0 B6R0.1 CCNC(=O)OC DB03919 [0,0,0,0,0,0|2,0,0]=2 1 B6R0.1 CCOC(=O)NC DB02856 [0,0,0,0,0,0|3,0,0]=3 2 B5R0.1 CC(=O)CCO DB04094 [1,0,0,0,0,0|2,0,0]=3 3 B5R0.1 CCCC(=O)O DB03568 [1,0,0,0,0,0|1,0,0]=2 4 B5R0.1 CCCC(N)=O DB02121 [1,0,0,0,0,0|2,0,0]=3 5 B5R0.1 CCOC(N)=O DB04827 [1,0,0,0,0,0|3,0,0]=4 6 B5R0.1 CNCC(=O)O DB12519 [1,0,0,0,0,0|1,0,0]=2 7 B5R0.1 CSCC(=O)[O-] DB03517 [1,0,0,0,0,0|0,0,1]=2 8 B5R0.1 CSC[S@](C)=O DB02311 [1,0,0,0,0,0|1,0,0]=2 9 B5R0.1 C[Se]CC(=O)[O-] DB03098 [1,0,0,0,0,0|0,1,1]=3 10 B5R0.1 C[Te]CC(=O)[O-] DB01918 [1,0,0,0,0,0|0,1,1]=3 11 B5R0.1 C\C=C\C(=O)O DB02074 [1,0,0,0,0,0|1,0,1]=3 12 B5R0.1 NCCC(=O)O DB03107 [1,0,0,0,0,0|2,0,0]=3 13 B5R0.1 NOCC(=O)O DB02079 [1,0,0,0,0,0|1,1,0]=3 14 B5R0.1 O=C(O)CCO DB03688 [1,0,0,0,0,0|2,0,0]=3 15 B5R0.2 COCCOC DB01749 [1,0,0,0,0,0|0,1,1]=3 16 B5R0.3 O=C(CO)CO DB01775 [1,0,0,0,0,0|2,1,0]=4 17 B7R0.5 CCOC(=O)C(C)=O DB05869 [0,1,0,0,0,0|3,0,0]=4 18 B7R0.7 CCO[PH](=O)OCC DB02811 [0,1,0,0,0,0|3,0,0]=4 19 B7R1.3 O=C1CCCCC1 DB02060 [0,0,0,1,0,0|2,0,0]=3 20 B7R1.4 CN1CCCC1=O DB12521 [0,0,0,1,0,0|2,0,0]=3 21 B4R0.1 C=CC(=O)O DB02579 [2,0,0,0,0,0|0,0,2]=4 22 B4R0.1 CC(=O)C=O DB03587 [2,0,0,0,0,0|0,1,1]=4 23 B4R0.1 CC(=O)NO DB00551 [2,0,0,0,0,0|1,1,0]=4 24 B4R0.1 CC(=O)O[Hg+] DB02176 [2,0,0,0,0,0|1,0,0]=3 25 B4R0.1 CCC(=O)O DB03766 [2,0,0,0,0,0|0,0,0]=2 26 B4R0.1 CCC(N)=O DB04161 [2,0,0,0,0,0|1,0,0]=3 27 B4R0.1 CC[C@@H](C)O DB02606 [2,0,0,0,0,0|0,0,2]=4 28 B4R0.1 NCC(=O)O DB00145 [2,0,0,0,0,0|1,0,0]=3 29 B4R0.1 NCC(=O)[O-] DB11189 [2,0,0,0,0,0|1,0,1]=4 30 B4R0.1 NCC(=O)[O-] DB11200 [2,0,0,0,0,0|1,0,1]=4 31 B4R0.1 NCC(=O)[O-] DB11210 [2,0,0,0,0,0|1,0,1]=4 32 B4R0.1 NCC(N)=O DB03636 [2,0,0,0,0,0|2,0,0]=4 33 B4R0.1 O=C(O)CBr DB02198 [2,0,0,0,0,0|1,0,0]=3 34 B4R0.1 O=C(O)CO DB03085 [2,0,0,0,0,0|0,1,0]=3 35 B4R0.1 O=CC(=O)O DB04343 [2,0,0,0,0,0|0,1,1]=4 36 B4R0.2 CCCCO DB02145 [2,0,0,0,0,0|1,0,1]=4 37 B4R0.2 COCCO DB02806 [2,0,0,0,0,0|0,1,1]=4 38 B4R0.2 C\C=C\C=O DB04381 [2,0,0,0,0,0|1,0,1]=4 39 B4R0.2 O=CCC=O DB03057 [2,0,0,0,0,0|2,0,0]=4 40 B6R0.2 CC(=O)CC(=O)O DB01762 [1,1,0,0,0,0|1,0,0]=3 41 B6R0.2 CC(C)CC(=O)O DB03750 [1,1,0,0,0,0|1,0,0]=3 42 B6R0.2 CN(C)CC(=O)O DB02083 [1,1,0,0,0,0|1,0,0]=3 43 B6R0.2 NC(=O)CC(=O)O DB02649 [1,1,0,0,0,0|2,0,0]=4 44 B6R0.2 O=C(O)CC(=O)O DB02175 [1,1,0,0,0,0|2,0,0]=4 45 B6R0.3 C#C[C@H](N)C(=O)O DB04217 [1,1,0,0,0,0|1,0,1]=4 46 B6R0.3 C=C(NC)C(=O)O DB03920 [1,1,0,0,0,0|1,0,1]=4 47 B6R0.3 C=C[C@H](N)C(=O)O DB03214 [1,1,0,0,0,0|1,0,1]=4 48 B6R0.3 CCC(=O)C(=O)O DB04553 [1,1,0,0,0,0|1,0,1]=4 49 B6R0.3 CC[C@@H](C)C(=O)O DB03741 [1,1,0,0,0,0|1,0,0]=3 50 B6R0.3 CC[C@@H](N)C(=O)O DB04454 [1,1,0,0,0,0|1,0,0]=3 51 B6R0.3 C\C=C(/N)C(=O)O DB03720 [1,1,0,0,0,0|1,0,1]=4 52 B6R0.3 N[C@@H](CO)C(=O)O DB00133 [1,1,0,0,0,0|2,0,0]=4 53 B6R0.3 N[C@@H](CS)C(=O)O DB00151 [1,1,0,0,0,0|2,0,0]=4 54 B6R0.3 N[C@@H](C[NH3+])C(=O)O DB03320 [1,1,0,0,0,0|2,0,0]=4 55 B6R0.3 N[C@@H](C[SeH])C(=O)O DB02345 [1,1,0,0,0,0|2,0,0]=4 56 B6R0.3 N[C@H](CO)C(=O)O DB03929 [1,1,0,0,0,0|2,0,0]=4 57 B6R0.3 N[C@H](CS)C(=O)O DB03201 [1,1,0,0,0,0|2,0,0]=4 58 B6R0.3 [C@H](N)(CS)C(=O)O DB11197 [1,1,0,0,0,0|2,0,0]=4 59 B6R0.4 CCCCC(=O)O DB02406 [1,1,0,0,0,0|1,0,0]=3 60 B6R0.4 CCCOC(C)=O DB01670 [1,1,0,0,0,0|1,0,0]=3 61 B6R0.4 NCCCC(=O)O DB02530 [1,1,0,0,0,0|1,0,0]=3 62 B6R0.4 O=C([O-])CCCO DB01440 [1,1,0,0,0,0|1,0,1]=4 63 B6R0.4 O=C([O-])CCCO DB09072 [1,1,0,0,0,0|1,0,1]=4 64 B8R0.8 CSCCC(=O)C(=O)O DB02238 [0,2,0,0,0,0|2,0,0]=4 65 B6R1.2 O=C1CCCO1 DB04699 [1,0,0,1,0,0|1,0,0]=3 66 B6R1.1 C1CCOCC1 DB02412 [1,0,0,1,0,0|1,0,1]=4 67 B6R1.1 C1COCCO1 DB03316 [1,0,0,1,0,0|0,1,1]=4 68 B8R1.4 C[C@H]1CC=CC(=O)O1 DB14121 [0,1,0,1,0,0|1,0,1]=4