0 B5R0.3 C=C(C#N)CO W19656 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.3 C=C[C@@H](N)CO 52208 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.3 C=C[C@@H](N)CO 52209 [0,0,0,0,0,0|2,0,2]=4 3 B5R0.3 C=C[C@@H](N)CO 52211 [0,0,0,0,0,0|2,0,2]=4 4 B5R0.3 C=C[C@@H](O)CO 56500 [0,0,0,0,0,0|1,0,3]=4 5 B5R0.3 CCC(=O)CN S11993 [0,0,0,0,0,0|2,0,0]=2 6 B5R0.3 CC[C@H](C)CN 88665 [0,0,0,0,0,0|3,0,1]=4 7 B5R0.3 CC[PH](=O)CC C77650 [0,0,0,0,0,0|3,0,0]=3 8 B5R0.3 CN[C@@H](C)CO AC8719 [0,0,0,0,0,0|3,0,1]=4 9 B5R0.3 CN[C@@H](C)CO C77593 [0,0,0,0,0,0|3,0,1]=4 10 B5R0.3 CN[C@@H](C)CO D80042 [0,0,0,0,0,0|3,0,1]=4 11 B5R0.3 CN[C@@H](C)CO D80344 [0,0,0,0,0,0|3,0,1]=4 12 B5R0.3 CN[C@@H](C)CO D82586 [0,0,0,0,0,0|3,0,1]=4 13 B5R0.3 CO[C@@H](C)CO 91002 [0,0,0,0,0,0|3,0,1]=4 14 B5R0.3 C[C@@H](CN)CCl 72948 [0,0,0,0,0,0|3,0,1]=4 15 B5R0.3 C[C@@H](CO)CBr AB3182 [0,0,0,0,0,0|2,0,1]=3 16 B5R0.3 FCC(I)CF AC4509 [0,0,0,0,0,0|3,0,1]=4 17 B5R0.3 NC[C@H](Br)CBr AC1488 [0,0,0,0,0,0|3,0,1]=4 18 B5R0.3 NC[C@H](F)CO 94841 [0,0,0,0,0,0|2,0,1]=3 19 B5R0.3 NC[C@H](F)CO 94845 [0,0,0,0,0,0|2,0,1]=3 20 B5R0.3 NC[C@H](F)CO 94846 [0,0,0,0,0,0|2,0,1]=3 21 B5R0.3 NC[C@H](O)CCl C10413 [0,0,0,0,0,0|2,0,2]=4 22 B5R0.3 NC[C@H](O)CF 94771 [0,0,0,0,0,0|2,0,2]=4 23 B5R0.3 OC[C@H](O)CF 65949 [0,0,0,0,0,0|1,0,2]=3 24 B5R0.3 OC[C@H](O)CF F14582 [0,0,0,0,0,0|1,0,2]=3 25 B4R0.1 CC(=N)NN C74999 [1,0,0,0,0,0|3,0,0]=4 26 B4R0.1 CC(C)CBr P19652 [1,0,0,0,0,0|2,0,1]=4 27 B4R0.1 CC[C@H](C)N 74047 [1,0,0,0,0,0|2,0,1]=4 28 B4R0.1 C[C@H](Br)CN F11189 [1,0,0,0,0,0|2,0,1]=4 29 B4R0.1 C[C@H](Br)CO W17591 [1,0,0,0,0,0|1,0,1]=3 30 B4R0.1 C[C@H](Cl)CN Y14715 [1,0,0,0,0,0|2,0,1]=4 31 B4R0.1 C[C@H](N)CF AC1136 [1,0,0,0,0,0|2,0,1]=4 32 B4R0.1 C[C@H](N)CF AC6177 [1,0,0,0,0,0|2,0,1]=4 33 B4R0.1 C\C=C(\C)Br D93160 [1,0,0,0,0,0|2,0,1]=4 34 B4R0.1 N=C(N)CO 20678 [1,0,0,0,0,0|2,0,0]=3 35 B4R0.1 NCC(=O)O A10882 [1,0,0,0,0,0|1,0,0]=2 36 B4R0.1 NCC(=O)O T72551 [1,0,0,0,0,0|1,0,0]=2 37 B4R0.1 NNC(N)=O D77852 [1,0,0,0,0,0|3,0,0]=4 38 B4R0.1 O=C([O-])C[O-] 47204 [1,0,0,0,0,0|0,0,2]=3 39 B4R0.2 BrCCCBr D77913 [1,0,0,0,0,0|2,0,1]=4 40 B4R0.2 BrCOCBr AC2225 [1,0,0,0,0,0|3,0,0]=4 41 B4R0.2 CCCCN T70838 [1,0,0,0,0,0|2,0,1]=4 42 B4R0.2 NCCCF 61303 [1,0,0,0,0,0|2,0,1]=4 43 B4R0.2 NCCCN T70045 [1,0,0,0,0,0|2,0,1]=4 44 B4R0.2 NCCCS A11074 [1,0,0,0,0,0|1,1,1]=4 45 B4R0.2 OCCCO D77845 [1,0,0,0,0,0|0,0,1]=2 46 B4R0.2 OCCCS D78398 [1,0,0,0,0,0|0,1,1]=3 47 B4R0.2 SCCCBr 77989 [1,0,0,0,0,0|1,1,1]=4 48 B6R0.1 C=CC[C@H](N)CO F16846 [0,1,0,0,0,0|2,0,1]=4 49 B6R0.1 CCC[C@H](N)CO C13482 [0,1,0,0,0,0|2,0,1]=4 50 B6R0.1 CCNC(=O)CO 79517 [0,1,0,0,0,0|1,0,0]=2 51 B6R0.1 CCO[C@@H](C)CO 91003 [0,1,0,0,0,0|2,0,1]=4 52 B6R0.1 CC[C@H](S)CCO D84734 [0,1,0,0,0,0|1,1,1]=4 53 B6R0.1 CNC(=O)CCN C75423 [0,1,0,0,0,0|3,0,0]=4 54 B6R0.1 CNC(=O)CCO AC6610 [0,1,0,0,0,0|2,0,0]=3 55 B6R0.1 CNC(=O)CCS A11187 [0,1,0,0,0,0|2,1,0]=4 56 B6R0.1 COC(=O)OCCl R10013 [0,1,0,0,0,0|3,0,0]=4 57 B6R0.1 COC[C@@H](O)CN 94767 [0,1,0,0,0,0|1,0,2]=4 58 B6R0.1 NCC[C@H](O)CO F51073 [0,1,0,0,0,0|1,0,2]=4 59 B6R0.1 NNC(=O)CCO C77491 [0,1,0,0,0,0|2,0,0]=3 60 B6R0.1 N[C@H](CO)CCO AB10026 [0,1,0,0,0,0|1,0,1]=3 61 B6R0.1 N[C@H](CO)CCO AB10027 [0,1,0,0,0,0|1,0,1]=3 62 B6R0.3 C=C(CBr)C(=O)O 74879 [0,1,0,0,0,0|2,0,1]=4 63 B6R0.3 CC(C)C(=O)CCl D94573 [0,1,0,0,0,0|2,0,0]=3 64 B6R0.3 CC(C)[C@@H](C)CO D93394 [0,1,0,0,0,0|2,0,1]=4 65 B6R0.3 CC[C@H](N)[C@@H](C)O N14663 [0,1,0,0,0,0|2,0,1]=4 66 B6R0.3 CN(C)C(=O)CN FD21613 [0,1,0,0,0,0|3,0,0]=4 67 B6R0.3 CNC(=O)[C@H](C)N C78177 [0,1,0,0,0,0|3,0,0]=4 68 B6R0.3 CNC(=O)[C@H](C)N C78349 [0,1,0,0,0,0|3,0,0]=4 69 B6R0.3 CNC(=O)[C@H](C)N FD21069 [0,1,0,0,0,0|3,0,0]=4 70 B6R0.3 C[C@@H](CO)C(=O)O FD6004 [0,1,0,0,0,0|1,0,2]=4 71 B6R0.3 NNC(=O)C(F)F A10612 [0,1,0,0,0,0|3,0,0]=4 72 B6R0.3 O=C(CBr)C(Br)Br F16018 [0,1,0,0,0,0|2,0,0]=3 73 B6R0.3 O=C(O)[C@@H](Br)CO A10085 [0,1,0,0,0,0|1,0,2]=4 74 B6R0.3 O=C(O)[C@@H](Br)CO AB19244 [0,1,0,0,0,0|1,0,2]=4 75 B6R0.8 CC(O)(CO)CO AC1642 [0,1,0,0,0,0|0,0,2]=3 76 B6R0.8 CCS(=O)(=O)CCl 72654 [0,1,0,0,0,0|3,0,0]=4 77 B6R0.8 NCC(F)(F)CO 74613 [0,1,0,0,0,0|2,0,1]=4 78 B6R0.9 CC[C@@H](CN)CO Y13480 [0,1,0,0,0,0|2,0,1]=4 79 B6R0.9 CO[C@@H](CN)CO P20679 [0,1,0,0,0,0|1,0,2]=4 80 B6R1.2 C=C1CCNC1 F13598 [0,0,0,1,0,0|3,0,0]=4 81 B6R1.2 Cl[C@H]1CCOC1 N12419 [0,0,0,1,0,0|2,0,1]=4 82 B6R1.2 IC1=COCC1 P19286 [0,0,0,1,0,0|2,0,1]=4 83 B6R1.2 I[C@H]1CCOC1 37310 [0,0,0,1,0,0|2,0,1]=4 84 B6R1.2 I[C@H]1CCOC1 37311 [0,0,0,1,0,0|2,0,1]=4 85 B6R1.2 O=C1CNCN1 25530 [0,0,0,1,0,0|3,0,0]=4 86 B6R1.2 O[C@H]1CNOC1 31712 [0,0,0,1,0,0|1,0,2]=4 87 B6R1.4 CC1OCC1O P16543 [0,0,0,1,0,0|1,0,2]=4 88 B6R1.4 C[C@@H]1OCC1=O P16003 [0,0,0,1,0,0|1,0,0]=2 89 B6R1.4 C[C@H]1CCC1=O W18267 [0,0,0,1,0,0|2,0,0]=3 90 B6R1.4 C[C@H]1CNC1=O P20594 [0,0,0,1,0,0|3,0,0]=4 91 B6R1.4 NC1CCC1O 94999 [0,0,0,1,0,0|2,0,1]=4 92 B6R1.4 N[C@@H]1CC[C@@H]1O P18786 [0,0,0,1,0,0|2,0,1]=4 93 B6R1.4 O=C1CC[C@@H]1Br P18435 [0,0,0,1,0,0|2,0,0]=3 94 B6R1.4 OC1CCC1O D79179 [0,0,0,1,0,0|1,0,2]=4 95 B6R1.4 O[C@H]1CC[C@@H]1O P21043 [0,0,0,1,0,0|1,0,2]=4 96 B6R1.6 OCC1CNC1 65945 [0,0,0,1,0,0|2,0,1]=4 97 B6R1.6 OC[C@H]1CCN1 36269 [0,0,0,1,0,0|2,0,1]=4 98 B6R1.6 OC[C@H]1CCN1 38353 [0,0,0,1,0,0|2,0,1]=4 99 B6R1.6 OC[C@H]1CCN1 38354 [0,0,0,1,0,0|2,0,1]=4 100 B6R1.6 OC[C@H]1CCO1 26540 [0,0,0,1,0,0|1,0,2]=4 101 B6R1.6 OC[C@H]1CCO1 AT10832 [0,0,0,1,0,0|1,0,2]=4 102 B6R1.6 OC[C@H]1CCO1 P19736 [0,0,0,1,0,0|1,0,2]=4 103 B6R1.7 C[C@]1(CO)CO1 95575 [0,0,0,1,0,0|1,0,1]=3 104 B6R1.7 NC1(CO)CC1 32781 [0,0,0,1,0,0|2,0,1]=4 105 B6R1.7 OCC1(F)CC1 72692 [0,0,0,1,0,0|2,0,1]=4 106 B6R1.7 OCC1(O)CC1 72268 [0,0,0,1,0,0|1,0,2]=4 107 B6R1.8 C[C@H]1C[C@@H]1CO 72702 [0,0,0,1,0,0|2,0,1]=4 108 B6R1.8 OC[C@H]1C[C@@H]1F CS3459 [0,0,0,1,0,0|2,0,1]=4 109 B3R0.1 ClCCI T71139 [2,0,0,0,0,0|2,0,0]=4 110 B3R0.1 NCCN A12036 [2,0,0,0,0,0|2,0,0]=4 111 B3R0.1 NCCN T72722 [2,0,0,0,0,0|2,0,0]=4 112 B3R0.2 CC(=O)[O-] AC2626 [2,0,0,0,0,0|0,0,1]=3 113 B3R0.2 CC(=O)[O-] D70195 [2,0,0,0,0,0|0,0,1]=3 114 B3R0.2 CC(=O)[O-] I11566 [2,0,0,0,0,0|0,0,1]=3 115 B3R0.2 C[13C](=O)O 41422 [2,0,0,0,0,0|0,0,0]=2 116 B3R0.2 C[S+](C)C AC2631 [2,0,0,0,0,0|2,0,0]=4 117 B3R0.2 O=C([O-])[O-] AC2639 [2,0,0,0,0,0|0,0,2]=4 118 B3R0.2 O=C([O-])[O-] AC7869 [2,0,0,0,0,0|0,0,2]=4 119 B3R0.2 O=C([O-])[O-] F20746 [2,0,0,0,0,0|0,0,2]=4 120 B3R0.2 [13CH3]C(=O)O 41421 [2,0,0,0,0,0|0,0,0]=2 121 B3R0.2 [15NH2]C([15NH2])=O 41394 [2,0,0,0,0,0|2,0,0]=4 122 B3R0.2 [15NH2][13C]([15NH2])=O 41395 [2,0,0,0,0,0|2,0,0]=4 123 B5R0.1 C=C(C)CON F31248 [1,1,0,0,0,0|1,0,0]=3 124 B5R0.1 CN(C)CCO D93012 [1,1,0,0,0,0|2,0,0]=4 125 B5R0.1 CNCC(=O)[O-] F20742 [1,1,0,0,0,0|1,0,1]=4 126 B5R0.1 COC[C@H](C)Br 78860 [1,1,0,0,0,0|1,0,1]=4 127 B5R0.1 COC[C@H](C)N 25526 [1,1,0,0,0,0|1,0,1]=4 128 B5R0.1 COC[C@H](C)N D95458 [1,1,0,0,0,0|1,0,1]=4 129 B5R0.1 COC[C@H](C)N W17998 [1,1,0,0,0,0|1,0,1]=4 130 B5R0.1 C[C@H](O)CON O10313 [1,1,0,0,0,0|0,0,2]=4 131 B5R0.1 C\C(I)=C/CI AC8880 [1,1,0,0,0,0|2,0,0]=4 132 B5R0.1 C\C(I)=C\CI AC3855 [1,1,0,0,0,0|2,0,0]=4 133 B5R0.1 N#CCC(=O)[O-] D70707 [1,1,0,0,0,0|1,0,1]=4 134 B5R0.1 O=C(O)\C=C\Br AC1121 [1,1,0,0,0,0|1,0,1]=4 135 B5R0.1 O=C(O)\C=C\I W15430 [1,1,0,0,0,0|1,0,1]=4 136 B5R0.4 CC(C)(F)CO P17817 [1,1,0,0,0,0|1,0,1]=4 137 B5R0.5 CC(=O)C(N)=S 93979 [1,1,0,0,0,0|0,1,1]=4 138 B5R0.5 CC(=O)[C@H](C)N D76571 [1,1,0,0,0,0|1,0,0]=3 139 B5R0.5 C[C@H](N)C(N)=O 25148 [1,1,0,0,0,0|2,0,0]=4 140 B5R0.5 C[C@H](O)C(=N)N 71516 [1,1,0,0,0,0|2,0,0]=4 141 B5R0.5 C[C@H](O)[C@H](C)O C91323 [1,1,0,0,0,0|0,0,2]=4 142 B5R0.2 CCCCON 31644 [1,1,0,0,0,0|1,0,1]=4 143 B5R0.2 COCCCO D77912 [1,1,0,0,0,0|0,0,1]=3 144 B5R0.2 NC\C=C\CN E70437 [1,1,0,0,0,0|2,0,0]=4 145 B5R0.2 NNCCCO AB9423 [1,1,0,0,0,0|1,0,1]=4 146 B5R0.2 O=CCCCO 55817 [1,1,0,0,0,0|0,0,2]=4 147 B7R0.2 CC(C)NC(=O)CBr A12824 [0,2,0,0,0,0|2,0,0]=4 148 B7R0.2 CC(C)NC(=O)CI A11046 [0,2,0,0,0,0|2,0,0]=4 149 B7R0.2 CC(C)OC(=O)CN FD21588 [0,2,0,0,0,0|2,0,0]=4 150 B7R0.2 N[C@H](CO)CC(=O)O D95019 [0,2,0,0,0,0|1,0,1]=4 151 B7R0.2 N[C@H](CO)CC(=O)O F14029 [0,2,0,0,0,0|1,0,1]=4 152 B7R0.3 C=C(CCl)OCOC P10081 [0,2,0,0,0,0|2,0,0]=4 153 B7R0.3 CCC(=O)OCCO A11774 [0,2,0,0,0,0|1,0,0]=3 154 B7R0.3 COC(=O)C#CCO AB7534 [0,2,0,0,0,0|2,0,0]=4 155 B7R0.5 CCOC(=O)[C@H](C)O D75729 [0,2,0,0,0,0|1,0,0]=3 156 B7R0.5 CCSC(=O)[C@H](C)N C14826 [0,2,0,0,0,0|2,0,0]=4 157 B7R0.7 CCNC(=O)CCCl Y14703 [0,2,0,0,0,0|2,0,0]=4 158 B7R0.7 CCNC(=O)CNC A12930 [0,2,0,0,0,0|2,0,0]=4 159 B7R0.7 CN(CCO)CCO A10780 [0,2,0,0,0,0|2,0,0]=4 160 B7R0.7 COCC(=O)COC 36699 [0,2,0,0,0,0|0,0,0]=2 161 B7R0.7 COC[C@@H](N)CCO AT12992 [0,2,0,0,0,0|1,0,1]=4 162 B7R0.10 CC[C@H](O)C(=O)OC 98375 [0,2,0,0,0,0|2,0,0]=4 163 B7R0.10 COC(=O)[C@@H](Br)CO AB21729 [0,2,0,0,0,0|2,0,0]=4 164 B7R0.10 COC(=O)[C@@H](O)CN AC4978 [0,2,0,0,0,0|2,0,0]=4 165 B7R0.10 COC(=O)[C@@H](O)CN D97235 [0,2,0,0,0,0|2,0,0]=4 166 B7R0.10 COC(=O)[C@@H](O)CO FD9041 [0,2,0,0,0,0|2,0,0]=4 167 B7R0.10 OC[C@H](O)[C@@H](O)CO T72117 [0,2,0,0,0,0|0,0,2]=4 168 B7R0.11 CC(C)(CO)CCO W16131 [0,2,0,0,0,0|1,0,1]=4 169 B7R0.11 COCC(C)(C)CO BL000418 [0,2,0,0,0,0|1,0,1]=4 170 B7R0.12 CCCC(CO)CO AB7729 [0,2,0,0,0,0|1,0,1]=4 171 B7R0.12 CCN(CCO)N=O T71710 [0,2,0,0,0,0|2,0,0]=4 172 B7R0.14 CC(C)(C)C(=O)CN F11054 [0,2,0,0,0,0|2,0,0]=4 173 B7R0.14 CC(C)(C)C(=O)CO F50563 [0,2,0,0,0,0|1,0,0]=3 174 B7R0.14 CC(C)(O)C(=N)NO F18387 [0,2,0,0,0,0|2,0,0]=4 175 B7R0.14 CC(C)(O)C(=O)NN A10178 [0,2,0,0,0,0|2,0,0]=4 176 B7R0.15 CC(C)C(CO)CO 73803 [0,2,0,0,0,0|1,0,1]=4 177 B5R1.2 C=C1COC1 P17999 [1,0,0,1,0,0|1,0,0]=3 178 B5R1.2 ClC1COC1 CS1986 [1,0,0,1,0,0|1,0,1]=4 179 B5R1.2 SC1COC1 32902 [1,0,0,1,0,0|0,1,1]=4 180 B5R1.4 N[C@@H]1C[C@@H]1O C93526 [1,0,0,1,0,0|1,0,1]=4 181 B5R1.1 C1COCN1 A51210 [1,0,0,1,0,0|2,0,0]=4 182 B7R1.1 OCC1=CON=C1 73633 [0,1,0,1,0,0|1,0,1]=4 183 B7R1.1 OC[C@H]1CCOC1 37313 [0,1,0,1,0,0|1,0,1]=4 184 B7R1.1 OC[C@H]1CCOC1 37314 [0,1,0,1,0,0|1,0,1]=4 185 B7R1.2 CC1=CC(=O)CO1 Y10351 [0,1,0,1,0,0|1,0,1]=4 186 B7R1.2 CN1CCC(=O)C1 64220 [0,1,0,1,0,0|2,0,0]=4 187 B7R1.2 C[C@H]1CCC(=O)N1 P20894 [0,1,0,1,0,0|2,0,0]=4 188 B7R1.2 C[C@H]1CCC(=O)N1 P20895 [0,1,0,1,0,0|2,0,0]=4 189 B7R1.2 NC1=NC(=O)CO1 C73385 [0,1,0,1,0,0|1,0,1]=4 190 B7R1.2 O=C1C=C[C@@H](O)O1 F11119 [0,1,0,1,0,0|1,0,1]=4 191 B7R1.2 O=C1CC[C@H](O)C1 P13127 [0,1,0,1,0,0|1,0,0]=3 192 B7R1.2 O=C1CNC(=O)C1 76756 [0,1,0,1,0,0|1,0,1]=4 193 B7R1.2 O=C1COC(=O)N1 F20602 [0,1,0,1,0,0|0,0,2]=4 194 B7R1.2 O=C1C[C@H](O)CO1 12464 [0,1,0,1,0,0|2,0,0]=4 195 B7R1.3 BrC1=CCOCC1 C90119 [0,1,0,1,0,0|2,0,0]=4 196 B7R1.3 C=C1CCOCC1 84295 [0,1,0,1,0,0|2,0,0]=4 197 B7R1.3 O=C1C=CCOC1 O10790 [0,1,0,1,0,0|1,0,1]=4 198 B7R1.3 O=C1CCCCS1 D95162 [0,1,0,1,0,0|2,0,0]=4 199 B7R1.3 O=C1CNCCO1 RB3226 [0,1,0,1,0,0|2,0,0]=4 200 B7R1.3 O=C1CSCCN1 23643 [0,1,0,1,0,0|1,1,0]=4 201 B7R1.4 C[C@H]1COC[C@@H]1O 73077 [0,1,0,1,0,0|1,0,1]=4 202 B7R1.4 NC1COCC1O O11159 [0,1,0,1,0,0|1,0,1]=4 203 B7R1.4 N[C@@H]1COC[C@@H]1O F53671 [0,1,0,1,0,0|1,0,1]=4 204 B7R1.4 N[C@@H]1COC[C@@H]1O P12686 [0,1,0,1,0,0|1,0,1]=4 205 B7R1.4 N[C@H]1CCNC1=O 51276 [0,1,0,1,0,0|2,0,0]=4 206 B7R1.4 N[C@H]1CCNC1=O 51277 [0,1,0,1,0,0|2,0,0]=4 207 B7R1.4 N[C@H]1CCNC1=O 51278 [0,1,0,1,0,0|2,0,0]=4 208 B7R1.4 N[C@H]1CCNC1=O F14678 [0,1,0,1,0,0|2,0,0]=4 209 B7R1.4 N[C@H]1CCSC1=O O10218 [0,1,0,1,0,0|2,0,0]=4 210 B7R1.4 N[C@H]1COC[C@@H]1O 71841 [0,1,0,1,0,0|1,0,1]=4 211 B7R1.4 N[C@H]1COC[C@@H]1O P12486 [0,1,0,1,0,0|1,0,1]=4 212 B7R1.4 N[C@H]1COC[C@@H]1O P15828 [0,1,0,1,0,0|1,0,1]=4 213 B7R1.4 N[C@H]1CONC1=O FD3007 [0,1,0,1,0,0|2,0,0]=4 214 B7R1.4 O=C1NCC[C@@H]1Br 78555 [0,1,0,1,0,0|2,0,0]=4 215 B7R1.4 O=C1OCC[C@@H]1O F14291 [0,1,0,1,0,0|1,0,0]=3 216 B7R1.4 O[C@H]1CCC=C1Br D79898 [0,1,0,1,0,0|2,0,0]=4 217 B7R1.4 O[C@H]1COC[C@@H]1F 73076 [0,1,0,1,0,0|1,0,1]=4 218 B7R1.4 O[C@H]1COC[C@@H]1O 66690 [0,1,0,1,0,0|0,0,2]=4 219 B7R1.6 OCCC1COC1 32759 [0,1,0,1,0,0|1,0,1]=4 220 B7R1.8 CO[C@H]1CCC1=O P17941 [0,1,0,1,0,0|1,0,0]=3 221 B7R1.8 O=C1CC[C@@H]1CO P13853 [0,1,0,1,0,0|1,0,0]=3 222 B7R1.9 OC[C@H]1C[C@H]1CO P16470 [0,1,0,1,0,0|1,0,1]=4 223 B7R1.10 OCC1CC(O)C1 N10548 [0,1,0,1,0,0|1,0,1]=4 224 B7R1.22 O=C(CO)C1CC1 E72699 [0,1,0,1,0,0|1,0,0]=3 225 B7R1.25 NC1(CO)COC1 32838 [0,1,0,1,0,0|1,0,1]=4 226 B7R1.25 OCC1(F)COC1 32840 [0,1,0,1,0,0|1,0,1]=4 227 B7R1.18 C[C@H](O)C1COC1 P18451 [0,1,0,1,0,0|1,0,1]=4