0 B5R0.1 C=C(C)CON M40345 [0,0,0,0,0,0|2,0,2]=4 1 B5R0.1 C=C(C)OCC E5573 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.1 CC(=O)CC#N X40158 [0,0,0,0,0,0|2,0,2]=4 3 B5R0.1 CC(=O)CCCl C69539 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.1 CC(C)CNN B40316 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.1 CC(C)\C=N\O I2624 [0,0,0,0,0,0|1,1,1]=3 6 B5R0.1 CCC[C@@H](C)N P16023 [0,0,0,0,0,0|2,0,2]=4 7 B5R0.1 CCC[C@H](C)N P22363 [0,0,0,0,0,0|2,0,2]=4 8 B5R0.1 CCOC(=N)N E36845 [0,0,0,0,0,0|4,0,0]=4 9 B5R0.1 CCOC(=S)[S-] P69346 [0,0,0,0,0,0|4,0,0]=4 10 B5R0.1 CCOC(C)=N E68065 [0,0,0,0,0,0|3,0,0]=3 11 B5R0.1 CN(C)CC=O D39943 [0,0,0,0,0,0|1,1,2]=4 12 B5R0.1 CN(C)CCBr B39953 [0,0,0,0,0,0|2,0,1]=3 13 B5R0.1 CN(C)NC=O D66358 [0,0,0,0,0,0|2,1,1]=4 14 B5R0.1 C[C@@H](N)CCO A10772 [0,0,0,0,0,0|1,1,2]=4 15 B5R0.1 C[C@H](N)CCO A10771 [0,0,0,0,0,0|1,1,2]=4 16 B5R0.1 C[C@H](N)CCO A39964 [0,0,0,0,0,0|1,1,2]=4 17 B5R0.1 C[C@H](O)CCO B68917 [0,0,0,0,0,0|1,1,2]=4 18 B5R0.1 C\C(N)=C\C#N A60547 [0,0,0,0,0,0|2,0,1]=3 19 B5R0.1 NCCC(N)=O A67869 [0,0,0,0,0,0|3,0,1]=4 20 B5R0.1 O=C(O)\C=C\Br B9431 [0,0,0,0,0,0|3,0,1]=4 21 B4R0.1 C=C(Br)CO B39863 [1,0,0,0,0,0|1,1,1]=4 22 B4R0.1 C=C(I)CO I9998 [1,0,0,0,0,0|1,1,1]=4 23 B4R0.1 C=NN(C)C D66909 [1,0,0,0,0,0|2,0,1]=4 24 B4R0.1 CC(=N)NN A38897 [1,0,0,0,0,0|3,0,0]=4 25 B4R0.1 CC(=O)CN A38843 [1,0,0,0,0,0|2,0,0]=3 26 B4R0.1 CC(=O)CO H60801 [1,0,0,0,0,0|1,1,0]=3 27 B4R0.1 CC(=O)NN A64932 [1,0,0,0,0,0|3,0,0]=4 28 B4R0.1 CC(C)=CBr B2881 [1,0,0,0,0,0|1,0,0]=2 29 B4R0.1 CC(C)NN P67395 [1,0,0,0,0,0|2,0,1]=4 30 B4R0.1 CC(C)NO P39934 [1,0,0,0,0,0|1,1,1]=4 31 B4R0.1 CC(C)ON P39935 [1,0,0,0,0,0|2,0,1]=4 32 B4R0.1 CC(N)=NO H37897 [1,0,0,0,0,0|2,1,0]=4 33 B4R0.1 CCC(=N)N P39882 [1,0,0,0,0,0|2,0,1]=4 34 B4R0.1 CCC(=N)N P39927 [1,0,0,0,0,0|2,0,1]=4 35 B4R0.1 CCC(N)=O P68920 [1,0,0,0,0,0|2,0,1]=4 36 B4R0.1 CC[C@H](C)N B62608 [1,0,0,0,0,0|1,0,2]=4 37 B4R0.1 CNC(=N)N M38407 [1,0,0,0,0,0|3,0,0]=4 38 B4R0.1 CNN(C)C T66359 [1,0,0,0,0,0|2,0,0]=3 39 B4R0.1 COC(=N)N M69240 [1,0,0,0,0,0|3,0,0]=4 40 B4R0.1 CSC(=N)N M60715 [1,0,0,0,0,0|3,0,0]=4 41 B4R0.1 C[C@@H](Cl)CO C39879 [1,0,0,0,0,0|1,1,1]=4 42 B4R0.1 C[C@@H](N)CN D39937 [1,0,0,0,0,0|2,0,1]=4 43 B4R0.1 C[C@@H](N)CO A13415 [1,0,0,0,0,0|1,1,1]=4 44 B4R0.1 C[C@@H](O)CCl C67728 [1,0,0,0,0,0|2,0,1]=4 45 B4R0.1 C[C@@H](O)CN A67482 [1,0,0,0,0,0|2,0,1]=4 46 B4R0.1 C[C@H](Br)CN B39885 [1,0,0,0,0,0|2,0,1]=4 47 B4R0.1 C[C@H](Cl)CO C39880 [1,0,0,0,0,0|1,1,1]=4 48 B4R0.1 C[C@H](N)CF F62811 [1,0,0,0,0,0|2,0,1]=4 49 B4R0.1 C[C@H](N)CN P39936 [1,0,0,0,0,0|2,0,1]=4 50 B4R0.1 C[C@H](N)CO A13416 [1,0,0,0,0,0|1,1,1]=4 51 B4R0.1 C[C@H](N)CO A69136 [1,0,0,0,0,0|1,1,1]=4 52 B4R0.1 C[C@H](O)CN A69178 [1,0,0,0,0,0|2,0,1]=4 53 B4R0.1 C[C@H](O)CO P60705 [1,0,0,0,0,0|1,1,1]=4 54 B4R0.1 N=C(N)CCl C39776 [1,0,0,0,0,0|3,0,0]=4 55 B4R0.1 N=C(N)CO H39795 [1,0,0,0,0,0|2,1,0]=4 56 B4R0.1 NC(=O)CBr B39771 [1,0,0,0,0,0|3,0,0]=4 57 B4R0.1 NC(=O)CI K60849 [1,0,0,0,0,0|3,0,0]=4 58 B4R0.1 NC(=O)CO H68919 [1,0,0,0,0,0|2,1,0]=4 59 B4R0.1 NC(=S)CF F6787 [1,0,0,0,0,0|3,0,0]=4 60 B4R0.1 NCC(N)=O G69255 [1,0,0,0,0,0|3,0,0]=4 61 B4R0.2 C=CCCN B21913 [1,0,0,0,0,0|1,0,2]=4 62 B4R0.2 C=CCCO B40252 [1,0,0,0,0,0|0,1,2]=4 63 B4R0.2 CC#CCO H64582 [1,0,0,0,0,0|0,1,2]=4 64 B4R0.2 CNCCBr B38473 [1,0,0,0,0,0|2,0,1]=4 65 B4R0.2 CNCCCl C39886 [1,0,0,0,0,0|2,0,1]=4 66 B4R0.2 COCCBr B39138 [1,0,0,0,0,0|2,0,1]=4 67 B4R0.2 COCCI K39881 [1,0,0,0,0,0|2,0,1]=4 68 B4R0.2 CSCCN M62136 [1,0,0,0,0,0|2,0,1]=4 69 B4R0.2 N#CCCS M39860 [1,0,0,0,0,0|1,0,2]=4 70 B6R0.1 C#C\C(C)=C/CO M43300 [0,1,0,0,0,0|0,1,1]=3 71 B6R0.1 CC=CC(=O)CC H41457 [0,1,0,0,0,0|2,0,1]=4 72 B6R0.1 CCOC(=O)CN G69291 [0,1,0,0,0,0|3,0,0]=4 73 B6R0.1 CCOC(=O)CO E37817 [0,1,0,0,0,0|3,0,0]=4 74 B6R0.1 CCOC(=O)OC E40254 [0,1,0,0,0,0|3,0,0]=4 75 B6R0.1 CCO\C(C)=N\O E68624 [0,1,0,0,0,0|3,0,0]=4 76 B6R0.1 CNC(=O)CCN A40306 [0,1,0,0,0,0|2,0,1]=4 77 B6R0.1 COC(=O)CCBr M39155 [0,1,0,0,0,0|2,0,1]=4 78 B6R0.1 COC(=O)CCN M67902 [0,1,0,0,0,0|2,0,1]=4 79 B6R0.1 COC(=O)CCO M24551 [0,1,0,0,0,0|1,1,1]=4 80 B6R0.1 COC(=O)OCCl C62332 [0,1,0,0,0,0|3,0,0]=4 81 B6R0.1 COC(=O)\C=C/Br B3417 [0,1,0,0,0,0|2,0,1]=4 82 B6R0.1 COC(=O)\C=C/I I2748 [0,1,0,0,0,0|2,0,1]=4 83 B6R0.1 COC(=O)\C=C\I M40173 [0,1,0,0,0,0|2,0,1]=4 84 B6R0.1 CO[C@@H](C)CCO M68623 [0,1,0,0,0,0|0,1,2]=4 85 B6R0.2 CC(=O)C=C(C)N A41256 [0,1,0,0,0,0|1,1,1]=4 86 B6R0.2 CC(=O)NC(C)C P40402 [0,1,0,0,0,0|3,0,0]=4 87 B6R0.2 CC(=O)O[C@H](C)Br B40231 [0,1,0,0,0,0|3,0,0]=4 88 B6R0.2 CC(C)=CB(O)O D3007 [0,1,0,0,0,0|1,1,0]=3 89 B6R0.2 CC(C)C[C@H](C)N M43511 [0,1,0,0,0,0|1,0,2]=4 90 B6R0.2 CC(C)NC(C)C D64760 [0,1,0,0,0,0|2,0,1]=4 91 B6R0.3 C=C(CBr)C(=O)O B40169 [0,1,0,0,0,0|3,0,0]=4 92 B6R0.3 CC(C)C(=O)NN I0020 [0,1,0,0,0,0|2,0,1]=4 93 B6R0.3 CC(C)[C@@H](N)CO V15808 [0,1,0,0,0,0|0,1,2]=4 94 B6R0.3 CC(C)[C@H](N)CO V40442 [0,1,0,0,0,0|0,1,2]=4 95 B6R0.3 CC(C)\C(N)=N\O H39948 [0,1,0,0,0,0|1,1,1]=4 96 B6R0.3 CCC(=O)C(=O)[O-] S40297 [0,1,0,0,0,0|3,0,0]=4 97 B6R0.3 CCC(=O)N(C)C D67412 [0,1,0,0,0,0|2,0,0]=3 98 B6R0.3 CCN(C)C(C)=O E40404 [0,1,0,0,0,0|3,0,0]=4 99 B6R0.3 CN(C)C(=O)CBr B40249 [0,1,0,0,0,0|2,0,0]=3 100 B6R0.3 CN(C)C(=O)CN A39947 [0,1,0,0,0,0|2,0,0]=3 101 B6R0.3 CN(C)C(=O)CN A40307 [0,1,0,0,0,0|2,0,0]=3 102 B6R0.3 CN(C)C(=O)CN A61441 [0,1,0,0,0,0|2,0,0]=3 103 B6R0.3 CN(C)C(=O)CO H40267 [0,1,0,0,0,0|1,1,0]=3 104 B6R0.3 N[C@@H](CS)C(=O)O A39926 [0,1,0,0,0,0|2,0,1]=4 105 B6R0.3 N[C@H](CS)C(=O)O A37860 [0,1,0,0,0,0|2,0,1]=4 106 B6R0.3 N[C@H](CS)C(=O)O C67456 [0,1,0,0,0,0|2,0,1]=4 107 B6R0.3 N[C@H](CS)C(=O)O C69203 [0,1,0,0,0,0|2,0,1]=4 108 B6R0.4 CC(=O)CCCCl C68599 [0,1,0,0,0,0|2,0,1]=4 109 B6R0.4 CC(=O)NCCN A68626 [0,1,0,0,0,0|2,0,1]=4 110 B6R0.4 CC(=O)NCCO H68625 [0,1,0,0,0,0|1,1,1]=4 111 B6R0.4 CC(=O)OCCBr B67892 [0,1,0,0,0,0|2,0,1]=4 112 B6R0.4 CC(C)=CCCBr B0351 [0,1,0,0,0,0|1,0,0]=2 113 B6R0.4 CC(C)=CCC[Mg+] M31885 [0,1,0,0,0,0|1,0,0]=2 114 B6R0.4 CC(C)CCCO M67872 [0,1,0,0,0,0|0,1,2]=4 115 B6R0.4 CC(C)NCCCl C40431 [0,1,0,0,0,0|1,0,2]=4 116 B6R0.4 CC(C)OCCBr B69154 [0,1,0,0,0,0|1,0,2]=4 117 B6R0.4 CN(C)CCCBr B40430 [0,1,0,0,0,0|2,0,1]=4 118 B6R0.4 CN(C)CCCCl C69241 [0,1,0,0,0,0|2,0,1]=4 119 B6R0.4 CN(C)\C=C\C=O D36904 [0,1,0,0,0,0|1,1,1]=4 120 B6R0.4 CNCCN(C)C T41392 [0,1,0,0,0,0|2,0,1]=4 121 B6R0.4 COC=CC(C)=O M41222 [0,1,0,0,0,0|1,1,1]=4 122 B6R0.4 O=C(O)\C=C\CBr B37272 [0,1,0,0,0,0|3,0,0]=4 123 B6R0.5 CC(C)(C)CCBr B41571 [0,1,0,0,0,0|1,0,2]=4 124 B6R0.5 CC(C)(F)CCN F62077 [0,1,0,0,0,0|1,0,2]=4 125 B6R0.5 CC(C)(N)CCN M37075 [0,1,0,0,0,0|1,0,2]=4 126 B6R0.5 CC(C)(N)CCO A40444 [0,1,0,0,0,0|0,1,2]=4 127 B6R0.5 CC(C)(O)CCN A61563 [0,1,0,0,0,0|1,0,2]=4 128 B6R0.5 CCC[N+](C)(C)C T43586 [0,1,0,0,0,0|2,0,1]=4 129 B6R0.5 C[N+](C)(C)CCO H63396 [0,1,0,0,0,0|1,1,1]=4 130 B6R0.5 C[Si](C)(C)\C=C\I K60897 [0,1,0,0,0,0|1,1,1]=4 131 B6R1.2 BrC1=CSC=C1 B39148 [0,0,0,1,0,0|1,0,2]=4 132 B6R1.2 BrC1=CSN=C1 B39812 [0,0,0,1,0,0|2,0,1]=4 133 B6R1.2 BrC1=NSC=C1 B39811 [0,0,0,1,0,0|2,0,1]=4 134 B6R1.2 CC1=CC=CN1 M37933 [0,0,0,1,0,0|2,0,1]=4 135 B6R1.2 CC1=CC=CS1 M39179 [0,0,0,1,0,0|2,0,1]=4 136 B6R1.2 CC1=CC=NO1 M24354 [0,0,0,1,0,0|2,0,1]=4 137 B6R1.2 CC1=CN=CS1 M40166 [0,0,0,1,0,0|3,0,0]=4 138 B6R1.2 CC1=CNC=C1 M14657 [0,0,0,1,0,0|1,0,2]=4 139 B6R1.2 CC1=COC=N1 M13405 [0,0,0,1,0,0|3,0,0]=4 140 B6R1.2 CC1=CSC=N1 M24933 [0,0,0,1,0,0|1,0,2]=4 141 B6R1.2 CC1=NCCC1 M41239 [0,0,0,1,0,0|2,0,0]=3 142 B6R1.2 CC1=NNC=C1 M36663 [0,0,0,1,0,0|2,0,1]=4 143 B6R1.2 CC1=NOC=C1 M40157 [0,0,0,1,0,0|1,1,1]=4 144 B6R1.2 CC1=NON=C1 M62158 [0,0,0,1,0,0|2,1,0]=4 145 B6R1.2 C[C@@H]1CCCN1 M23610 [0,0,0,1,0,0|2,0,1]=4 146 B6R1.2 C[C@@H]1CCNC1 M22540 [0,0,0,1,0,0|1,0,2]=4 147 B6R1.2 C[C@H]1CCCN1 M21836 [0,0,0,1,0,0|2,0,1]=4 148 B6R1.2 C[C@H]1CCCN1 M24199 [0,0,0,1,0,0|2,0,1]=4 149 B6R1.2 C[C@H]1CCCN1 M24435 [0,0,0,1,0,0|2,0,1]=4 150 B6R1.2 C[C@H]1CCNC1 M22012 [0,0,0,1,0,0|1,0,2]=4 151 B6R1.2 C[C@H]1CCNC1 M69520 [0,0,0,1,0,0|1,0,2]=4 152 B6R1.2 ClC1=CSC=C1 C40018 [0,0,0,1,0,0|1,0,2]=4 153 B6R1.2 IC1=CSC=C1 K40019 [0,0,0,1,0,0|1,0,2]=4 154 B6R1.2 NC1=CSC=C1 A40167 [0,0,0,1,0,0|1,0,2]=4 155 B6R1.2 NC1=CSC=C1 T10330 [0,0,0,1,0,0|1,0,2]=4 156 B6R1.2 NC1=CSC=C1 T64858 [0,0,0,1,0,0|1,0,2]=4 157 B6R1.2 NC1=NCCC1 D38561 [0,0,0,1,0,0|3,0,0]=4 158 B6R1.2 O=C1C=CCC1 C26583 [0,0,0,1,0,0|2,0,1]=4 159 B6R1.2 O=C1C=CSN1 T60536 [0,0,0,1,0,0|2,0,1]=4 160 B6R1.2 O=C1CCNC1 P0198 [0,0,0,1,0,0|2,0,1]=4 161 B6R1.2 O=C1CCOC1 X0391 [0,0,0,1,0,0|1,1,1]=4 162 B6R1.2 O=C1CCSC1 D10906 [0,0,0,1,0,0|1,0,1]=3 163 B6R1.3 ICCC1CC1 I23113 [0,0,0,1,0,0|1,0,2]=4 164 B6R1.3 NCCC1CC1 C7864 [0,0,0,1,0,0|1,0,2]=4 165 B6R1.3 OCCC1CC1 C7861 [0,0,0,1,0,0|0,1,2]=4 166 B6R1.3 OCCN1CC1 A69643 [0,0,0,1,0,0|1,1,1]=4 167 B6R1.5 CC1CC(=O)C1 M17286 [0,0,0,1,0,0|2,0,1]=4 168 B6R1.5 CC1CC(N)C1 M41317 [0,0,0,1,0,0|1,0,2]=4 169 B6R1.5 CN1CC(N)C1 M0108 [0,0,0,1,0,0|2,0,1]=4 170 B6R1.5 CN1CC(O)C1 H0109 [0,0,0,1,0,0|1,1,1]=4 171 B6R1.5 NC1CC(=O)C1 A0660 [0,0,0,1,0,0|2,0,1]=4 172 B6R1.5 O=C1CC(Br)C1 B8012 [0,0,0,1,0,0|2,0,1]=4 173 B6R1.5 O=C1CC(F)C1 F13109 [0,0,0,1,0,0|2,0,1]=4 174 B6R1.5 O=C1CC(O)C1 H10121 [0,0,0,1,0,0|1,1,1]=4 175 B6R1.9 CC1(C)C[C@@H]1Br B60254 [0,0,0,1,0,0|1,0,2]=4 176 B3R0.1 CCCN P62456 [2,0,0,0,0,0|1,0,1]=4 177 B3R0.1 CCNC M39932 [2,0,0,0,0,0|1,0,1]=4 178 B3R0.2 C=C(C)[Mg+] K5651 [2,0,0,0,0,0|1,0,0]=3 179 B3R0.2 CC(=O)O F69263 [2,0,0,0,0,0|1,1,0]=4 180 B3R0.2 CC(=O)[O-] C69398 [2,0,0,0,0,0|1,1,0]=4 181 B3R0.2 CC(=O)[O-] M67642 [2,0,0,0,0,0|1,1,0]=4 182 B3R0.2 CC(=O)[O-] N62590 [2,0,0,0,0,0|1,1,0]=4 183 B3R0.2 CC(=O)[O-] P67455 [2,0,0,0,0,0|1,1,0]=4 184 B3R0.2 CC(=O)[O-] R62611 [2,0,0,0,0,0|1,1,0]=4 185 B3R0.2 CC(=O)[O-] S62515 [2,0,0,0,0,0|1,1,0]=4 186 B3R0.2 CC(C)N P39142 [2,0,0,0,0,0|1,0,1]=4 187 B3R0.2 C[S+](C)C T68118 [2,0,0,0,0,0|1,0,0]=3 188 B3R0.2 NC(=S)S A39756 [2,0,0,0,0,0|2,0,0]=4 189 B5R0.3 C=C(CBr)CBr B36829 [1,1,0,0,0,0|1,0,1]=4 190 B5R0.3 C=C(CCl)CCl C10867 [1,1,0,0,0,0|1,0,1]=4 191 B5R0.3 C=C(CO)CO M5145 [1,1,0,0,0,0|0,1,1]=4 192 B5R0.3 C=CC(=O)NC M37664 [1,1,0,0,0,0|1,0,1]=4 193 B5R0.3 CC(CBr)CBr D40238 [1,1,0,0,0,0|1,0,1]=4 194 B5R0.3 CC(CO)CO M60880 [1,1,0,0,0,0|0,1,1]=4 195 B5R0.3 CCC(=O)CN A32390 [1,1,0,0,0,0|1,0,1]=4 196 B5R0.3 CCC(=O)CO H36713 [1,1,0,0,0,0|1,0,1]=4 197 B5R0.3 CNC(=O)CBr B60913 [1,1,0,0,0,0|2,0,0]=4 198 B5R0.3 CNC(=O)CCl C67921 [1,1,0,0,0,0|2,0,0]=4 199 B5R0.3 COC(=O)CN M69126 [1,1,0,0,0,0|2,0,0]=4 200 B5R0.3 COC(=O)CO M67586 [1,1,0,0,0,0|1,1,0]=4 201 B5R0.3 CO[C@@H](C)CN M40313 [1,1,0,0,0,0|1,0,1]=4 202 B5R0.3 CO[C@@H](C)CO M68380 [1,1,0,0,0,0|0,1,1]=4 203 B5R0.3 CO[C@H](C)CN M40312 [1,1,0,0,0,0|1,0,1]=4 204 B5R0.3 CO[C@H](C)CO M68381 [1,1,0,0,0,0|0,1,1]=4 205 B5R0.3 O=C(CCl)CCl D4849 [1,1,0,0,0,0|2,0,0]=4 206 B5R0.4 C=C[Si](C)(C)C E25225 [1,1,0,0,0,0|0,1,1]=4 207 B5R0.4 CC(C)(C)CN D41344 [1,1,0,0,0,0|1,0,1]=4 208 B5R0.4 CC(C)(C)C[Mg+] D31702 [1,1,0,0,0,0|1,0,1]=4 209 B5R0.4 CC(C)(F)CO F64897 [1,1,0,0,0,0|0,1,1]=4 210 B5R0.4 CC(C)(N)CN M25502 [1,1,0,0,0,0|1,0,1]=4 211 B5R0.4 CC(C)(N)CO A68632 [1,1,0,0,0,0|0,1,1]=4 212 B5R0.4 CC(C)(O)CCl C40272 [1,1,0,0,0,0|1,0,1]=4 213 B5R0.4 CC(C)(O)CN A10987 [1,1,0,0,0,0|1,0,1]=4 214 B5R0.4 CC(C)(O)CO M37968 [1,1,0,0,0,0|0,1,1]=4 215 B5R0.4 CC(C)(S)CN A40315 [1,1,0,0,0,0|1,0,1]=4 216 B5R0.4 C[Si](C)(C)CI K39963 [1,1,0,0,0,0|1,1,0]=4 217 B5R0.5 CC(=O)C(=O)[O-] C43424 [1,1,0,0,0,0|1,1,0]=4 218 B5R0.5 CC(C)C(=N)N B40303 [1,1,0,0,0,0|1,0,1]=4 219 B5R0.5 CC(C)C(N)=O I4848 [1,1,0,0,0,0|0,1,1]=4 220 B5R0.5 CC(C)C(N)=S M3101 [1,1,0,0,0,0|0,0,2]=4 221 B5R0.5 CN(C)C(=S)Cl D8332 [1,1,0,0,0,0|1,0,1]=4 222 B5R0.2 BrC\C=C\CBr D60806 [1,1,0,0,0,0|1,0,0]=3 223 B5R0.2 CCO\C=C/Br B2725 [1,1,0,0,0,0|2,0,0]=4 224 B5R0.2 NC\C=C/CCl C65470 [1,1,0,0,0,0|1,0,0]=3 225 B5R0.2 NC\C=C/CN B69714 [1,1,0,0,0,0|1,0,0]=3 226 B5R0.2 NOCC=CCl C39871 [1,1,0,0,0,0|1,1,0]=4 227 B5R0.2 OC\C=C\CO B64254 [1,1,0,0,0,0|0,1,0]=3 228 B7R0.2 CC(C)NC(=O)CCl P40378 [0,2,0,0,0,0|1,0,1]=4 229 B7R0.2 CC(C)OC(=O)CO I38145 [0,2,0,0,0,0|0,1,1]=4 230 B7R0.2 CCC(=O)CC(C)=O H69646 [0,2,0,0,0,0|2,0,0]=4 231 B7R0.2 CCC(=O)OC(C)=O A41227 [0,2,0,0,0,0|2,0,0]=4 232 B7R0.2 COC(=O)C=C(C)C M41461 [0,2,0,0,0,0|0,1,1]=4 233 B7R0.3 COC(=O)C=CCBr M37461 [0,2,0,0,0,0|2,0,0]=4 234 B7R0.3 COC(=O)\C=C\CBr M41176 [0,2,0,0,0,0|2,0,0]=4 235 B7R0.5 CC(C)C(=O)CC#N M43378 [0,2,0,0,0,0|1,0,1]=4 236 B7R0.5 CC(C)C(=O)OCCl C24559 [0,2,0,0,0,0|1,0,1]=4 237 B7R0.5 CCC=C(C)C(=O)O M39198 [0,2,0,0,0,0|1,0,1]=4 238 B7R0.5 CCOC(=O)C(C)=O E60800 [0,2,0,0,0,0|2,0,0]=4 239 B7R0.5 CC\C=C(/C)C(=O)O M41462 [0,2,0,0,0,0|1,0,1]=4 240 B7R0.10 C=C(CBr)C(=O)OC M36843 [0,2,0,0,0,0|2,0,0]=4 241 B7R0.10 C=C(CO)C(=O)OC M7022 [0,2,0,0,0,0|1,1,0]=4 242 B7R0.10 CCC(=O)C(=O)CC H41459 [0,2,0,0,0,0|2,0,0]=4 243 B7R0.10 CCC(=O)N(C)OC M40411 [0,2,0,0,0,0|2,0,0]=4 244 B7R0.10 COC(=O)C(=O)CBr M2726 [0,2,0,0,0,0|2,0,0]=4 245 B7R0.10 COC(=O)[C@H](N)CS M69349 [0,2,0,0,0,0|1,0,1]=4 246 B7R0.10 CON(C)C(=O)CCl C40248 [0,2,0,0,0,0|2,0,0]=4 247 B7R0.8 C[Si](C)(C)\C=C\CO T41617 [0,2,0,0,0,0|0,2,0]=4 248 B5R1.2 CC1CNC1 M1321 [1,0,0,1,0,0|1,0,1]=4 249 B5R1.2 C[C@H]1CCN1 M29512 [1,0,0,1,0,0|1,0,1]=4 250 B5R1.2 NC1CSC1 T6025 [1,0,0,1,0,0|1,0,1]=4 251 B5R1.2 O=C1CCC1 C8674 [1,0,0,1,0,0|1,0,1]=4 252 B5R1.2 O=C1CNC1 A1318 [1,0,0,1,0,0|2,0,0]=4 253 B5R1.2 O=C1COC1 O4015 [1,0,0,1,0,0|1,1,0]=4 254 B5R1.2 O=C1CSC1 T6026 [1,0,0,1,0,0|1,0,0]=3 255 B5R1.3 BrCC1CC1 C2498 [1,0,0,1,0,0|1,0,1]=4 256 B5R1.3 CNC1CC1 M1319 [1,0,0,1,0,0|1,0,1]=4 257 B5R1.3 CNC1CC1 M14718 [1,0,0,1,0,0|1,0,1]=4 258 B5R1.3 O=CC1CC1 C20058 [1,0,0,1,0,0|0,1,1]=4 259 B5R1.4 C[C@@H]1C[C@H]1N M40340 [1,0,0,1,0,0|1,0,1]=4 260 B5R1.1 C1=CCNC1 D40328 [1,0,0,1,0,0|1,0,0]=3 261 B5R1.1 C1=CSN=C1 T39830 [1,0,0,1,0,0|1,0,1]=4 262 B5R1.1 C1CSCN1 T38217 [1,0,0,1,0,0|1,0,1]=4 263 B5R1.1 C1CSCN1 T60563 [1,0,0,1,0,0|1,0,1]=4 264 B7R1.1 BrCC1=CCCC1 B7551 [0,1,0,1,0,0|1,0,0]=3 265 B7R1.1 BrCC1=CSC=C1 B60823 [0,1,0,1,0,0|0,0,2]=4 266 B7R1.1 COC1=CSC=C1 M41124 [0,1,0,1,0,0|0,0,2]=4 267 B7R1.1 COC1=NCCC1 M69559 [0,1,0,1,0,0|2,0,0]=4 268 B7R1.1 NCC1=CSC=C1 T41357 [0,1,0,1,0,0|0,0,2]=4 269 B7R1.1 NCC1=NSC=C1 I15218 [0,1,0,1,0,0|1,0,1]=4 270 B7R1.1 O=CC1=CCCC1 C69466 [0,1,0,1,0,0|1,0,1]=4 271 B7R1.1 OCC1=CSC=C1 T12827 [0,1,0,1,0,0|0,0,2]=4 272 B7R1.2 CC1=CC(=O)CC1 M22783 [0,1,0,1,0,0|0,1,1]=4 273 B7R1.2 CC1=CC(=O)CO1 M41117 [0,1,0,1,0,0|0,1,1]=4 274 B7R1.2 CC1=CSC(N)=C1 A0597 [0,1,0,1,0,0|0,0,2]=4 275 B7R1.2 CC1=NSC(I)=C1 I6114 [0,1,0,1,0,0|1,0,1]=4 276 B7R1.2 CC1=NSC(N)=C1 M65783 [0,1,0,1,0,0|1,0,1]=4 277 B7R1.2 O=C1C[C@@H](S)CN1 M12154 [0,1,0,1,0,0|1,0,1]=4 278 B7R1.3 CC1=CCCNC1 M12102 [0,1,0,1,0,0|1,0,0]=3 279 B7R1.3 CC1=CCNCC1 M26826 [0,1,0,1,0,0|1,0,0]=3 280 B7R1.3 O=C1C=CCOC1 P26982 [0,1,0,1,0,0|1,1,0]=4 281 B7R1.3 O=C1CCCSC1 T1776 [0,1,0,1,0,0|1,0,1]=4 282 B7R1.3 O=C1CCSCC1 T6200 [0,1,0,1,0,0|1,0,1]=4 283 B7R1.3 O=C1CSCCN1 T40230 [0,1,0,1,0,0|1,0,1]=4 284 B7R1.4 BrC1=C(Br)CCC1 D68539 [0,1,0,1,0,0|2,0,0]=4 285 B7R1.4 CC1=C(Br)SC=C1 B12699 [0,1,0,1,0,0|0,0,2]=4 286 B7R1.4 CC1=C(C)SC=N1 D41175 [0,1,0,1,0,0|1,0,1]=4 287 B7R1.4 CC1=C(Cl)SC=C1 C39173 [0,1,0,1,0,0|0,0,2]=4 288 B7R1.4 CC1=CC=NN1C D3267 [0,1,0,1,0,0|1,0,1]=4 289 B7R1.4 CC1=CNC=C1C D12050 [0,1,0,1,0,0|2,0,0]=4 290 B7R1.4 CC1=CNN=C1C D22811 [0,1,0,1,0,0|2,0,0]=4 291 B7R1.4 CC1=CNN=C1C D60965 [0,1,0,1,0,0|2,0,0]=4 292 B7R1.4 CC1=CSC=C1Br B40866 [0,1,0,1,0,0|0,0,2]=4 293 B7R1.4 CN1CCCC1=S M6872 [0,1,0,1,0,0|2,0,0]=4 294 B7R1.4 C[C@H]1CCCC1=O M41458 [0,1,0,1,0,0|1,0,1]=4 295 B7R1.6 COC=C1COC1 M6231 [0,1,0,1,0,0|2,0,0]=4 296 B7R1.6 N#CC=C1CNC1 A18603 [0,1,0,1,0,0|1,0,1]=4 297 B7R1.6 N#CC=C1COC1 X6646 [0,1,0,1,0,0|1,0,1]=4 298 B7R1.22 CCC(=O)C1CC1 C24823 [0,1,0,1,0,0|1,0,1]=4 299 B7R1.17 CC1(C)CCC1=O D60316 [0,1,0,1,0,0|1,0,1]=4