0,1]=4 83 B6R0.4 O=C(O)\C=C\CCl 11303 [1,1,0,0,0,0|1,0,0]=3 84 B6R0.4 O=C([O-])CNCO F20522 [1,1,0,0,0,0|2,0,0]=4 85 B6R0.4 O=C\C=C\B(O)O A50009 [1,1,0,0,0,0|2,0,0]=4 86 B8R0.1 CCOC(=O)CCC=O AB9300 [0,2,0,0,0,0|0,0,1]=3 87 B8R0.4 C=CCCCCCC=O N11873 [0,2,0,0,0,0|0,0,2]=4 88 B8R0.6 CCCCCC(=O)CBr C73149 [0,2,0,0,0,0|0,0,2]=4 89 B8R0.7 COCCNCC(=O)O W16095 [0,2,0,0,0,0|1,0,1]=4 90 B8R0.7 NCCCCCC(=O)O P19609 [0,2,0,0,0,0|0,0,2]=4 91 B8R0.7 NCCCCCC(N)=O AC6029 [0,2,0,0,0,0|0,0,2]=4 92 B8R0.7 O=C([O-])CCCCCO Y14708 [0,2,0,0,0,0|0,0,2]=4 93 B8R0.8 CCCC[C@H](N)C(N)=O C77276 [0,2,0,0,0,0|0,0,2]=4 94 B8R0.8 CCCC[C@H](O)C(=O)O C11377 [0,2,0,0,0,0|0,0,2]=4 95 B8R0.9 CCC(C)=CCC(=O)O C75612 [0,2,0,0,0,0|0,0,0]=2 96 B8R0.9 CC[C@H](Cl)CCC(=O)Cl AC1939 [0,2,0,0,0,0|0,0,2]=4 97 B8R0.9 O=C(O)CCC(=O)CBr P19462 [0,2,0,0,0,0|1,0,1]=4 98 B8R0.25 CCCCC(C)(C)C=O D93253 [0,2,0,0,0,0|0,0,2]=4 99 B8R0.5 CCCC(=O)CC(C)=O 79568 [0,2,0,0,0,0|0,0,1]=3 100 B8R0.5 CCC[C@H](C)CC(C)=O D93522 [0,2,0,0,0,0|0,0,2]=4 101 B8R0.5 CCC[C@H](N)CC(=O)O C76010 [0,2,0,0,0,0|0,0,2]=4 102 B8R0.5 CCC\C(C)=C\C(=O)O A11778 [0,2,0,0,0,0|0,0,2]=4 103 B8R0.5 CCOC(=O)CC(=O)[O-] C15698 [0,2,0,0,0,0|1,0,0]=3 104 B8R0.28 CC(C)=CCCC(=O)O F16793 [0,2,0,0,0,0|0,0,2]=4 105 B8R0.28 CC(C)CNCC(=O)O W10796 [0,2,0,0,0,0|1,0,1]=4 106 B6R1.2 C=C1CCNC1 F13598 [1,0,0,1,0,0|2,0,0]=4 107 B6R1.2 CC1=CC=CN1 23756 [1,0,0,1,0,0|1,0,1]=4 108 B6R1.2 CC1=CNC=C1 59365 [1,0,0,1,0,0|1,0,1]=4 109 B6R1.2 CC1=COC=C1 W18310 [1,0,0,1,0,0|1,0,1]=4 110 B6R1.2 IC1=COCC1 P19286 [1,0,0,1,0,0|2,0,0]=4 111 B6R1.2 O=C1C=CCN1 AC1277 [1,0,0,1,0,0|1,0,0]=3 112 B6R1.2 O=C1CNCN1 25530 [1,0,0,1,0,0|2,0,0]=4 113 B6R1.3 O=CCC1CC1 P10743 [1,0,0,1,0,0|0,0,1]=3 114 B6R1.4 C[C@@H]1OCC1=O P16003 [1,0,0,1,0,0|1,0,0]=3 115 B6R1.4 C[C@H]1CCC1=O W18267 [1,0,0,1,0,0|0,0,1]=3 116 B6R1.4 C[C@H]1CNC1=O P20594 [1,0,0,1,0,0|1,0,1]=4 117 B6R1.4 O=C1CC[C@@H]1Br P18435 [1,0,0,1,0,0|1,0,1]=4 118 B6R1.6 O=CC1COC1 84841 [1,0,0,1,0,0|1,0,1]=4 119 B8R1.2 CCC1=NC=NC=C1 F17281 [0,1,0,1,0,0|1,0,1]=4 120 B8R1.2 O=CN1CCCCC1 D77795 [0,1,0,1,0,0|0,0,2]=4 121 B8R1.2 O=C[C@@H]1CCCCN1 62054 [0,1,0,1,0,0|0,0,2]=4 122 B8R1.2 O=C[C@@H]1CCCCO1 79885 [0,1,0,1,0,0|0,0,2]=4 123 B8R1.2 O=C[C@@H]1COCCO1 D78647 [0,1,0,1,0,0|1,0,1]=4 124 B8R1.2 O=C[C@H]1CCCOC1 79874 [0,1,0,1,0,0|0,0,2]=4 125 B8R1.5 C[C@@H]1OCCNC1=O AC4099 [0,1,0,1,0,0|1,0,1]=4 126 B8R1.5 C[C@H]1CCCCC1=O D77719 [0,1,0,1,0,0|0,0,2]=4 127 B8R1.5 C[C@H]1CCCOC1=O AB4082 [0,1,0,1,0,0|0,0,2]=4 128 B8R1.5 C[C@H]1COCCC1=O 27832 [0,1,0,1,0,0|0,0,2]=4 129 B8R1.5 C[C@H]1CSCCC1=O 70869 [0,1,0,1,0,0|0,0,2]=4 130 B8R1.5 N[C@H]1CC=CC[C@@H]1N F16351 [0,1,0,1,0,0|1,0,1]=4 131 B8R1.5 N[C@H]1CCCCC1=O C16242 [0,1,0,1,0,0|0,0,2]=4 132 B8R1.5 O=C1CCOC[C@@H]1Br RB3241 [0,1,0,1,0,0|1,0,1]=4 133 B8R1.8 BrCCC1=CSC=C1 F20032 [0,1,0,1,0,0|2,0,0]=4 134 B8R1.8 CNCC1=CNC=N1 AT15460 [0,1,0,1,0,0|2,0,0]=4 135 B8R1.8 CNCC1=COC=C1 AC5678 [0,1,0,1,0,0|2,0,0]=4 136 B8R1.8 COCC1=CN=CN1 AC8003 [0,1,0,1,0,0|2,0,0]=4 137 B8R1.8 NCCC1=CC=CN1 31556 [0,1,0,1,0,0|1,0,1]=4 138 B8R1.8 NCCC1=CC=CN1 F10331 [0,1,0,1,0,0|1,0,1]=4 139 B8R1.8 NCCC1=CSC=C1 P10092 [0,1,0,1,0,0|2,0,0]=4 140 B8R1.8 O=CCC1CCCC1 F11683 [0,1,0,1,0,0|0,0,2]=4 141 B8R1.8 OCCC1=CC=CN1 AB10351 [0,1,0,1,0,0|1,0,1]=4 142 B8R1.8 OCCC1=CC=CO1 W10532 [0,1,0,1,0,0|0,0,2]=4 143 B8R1.8 OCCC1=COC=C1 D93026 [0,1,0,1,0,0|2,0,0]=4 144 B8R1.11 CC1=CSC=C1C=O P16095 [0,1,0,1,0,0|0,0,2]=4 145 B8R1.11 CCC1=C(C)N=CS1 60935 [0,1,0,1,0,0|1,1,0]=4 146 B8R1.11 CCC1=CNN=C1C AC8755 [0,1,0,1,0,0|2,0,0]=4 147 B8R1.11 CCN1C=CN=C1Br AT15593 [0,1,0,1,0,0|2,0,0]=4 148 B8R1.11 NC[C@H]1CCCC1=O 33703 [0,1,0,1,0,0|0,0,2]=4 149 B8R1.11 O=C1CCC=C1CO E70389 [0,1,0,1,0,0|1,0,0]=3 150 B8R1.11 O=C1CCC[C@@H]1CO C73905 [0,1,0,1,0,0|0,0,2]=4 151 B8R1.22 O=C1CCCCCN1 D94502 [0,1,0,1,0,0|0,0,2]=4 152 B8R1.22 O=C1CCCCNC1 50109 [0,1,0,1,0,0|0,0,2]=4 153 B8R1.22 O=C1CCCOCC1 P12770 [0,1,0,1,0,0|0,0,2]=4 154 B8R1.22 O=C1CCNCCN1 58405 [0,1,0,1,0,0|1,0,1]=4 155 B8R1.22 O=C1CNCCNC1 77718 [0,1,0,1,0,0|1,0,1]=4 156 B8R1.22 O=C1CNCCOC1 P20266 [0,1,0,1,0,0|1,0,1]=4 157 B8R1.22 O=C1COCCCN1 71169 [0,1,0,1,0,0|1,0,1]=4 158 B8R1.49 C1=CCCC=CCC1 A11943 [0,1,0,1,0,0|1,0,0]=3 159 B8R1.49 C1=CCCC=CCC1 C10709 [0,1,0,1,0,0|1,0,0]=3 160 B8R1.49 C1=CCCC=CCC1 D94664 [0,1,0,1,0,0|1,0,0]=3 161 B8R1.49 C1=CCCC=CCC1 F16608 [0,1,0,1,0,0|1,0,0]=3 162 B8R1.49 C1=CCCC=CCC1 F16639 [0,1,0,1,0,0|1,0,0]=3 163 B8R1.49 C1=CCCC=CCC1 H10532 [0,1,0,1,0,0|1,0,0]=3 164 B8R1.49 C1=CCCC=CCC1 O11699 [0,1,0,1,0,0|1,0,0]=3 165 B8R1.49 C1=CCCC=CCC1 S12179 [0,1,0,1,0,0|1,0,0]=3 166 B8R1.49 C1=CCCC=CCC1 T72889 [0,1,0,1,0,0|1,0,0]=3 167 B8R1.1 C=C[C@@H]1CCC(=O)N1 N10616 [0,1,0,1,0,0|2,0,0]=4 168 B8R1.1 CC1=CC=C(C=O)N1 29847 [0,1,0,1,0,0|0,0,2]=4 169 B8R1.1 CCC1=CC=C(C)O1 A12137 [0,1,0,1,0,0|0,0,2]=4 170 B8R1.1 CCC1=CN=C(N)S1 84403 [0,1,0,1,0,0|1,1,0]=4 171 B8R1.1 CN1C=CC(C=O)=C1 AT16322 [0,1,0,1,0,0|1,0,1]=4 172 B8R1.1 COC1=CC(=O)CC1 63697 [0,1,0,1,0,0|1,0,1]=4 173 B8R1.3 CN1CC=C(Br)CC1 CS3354 [0,1,0,1,0,0|2,0,0]=4 174 B8R1.3 C[C@@H]1C=CC(=O)CC1 P17313 [0,1,0,1,0,0|0,0,2]=4 175 B8R1.3 O=C1CCC(=O)OC1 P20160 [0,1,0,1,0,0|1,0,0]=3 176 B8R1.3 O=C1CCC(F)CC1 23163 [0,1,0,1,0,0|0,0,2]=4 177 B8R1.50 CN1C(=O)CCC1=O D70368 [0,1,0,1,0,0|1,0,1]=4 178 B8R1.52 CC1(C=O)CCCC1 90941 [0,1,0,1,0,0|0,0,2]=4 179 B8R1.4 C=C1CCCC(=O)O1 D93802 [0,1,0,1,0,0|1,0,1]=4 180 B8R1.4 CC1=CN=NC(=O)C1 78530 [0,1,0,1,0,0|2,0,0]=4 181 B8R1.4 CN1CCCC(=O)C1 S10664 [0,1,0,1,0,0|1,0,1]=4 182 B8R1.4 C[C@H]1CC(=O)CCN1 37834 [0,1,0,1,0,0|1,0,1]=4 183 B8R1.4 C[C@H]1CC(=O)CCN1 37835 [0,1,0,1,0,0|1,0,1]=4 184 B8R1.4 C[C@H]1CC(=O)CCN1 37846 [0,1,0,1,0,0|1,0,1]=4 185 B8R1.4 C[C@H]1CC(=O)CCO1 P11761 [0,1,0,1,0,0|1,0,1]=4 186 B8R1.4 C[C@H]1CNCC(=O)N1 38273 [0,1,0,1,0,0|1,0,1]=4 187 B8R1.4 C[C@H]1CNCC(=O)N1 71648 [0,1,0,1,0,0|1,0,1]=4 188 B8R1.4 C[C@H]1CNCC(=O)N1 P10459 [0,1,0,1,0,0|1,0,1]=4 189 B8R1.4 N[C@H]1CCCC(=O)C1 20374 [0,1,0,1,0,0|0,0,2]=4 190 B8R1.4 O=C1CNCC(=O)C1 91786 [0,1,0,1,0,0|1,0,1]=4 191 B8R1.6 CCCC1CC(=O)C1 D96728 [0,1,0,1,0,0|0,0,2]=4 192 B8R1.7 CC(=O)[C@H]1CCOC1 79964 [0,1,0,1,0,0|1,0,1]=4 193 B8R1.7 CC(C)C1=CC=CO1 81450 [0,1,0,1,0,0|0,0,2]=4 194 B8R1.7 CC(C)C1=CNC=N1 F30487 [0,1,0,1,0,0|2,0,0]=4 195 B8R1.7 C[C@H](N)C1=CC=CO1 Y10899 [0,1,0,1,0,0|0,0,2]=4 196 B8R1.7 C[C@H](N)C1=CC=CO1 Y12106 [0,1,0,1,0,0|0,0,2]=4 197 B8R1.7 C[C@H](N)C1=CC=CS1 82880 [0,1,0,1,0,0|0,1,1]=4 198 B8R1.7 C[C@H](N)C1=CC=CS1 D81260 [0,1,0,1,0,0|0,1,1]=4 199 B8R1.7 C[C@H](N)C1=CC=CS1 N11134 [0,1,0,1,0,0|0,1,1]=4 200 B8R1.7 C[C@H](N)C1=CC=CS1 N12970 [0,1,0,1,0,0|0,1,1]=4 201 B8R1.7 C[C@H](N)C1=CC=CS1 Y10683 [0,1,0,1,0,0|0,1,1]=4 202 B8R1.7 C[C@H](N)C1=CN=CS1 72023 [0,1,0,1,0,0|1,1,0]=4 203 B8R1.7 C[C@H](N)C1=CNC=N1 F13130 [0,1,0,1,0,0|2,0,0]=4 204 B8R1.7 C[C@H](N)C1=CSC=C1 27894 [0,1,0,1,0,0|2,0,0]=4 205 B8R1.7 C[C@H](N)C1=CSC=C1 Y14612 [0,1,0,1,0,0|2,0,0]=4 206 B8R1.7 C[C@H](O)C1=CN=CS1 AT14805 [0,1,0,1,0,0|1,1,0]=4 207 B8R1.7 C[C@H](O)C1=CNC=N1 71746 [0,1,0,1,0,0|2,0,0]=4 208 B8R1.7 C[C@H](O)C1=CSC=C1 79116 [0,1,0,1,0,0|2,0,0]=4 209 B8R1.7 NC(=O)[C@H]1CCNC1 31795 [0,1,0,1,0,0|1,0,1]=4 210 B8R1.7 NC(=O)[C@H]1CCNC1 37190 [0,1,0,1,0,0|1,0,1]=4 211 B8R1.7 NC(=O)[C@H]1CCOC1 39026 [0,1,0,1,0,0|1,0,1]=4 212 B8R1.7 O=C(Cl)[C@@H]1CCCO1 P19141 [0,1,0,1,0,0|1,0,1]=4 213 B8R1.7 O=C(O)[C@@H]1CCCN1 D77952 [0,1,0,1,0,0|1,0,1]=4 214 B8R1.7 O=C(O)[C@H]1CCNC1 65432 [0,1,0,1,0,0|1,0,1]=4 215 B8R1.7 O=C(O)[C@H]1CCNC1 P10866 [0,1,0,1,0,0|1,0,1]=4 216 B8R1.7 O=C(O)[C@H]1CCOC1 59930 [0,1,0,1,0,0|1,0,1]=4 217 B8R1.7 O=C(O)[C@H]1CCOC1 66517 [0,1,0,1,0,0|1,0,1]=4 218 B8R1.19 CC1(C)OCCC1=O P18857 [0,1,0,1,0,0|1,0,1]=4 219 B8R1.31 CC1NCC1C(=O)O P14366 [0,1,0,1,0,0|1,0,1]=4 220 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O P15238 [0,1,0,1,0,0|1,0,1]=4 221 B8R1.34 CC(=O)CC1CCC1 D79207 [0,1,0,1,0,0|0,0,2]=4 222 B8R1.34 O=C(O)CN1CCC1 55159 [0,1,0,1,0,0|1,0,1]=4 223 B8R1.35 O=C(O)CNC1CC1 F14996 [0,1,0,1,0,0|1,0,1]=4 224 B8R1.35 O=C(O)CNC1CC1 W15242 [0,1,0,1,0,0|1,0,1]=4 225 B8R1.18 C[C@@H]1SC(N)=NC1=O D85819 [0,1,0,1,0,0|2,0,0]=4 226 B8R2.34 C1=C[C@@H]2CN[C@H]1C2 P10331 [0,0,0,2,0,0|1,0,1]=4 227 B8R2.18 O=C1CC2CC2C1 W10830 [0,0,0,2,0,0|0,0,2]=4 228 B8R2.38 O=C1CCC2CC12 P19135 [0,0,0,2,0,0|0,0,2]=4 229 B8R2.38 O=C1CCC2OC12 60057 [0,0,0,2,0,0|1,0,1]=4 230 B8R2.19 O=C1CCC12CC2 P10135 [0,0,0,2,0,0|0,0,2]=4