0 B7R0.7 CC#CC(=O)OCC E36835 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.7 CCC[C@H](N)CCO A43513 [0,0,0,0,0,0|4,0,0]=4 2 B7R0.7 CCNC(=O)NCC D40424 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.7 CCOC(=O)CCBr E39188 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.7 CCOC(=O)CCI E41273 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.7 CCOC(=O)CCO E36682 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.7 CCOC(=O)CNC S69399 [0,0,0,0,0,0|3,0,1]=4 7 B7R0.7 CCOC(=O)CSC E40386 [0,0,0,0,0,0|3,0,1]=4 8 B7R0.7 CCOC(=O)OCCl C38646 [0,0,0,0,0,0|2,0,1]=3 9 B7R0.7 CCOC(C)=NC#N E41191 [0,0,0,0,0,0|2,0,2]=4 10 B6R0.1 CCC[C@@H](Cl)CC C63946 [1,0,0,0,0,0|2,0,0]=3 11 B6R0.1 CCC[C@H](N)CO A40443 [1,0,0,0,0,0|3,0,0]=4 12 B6R0.1 CCC[C@H](N)CO A66421 [1,0,0,0,0,0|3,0,0]=4 13 B6R0.1 CCOC(=O)CN G69291 [1,0,0,0,0,0|2,0,1]=4 14 B6R0.1 CCOC(=O)CO E37817 [1,0,0,0,0,0|2,0,1]=4 15 B6R0.1 CCOC(=O)OC E40254 [1,0,0,0,0,0|1,0,1]=3 16 B6R0.1 CCO\C(C)=N\O E68624 [1,0,0,0,0,0|2,0,1]=4 17 B6R0.1 COC(=O)OCCl C62332 [1,0,0,0,0,0|2,0,1]=4 18 B6R0.1 CO[C@@H](C)CCO M68623 [1,0,0,0,0,0|2,0,0]=3 19 B6R0.6 CCCCCC[Mg+] H31703 [1,0,0,0,0,0|3,0,0]=4 20 B6R0.6 CCCCCNC M41618 [1,0,0,0,0,0|3,0,0]=4 21 B6R0.6 CCOCCC#N E41255 [1,0,0,0,0,0|2,0,1]=4 22 B8R0.1 CCOC(=O)CCCBr B69333 [0,1,0,0,0,0|2,0,1]=4 23 B8R0.1 CCOC(=O)CCCI E31893 [0,1,0,0,0,0|2,0,1]=4 24 B8R0.1 CCOC(=O)CCCN E43487 [0,1,0,0,0,0|2,0,1]=4 25 B8R0.1 CCOC(=O)CCNC E41584 [0,1,0,0,0,0|2,0,1]=4 26 B8R0.1 CCOC(=O)CCSC E39202 [0,1,0,0,0,0|2,0,1]=4 27 B8R0.1 CCOCC(=O)OCC E41554 [0,1,0,0,0,0|1,0,1]=3 28 B8R0.3 CCN[C@@H](C)C(=O)OC M32327 [0,1,0,0,0,0|3,0,0]=4 29 B8R0.3 CCOC(=O)C(=O)CC E67705 [0,1,0,0,0,0|2,0,1]=4 30 B8R0.3 CCOC(=O)[C@@H](C)CC E43888 [0,1,0,0,0,0|2,0,1]=4 31 B8R0.3 CCOC(=O)[C@@H](N)CC E43491 [0,1,0,0,0,0|2,0,1]=4 32 B8R0.5 CC(C)OC(=O)OCCl C68871 [0,1,0,0,0,0|2,0,1]=4 33 B8R0.5 CC(C)OC(=O)OCI K62369 [0,1,0,0,0,0|2,0,1]=4 34 B8R0.5 CCOC(=O)C[C@@H](C)O E64944 [0,1,0,0,0,0|2,0,1]=4 35 B8R0.5 CCOC(=O)C[C@H](C)N E43492 [0,1,0,0,0,0|2,0,1]=4 36 B8R0.5 CCOC(=O)C[C@H](C)N E61042 [0,1,0,0,0,0|2,0,1]=4 37 B8R0.22 C#CC(OCC)OCC D43803 [0,1,0,0,0,0|0,0,1]=2 38 B8R0.22 CCOC(C#N)OCC D41500 [0,1,0,0,0,0|0,0,1]=2 39 B8R0.22 CCOC(CBr)OCC B8051 [0,1,0,0,0,0|0,0,0]=1 40 B8R0.22 CCOC(CI)OCC D1378 [0,1,0,0,0,0|0,0,0]=1 41 B8R0.22 CCOC(CN)OCC D41622 [0,1,0,0,0,0|0,0,0]=1 42 B8R0.22 CCOC(CO)OCC D37875 [0,1,0,0,0,0|0,0,0]=1 43 B8R0.30 CCOP(=O)([O-])OCC E54072 [0,1,0,0,0,0|2,0,0]=3 44 B8R1.4 CC1CC(N)CCO1 M26284 [0,0,0,1,0,0|2,0,0]=3 45 B8R1.4 CC1CC(O)CCN1 M11589 [0,0,0,1,0,0|3,0,0]=4 46 B8R1.4 CC1CC(O)CCO1 M14345 [0,0,0,1,0,0|2,0,0]=3 47 B8R1.4 CC1CNCC(C)C1 D39299 [0,0,0,1,0,0|3,0,0]=4 48 B8R1.4 CC1CNCC(C)N1 D4711 [0,0,0,1,0,0|3,0,0]=4 49 B8R1.4 C[C@@H]1CC(=O)CCO1 M11329 [0,0,0,1,0,0|2,0,1]=4 50 B8R1.4 C[C@@H]1CN(C)CCN1 D27738 [0,0,0,1,0,0|3,0,0]=4 51 B8R1.4 C[C@@H]1CN(C)CCN1 D62333 [0,0,0,1,0,0|3,0,0]=4 52 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 D13904 [0,0,0,1,0,0|3,0,0]=4 53 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 D20228 [0,0,0,1,0,0|3,0,0]=4 54 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 D43561 [0,0,0,1,0,0|3,0,0]=4 55 B8R1.4 C[C@@H]1COC[C@@H](C)N1 D27896 [0,0,0,1,0,0|3,0,0]=4 56 B8R1.4 C[C@@H]1C[C@H](O)CCN1 M31245 [0,0,0,1,0,0|3,0,0]=4 57 B8R1.4 C[C@H]1CC(=O)CCO1 M11328 [0,0,0,1,0,0|2,0,1]=4 58 B8R1.4 C[C@H]1CC(=O)CCO1 M14197 [0,0,0,1,0,0|2,0,1]=4 59 B8R1.4 C[C@H]1CN(C)CCN1 D41607 [0,0,0,1,0,0|3,0,0]=4 60 B8R1.4 C[C@H]1CNC[C@@H](C)N1 D10658 [0,0,0,1,0,0|3,0,0]=4 61 B8R1.4 C[C@H]1CNC[C@@H](C)O1 D14096 [0,0,0,1,0,0|2,0,0]=3 62 B8R1.4 C[C@H]1CNC[C@H](C)N1 D11159 [0,0,0,1,0,0|3,0,0]=4 63 B8R1.4 C[C@H]1CNC[C@H](C)N1 D20216 [0,0,0,1,0,0|3,0,0]=4 64 B8R1.4 C[C@H]1CNC[C@H](C)O1 D22785 [0,0,0,1,0,0|2,0,0]=3 65 B8R1.4 C[C@H]1CNC[C@H](C)O1 D7921 [0,0,0,1,0,0|2,0,0]=3 66 B8R1.4 C[C@H]1COC[C@@H](C)N1 D11279 [0,0,0,1,0,0|3,0,0]=4 67 B8R1.4 C[C@H]1C[C@@H](O)CCN1 M11590 [0,0,0,1,0,0|3,0,0]=4 68 B8R1.4 C[C@H]1C[C@@H](O)CCN1 M8079 [0,0,0,1,0,0|3,0,0]=4 69 B8R1.6 CCNC1CN(C)C1 A19743 [0,0,0,1,0,0|3,0,0]=4 70 B8R1.6 CCOC1CC(N)C1 E15188 [0,0,0,1,0,0|2,0,0]=3 71 B8R1.6 CCO[C@H]1C[C@@H](N)C1 E19476 [0,0,0,1,0,0|2,0,0]=3 72 B8R1.6 CCO[C@H]1C[C@H](N)C1 E15190 [0,0,0,1,0,0|2,0,0]=3 73 B8R1.8 BrCCC1OCCO1 B41267 [0,0,0,1,0,0|3,0,0]=4 74 B8R1.8 CCO[C@@H]1CCNC1 E13930 [0,0,0,1,0,0|2,0,0]=3 75 B8R1.8 CCO[C@H]1CCNC1 E14045 [0,0,0,1,0,0|2,0,0]=3 76 B8R1.8 COC[C@@H]1CCCN1 M14243 [0,0,0,1,0,0|3,0,0]=4 77 B8R1.8 COC[C@H]1CCCN1 M14242 [0,0,0,1,0,0|3,0,0]=4 78 B8R1.8 NCCC1CCCC1 C46503 [0,0,0,1,0,0|3,0,0]=4 79 B8R1.8 NCC[C@H]1CCCO1 T1128 [0,0,0,1,0,0|2,0,0]=3 80 B8R1.8 OCC[C@H]1CCCN1 P11010 [0,0,0,1,0,0|3,0,0]=4 81 B8R1.22 C[C@H]1CCNCCN1 M13937 [0,0,0,1,0,0|3,0,0]=4 82 B8R1.37 CCOC(=O)C1CC1 E41463 [0,0,0,1,0,0|2,0,1]=4 83 B5R0.1 C=C(C)OCC E5573 [2,0,0,0,0,0|0,0,2]=4 84 B5R0.1 CC#C[C@H](C)O B1790 [2,0,0,0,0,0|1,0,1]=4 85 B5R0.1 CCC[C@@H](C)N P16023 [2,0,0,0,0,0|2,0,0]=4 86 B5R0.1 CCC[C@H](C)N P22363 [2,0,0,0,0,0|2,0,0]=4 87 B5R0.1 CCOC(C)=N E68065 [2,0,0,0,0,0|1,0,1]=4 88 B5R0.1 COC[C@@H](C)O M39959 [2,0,0,0,0,0|2,0,0]=4 89 B5R0.1 COC[C@H](C)O M61064 [2,0,0,0,0,0|2,0,0]=4 90 B5R0.1 C[C@H](O)CCO B68917 [2,0,0,0,0,0|2,0,0]=4 91 B5R0.2 CCCCON B40310 [2,0,0,0,0,0|2,0,0]=4 92 B5R0.2 CNCCOC M23409 [2,0,0,0,0,0|2,0,0]=4 93 B5R0.2 COCCCBr B68335 [2,0,0,0,0,0|2,0,0]=4 94 B5R0.2 COCCCO M69411 [2,0,0,0,0,0|2,0,0]=4 95 B5R0.3 CC(CBr)CBr D40238 [2,0,0,0,0,0|2,0,0]=4 96 B5R0.3 CC(CO)CO M60880 [2,0,0,0,0,0|2,0,0]=4 97 B5R0.3 CCC(N)CC P40440 [2,0,0,0,0,0|1,0,0]=3 98 B5R0.3 CC[C@@H](N)CO A39144 [2,0,0,0,0,0|2,0,0]=4 99 B5R0.3 CC[C@@H](O)CO B39955 [2,0,0,0,0,0|2,0,0]=4 100 B5R0.3 CC[C@H](N)CO A39145 [2,0,0,0,0,0|2,0,0]=4 101 B5R0.3 CC[C@H](O)CO B39956 [2,0,0,0,0,0|2,0,0]=4 102 B5R0.3 CO[C@@H](C)CN M40313 [2,0,0,0,0,0|1,0,0]=3 103 B5R0.3 CO[C@@H](C)CO M68380 [2,0,0,0,0,0|1,0,0]=3 104 B5R0.3 CO[C@H](C)CN M40312 [2,0,0,0,0,0|1,0,0]=3 105 B5R0.3 CO[C@H](C)CO M68381 [2,0,0,0,0,0|1,0,0]=3 106 B7R0.3 CCCC[C@@H]([Mg+])CC E31708 [1,1,0,0,0,0|2,0,0]=4 107 B7R0.3 CCCOC(=O)OC M40388 [1,1,0,0,0,0|1,0,1]=4 108 B7R0.5 CCOC(=O)[C@@H](C)N A39194 [1,1,0,0,0,0|1,0,1]=4 109 B7R0.5 CCOC(=O)[C@@H](C)O E68607 [1,1,0,0,0,0|1,0,1]=4 110 B7R0.5 CCOC(=O)[C@H](C)F E41270 [1,1,0,0,0,0|1,0,1]=4 111 B7R0.5 CCOC(=O)[C@H](C)S E40385 [1,1,0,0,0,0|1,0,1]=4 112 B7R0.10 CCC(=O)N(C)OC M40411 [1,1,0,0,0,0|2,0,0]=4 113 B7R0.10 CC[C@H](C)[C@H](N)CO K68906 [1,1,0,0,0,0|2,0,0]=4 114 B7R0.12 COC(CCBr)OC B40419 [1,1,0,0,0,0|2,0,0]=4 115 B7R0.12 COCC(OC)OC T40436 [1,1,0,0,0,0|2,0,0]=4 116 B7R0.1 CCCCCCCBr B43897 [1,1,0,0,0,0|2,0,0]=4 117 B7R0.1 CCCCCCC[Mg+] H31707 [1,1,0,0,0,0|2,0,0]=4 118 B7R0.1 COCCOCCI K40420 [1,1,0,0,0,0|2,0,0]=4 119 B7R0.1 COCCOCCN M38824 [1,1,0,0,0,0|2,0,0]=4 120 B7R0.4 CCCCC[C@H](C)O H43947 [1,1,0,0,0,0|2,0,0]=4 121 B9R0.5 CCOC(=O)COCCCl E41531 [0,2,0,0,0,0|1,0,1]=4 122 B9R0.5 CCOC=CC(=O)OCC E43814 [0,2,0,0,0,0|1,0,1]=4 123 B9R0.5 CCO\C=C\C(=O)OCC E43813 [0,2,0,0,0,0|1,0,1]=4 124 B9R0.35 CCC[C@H](C)C(=O)OCC E39445 [0,2,0,0,0,0|1,0,0]=3 125 B9R0.35 CCC[C@H](N)C(=O)OCC N65311 [0,2,0,0,0,0|2,0,0]=4 126 B9R0.35 CCOC(=N)C(=O)OCC E32050 [0,2,0,0,0,0|1,0,1]=4 127 B9R0.53 CC(C)OC(=O)OC(C)C D38665 [0,2,0,0,0,0|1,0,1]=4 128 B9R0.53 CC(C)OC(=O)O[C@H](C)Cl C39199 [0,2,0,0,0,0|1,0,1]=4 129 B9R0.53 CC(Cl)OC(=O)OC(C)Cl B41230 [0,2,0,0,0,0|1,0,1]=4 130 B9R0.15 C=C(Cl)C(OCC)OCC C3696 [0,2,0,0,0,0|0,0,1]=3 131 B9R0.15 CCOC(OCC)C(Br)Br D3669 [0,2,0,0,0,0|0,0,0]=2 132 B9R0.15 CCOC(OCC)[C@H](C)Br B5672 [0,2,0,0,0,0|0,0,0]=2 133 B9R0.17 CCOC(CCN)OCC A43954 [0,2,0,0,0,0|0,0,0]=2 134 B9R0.17 CCOC(CCO)OCC D43950 [0,2,0,0,0,0|0,0,0]=2 135 B9R0.59 C#CP(=O)(OCC)OCC D2479 [0,2,0,0,0,0|1,0,1]=4 136 B9R0.59 C=CP(=O)(OCC)OCC D41599 [0,2,0,0,0,0|1,0,1]=4 137 B9R0.59 CCOP(=O)(CCl)OCC D61931 [0,2,0,0,0,0|1,0,0]=3 138 B9R0.59 CCOP(=O)(CI)OCC D62231 [0,2,0,0,0,0|1,0,0]=3 139 B9R0.59 CCOP(=O)(CO)OCC D39167 [0,2,0,0,0,0|1,0,0]=3 140 B7R1.1 BrCC1CCCC1 B23399 [1,0,0,1,0,0|2,0,0]=4 141 B7R1.1 BrC[C@H]1CCCO1 B17294 [1,0,0,1,0,0|1,0,0]=3 142 B7R1.1 CC[C@@H]1CCNC1 E22541 [1,0,0,1,0,0|2,0,0]=4 143 B7R1.1 CC[C@H]1CCNC1 E22542 [1,0,0,1,0,0|2,0,0]=4 144 B7R1.1 COC1=NCCC1 M69559 [1,0,0,1,0,0|1,0,1]=4 145 B7R1.1 CO[C@@H]1CCNC1 M0200 [1,0,0,1,0,0|2,0,0]=4 146 B7R1.1 CO[C@@H]1CCNC1 M12251 [1,0,0,1,0,0|2,0,0]=4 147 B7R1.1 CO[C@H]1CCNC1 M1159 [1,0,0,1,0,0|2,0,0]=4 148 B7R1.1 CO[C@H]1CCNC1 M7459 [1,0,0,1,0,0|2,0,0]=4 149 B7R1.1 FC[C@@H]1CCCN1 F1127 [1,0,0,1,0,0|2,0,0]=4 150 B7R1.1 FC[C@H]1CCCN1 F12954 [1,0,0,1,0,0|2,0,0]=4 151 B7R1.1 NCC1CCCC1 C5395 [1,0,0,1,0,0|2,0,0]=4 152 B7R1.1 NC[C@@H]1CCCN1 A7822 [1,0,0,1,0,0|2,0,0]=4 153 B7R1.1 NC[C@@H]1CCCO1 T25038 [1,0,0,1,0,0|1,0,0]=3 154 B7R1.1 NC[C@H]1CCCN1 A60830 [1,0,0,1,0,0|2,0,0]=4 155 B7R1.1 OCC1CCCC1 C23297 [1,0,0,1,0,0|2,0,0]=4 156 B7R1.1 OCC1OCCO1 D40256 [1,0,0,1,0,0|2,0,0]=4 157 B7R1.1 OC[C@@H]1CCCN1 P1125 [1,0,0,1,0,0|2,0,0]=4 158 B7R1.1 OC[C@@H]1CCCN1 P1542 [1,0,0,1,0,0|2,0,0]=4 159 B7R1.1 OC[C@@H]1CCCO1 T40383 [1,0,0,1,0,0|1,0,0]=3 160 B7R1.1 OC[C@H]1CCCN1 P14128 [1,0,0,1,0,0|2,0,0]=4 161 B7R1.1 OC[C@H]1CCCN1 P67898 [1,0,0,1,0,0|2,0,0]=4 162 B7R1.1 OC[C@H]1CCCO1 T67581 [1,0,0,1,0,0|1,0,0]=3 163 B7R1.1 OC[C@H]1CCCO1 T68627 [1,0,0,1,0,0|1,0,0]=3 164 B7R1.2 C[C@@H]1CC[C@@H](C)N1 D60301 [1,0,0,1,0,0|1,0,0]=3 165 B7R1.3 BrC1CCCCC1 B69054 [1,0,0,1,0,0|2,0,0]=4 166 B7R1.3 CC1SCCCS1 M63108 [1,0,0,1,0,0|0,2,0]=4 167 B7R1.3 C[C@@H]1CCCNC1 M43474 [1,0,0,1,0,0|2,0,0]=4 168 B7R1.3 C[C@@H]1CNCCN1 M10716 [1,0,0,1,0,0|2,0,0]=4 169 B7R1.3 C[C@@H]1CNCCO1 M15403 [1,0,0,1,0,0|1,0,0]=3 170 B7R1.3 C[C@@H]1CNCCO1 M28760 [1,0,0,1,0,0|1,0,0]=3 171 B7R1.3 C[C@@H]1COCCN1 M26868 [1,0,0,1,0,0|2,0,0]=4 172 B7R1.3 C[C@@H]1COCCN1 M9009 [1,0,0,1,0,0|2,0,0]=4 173 B7R1.3 C[C@H]1CCCCN1 M43475 [1,0,0,1,0,0|1,0,0]=3 174 B7R1.3 C[C@H]1CNCCN1 M10717 [1,0,0,1,0,0|2,0,0]=4 175 B7R1.3 C[C@H]1CNCCO1 M15401 [1,0,0,1,0,0|1,0,0]=3 176 B7R1.3 C[C@H]1CNCCO1 M15402 [1,0,0,1,0,0|1,0,0]=3 177 B7R1.3 C[C@H]1CNCCO1 M29509 [1,0,0,1,0,0|1,0,0]=3 178 B7R1.3 C[C@H]1CNCCO1 M41323 [1,0,0,1,0,0|1,0,0]=3 179 B7R1.3 C[C@H]1COCCN1 M23631 [1,0,0,1,0,0|2,0,0]=4 180 B7R1.3 C[C@H]1COCCN1 M41324 [1,0,0,1,0,0|2,0,0]=4 181 B7R1.3 C[C@H]1COCCN1 M8924 [1,0,0,1,0,0|2,0,0]=4 182 B7R1.3 NC1CCCCC1 C39283 [1,0,0,1,0,0|2,0,0]=4 183 B7R1.3 O[C@@H]1CNCCO1 M40347 [1,0,0,1,0,0|2,0,0]=4 184 B7R1.3 [Mg+]C1CCCCC1 C31701 [1,0,0,1,0,0|2,0,0]=4 185 B7R1.4 C[C@@H]1OCCC1=O M41223 [1,0,0,1,0,0|1,0,1]=4 186 B7R1.4 C[C@H]1CCOC1=O M41224 [1,0,0,1,0,0|1,0,1]=4 187 B7R1.6 CCNC1COC1 E8452 [1,0,0,1,0,0|2,0,0]=4 188 B7R1.6 CCOC1CNC1 E41322 [1,0,0,1,0,0|1,0,0]=3 189 B7R1.6 NCCC1CCC1 C15341 [1,0,0,1,0,0|2,0,0]=4 190 B7R1.6 OCC[C@H]1CCO1 X59677 [1,0,0,1,0,0|2,0,0]=4 191 B7R1.10 COC1CC(N)C1 M0320 [1,0,0,1,0,0|2,0,0]=4 192 B7R1.10 CO[C@H]1C[C@@H](N)C1 SB7404 [1,0,0,1,0,0|2,0,0]=4 193 B7R1.10 CO[C@H]1C[C@H](N)C1 SB7405 [1,0,0,1,0,0|2,0,0]=4 194 B7R1.21 CC1(CCO)CC1 M22121 [1,0,0,1,0,0|2,0,0]=4 195 B7R1.22 CC[C@H](O)C1CC1 C29750 [1,0,0,1,0,0|2,0,0]=4 196 B7R1.25 CC1(CN)CCC1 M1145 [1,0,0,1,0,0|2,0,0]=4 197 B7R1.25 CC1(CN)CCC1 M14421 [1,0,0,1,0,0|2,0,0]=4 198 B7R1.25 COC1(C)CNC1 M0268 [1,0,0,1,0,0|2,0,0]=4 199 B7R1.27 CC[C@]1(C)ON1C E65451 [1,0,0,1,0,0|1,0,0]=3 200 B7R1.24 C1CCCNCC1 H64495 [1,0,0,1,0,0|2,0,0]=4 201 B7R1.24 C1CNCCOC1 X1345 [1,0,0,1,0,0|2,0,0]=4 202 B9R1.2 CC1CCCC(CO)N1 M13497 [0,1,0,1,0,0|2,0,0]=4 203 B9R1.2 CN1CCO[C@@H](CN)C1 M38222 [0,1,0,1,0,0|2,0,0]=4 204 B9R1.2 CN1CCO[C@@H](CO)C1 M62084 [0,1,0,1,0,0|2,0,0]=4 205 B9R1.2 CN1CCO[C@@H](CO)C1 M62085 [0,1,0,1,0,0|2,0,0]=4 206 B9R1.2 CN1CCO[C@H](CO)C1 M62083 [0,1,0,1,0,0|2,0,0]=4 207 B9R1.2 CO[C@@H]1CCN[C@H](C)C1 M60297 [0,1,0,1,0,0|2,0,0]=4 208 B9R1.7 CCN[C@H]1CCN(C)C1 E11171 [0,1,0,1,0,0|2,0,0]=4 209 B9R1.8 BrCCC1OCCCO1 B41524 [0,1,0,1,0,0|2,0,0]=4 210 B9R1.8 CCCC1CCNCC1 P49579 [0,1,0,1,0,0|2,0,0]=4 211 B9R1.8 CCC[C@H]1CCCCN1 P49580 [0,1,0,1,0,0|2,0,0]=4 212 B9R1.8 CCNC1CCOCC1 E43915 [0,1,0,1,0,0|2,0,0]=4 213 B9R1.8 CNC[C@H]1CCCOC1 M13661 [0,1,0,1,0,0|2,0,0]=4 214 B9R1.8 COC[C@@H]1CNCCO1 M43500 [0,1,0,1,0,0|2,0,0]=4 215 B9R1.8 COC[C@H]1CNCCO1 M41585 [0,1,0,1,0,0|2,0,0]=4 216 B9R1.8 COC[C@H]1CNCCO1 M43493 [0,1,0,1,0,0|2,0,0]=4 217 B9R1.8 COC[C@H]1CNCCO1 M43498 [0,1,0,1,0,0|2,0,0]=4 218 B9R1.8 [Mg+]CCC1OCCCO1 D31711 [0,1,0,1,0,0|2,0,0]=4 219 B9R1.12 COCC[C@H]1CCCN1 M9079 [0,1,0,1,0,0|2,0,0]=4 220 B9R1.12 ClCCCC1OCCO1 C69086 [0,1,0,1,0,0|2,0,0]=4 221 B9R1.15 C[C@H]1OCCN[C@@H]1CO M43503 [0,1,0,1,0,0|2,0,0]=4 222 B9R1.134 CC1(CCN)OCCO1 M5779 [0,1,0,1,0,0|2,0,0]=4 223 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)O1 D19918 [0,1,0,1,0,0|1,0,1]=4 224 B9R1.66 CC1(C)C[C@@H](N)CCO1 D22688 [0,1,0,1,0,0|2,0,0]=4 225 B9R1.14 CCN1CCC[C@@H]1CN A15583 [0,1,0,1,0,0|2,0,0]=4 226 B9R1.14 CCN1CCC[C@@H]1CN A15585 [0,1,0,1,0,0|2,0,0]=4 227 B9R1.14 CCN1CCC[C@H]1CN A15584 [0,1,0,1,0,0|2,0,0]=4 228 B9R1.89 NCC1CCCCCC1 C49582 [0,1,0,1,0,0|2,0,0]=4 229 B9R1.89 OC[C@@H]1CCCCCN1 A64396 [0,1,0,1,0,0|2,0,0]=4 230 B9R1.148 CC1(C)OCC=CCO1 D43808 [0,1,0,1,0,0|0,0,2]=4 231 B9R2.68 C1CC2CCC(C1)N2 A1635 [0,0,0,2,0,0|2,0,0]=4 232 B9R2.68 C1CC2CCC(C1)N2 A29908 [0,0,0,2,0,0|2,0,0]=4 233 B9R2.68 C1CC2CNCC1O2 X14974 [0,0,0,2,0,0|2,0,0]=4 234 B9R2.68 C1CC2CNCC1O2 X6234 [0,0,0,2,0,0|2,0,0]=4 235 B9R2.3 C1CC2CNCC2O1 H15277 [0,0,0,2,0,0|2,0,0]=4 236 B9R2.173 C1CC2(CCO2)CN1 X12068 [0,0,0,2,0,0|2,0,0]=4 237 B9R2.173 C1CCC2(C1)CCN2 A14687 [0,0,0,2,0,0|2,0,0]=4 238 B9R2.173 C1CNC2(C1)CCC2 A15582 [0,0,0,2,0,0|2,0,0]=4 239 B9R2.173 C1CNC2(C1)CCC2 A7184 [0,0,0,2,0,0|2,0,0]=4 240 B9R2.173 C1COC2(C1)CNC2 X7225 [0,0,0,2,0,0|2,0,0]=4 241 B9R2.173 C1C[C@@]2(CCO2)CN1 O5948 [0,0,0,2,0,0|2,0,0]=4 242 B9R2.173 C1C[C@@]2(CCO2)CN1 X8445 [0,0,0,2,0,0|2,0,0]=4