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|1,0,0]=1 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|2,0,0]=3 4 B5R0.1 CCCC(N)=O DB02121 [1,0,0,0,0,0|2,0,0]=3 5 B5R0.1 CCSC(=N)N DB02234 [1,0,0,0,0,0|2,1,0]=4 6 B5R0.1 CC[Se]C(=N)N DB02589 [1,0,0,0,0,0|2,1,0]=4 7 B5R0.1 CSCC(=O)[O-] DB03517 [1,0,0,0,0,0|3,0,0]=4 8 B5R0.1 CSC[S@](C)=O DB02311 [1,0,0,0,0,0|3,0,0]=4 9 B5R0.1 C[Se]CC(=O)[O-] DB03098 [1,0,0,0,0,0|3,0,0]=4 10 B5R0.1 C[Te]CC(=O)[O-] DB01918 [1,0,0,0,0,0|3,0,0]=4 11 B5R0.1 C\C=C\C(=O)O DB02074 [1,0,0,0,0,0|2,0,1]=4 12 B5R0.1 NCCC(=O)O DB03107 [1,0,0,0,0,0|3,0,0]=4 13 B5R0.1 O=C(O)CCO DB03688 [1,0,0,0,0,0|3,0,0]=4 14 B5R0.2 CCCCCN DB02045 [1,0,0,0,0,0|2,0,1]=4 15 B5R0.2 CCOCCO DB02249 [1,0,0,0,0,0|1,0,1]=3 16 B5R0.3 O=C(CO)CO DB01775 [1,0,0,0,0,0|2,0,0]=3 17 B7R0.7 CCO[PH](=O)OCC DB02811 [0,1,0,0,0,0|1,0,0]=2 18 B7R1.3 O=C1CCCCC1 DB02060 [0,0,0,1,0,0|1,0,0]=2 19 B7R1.3 OC1CCCCC1 DB03703 [0,0,0,1,0,0|1,0,2]=4 20 B7R1.3 [NH3+]C1CCCCC1 DB02995 [0,0,0,1,0,0|2,0,1]=4 21 B7R1.4 N[C@@H]1CCOC1=O DB02624 [0,0,0,1,0,0|1,0,0]=2 22 B4R0.1 C=CC(=O)O DB02579 [2,0,0,0,0,0|0,0,2]=4 23 B4R0.1 CC(=O)C=O DB03587 [2,0,0,0,0,0|1,0,1]=4 24 B4R0.1 CC(=O)O[Hg+] DB02176 [2,0,0,0,0,0|1,0,0]=3 25 B4R0.1 CCC(N)=O DB04161 [2,0,0,0,0,0|1,0,0]=3 26 B4R0.1 CC[C@@H](C)O DB02606 [2,0,0,0,0,0|0,0,2]=4 27 B4R0.1 NCC(N)=O DB03636 [2,0,0,0,0,0|2,0,0]=4 28 B4R0.1 O=C(O)CBr DB02198 [2,0,0,0,0,0|1,0,0]=3 29 B4R0.1 O=CC(=O)O DB04343 [2,0,0,0,0,0|1,0,1]=4 30 B4R0.2 CCCCN DB03659 [2,0,0,0,0,0|1,0,1]=4 31 B4R0.2 CCCCO DB02145 [2,0,0,0,0,0|1,0,1]=4 32 B4R0.2 COCCO DB02806 [2,0,0,0,0,0|1,0,1]=4 33 B4R0.2 C\C=C\C=O DB04381 [2,0,0,0,0,0|1,0,1]=4 34 B6R0.2 CC(C)CC(=O)O DB03750 [1,1,0,0,0,0|2,0,0]=4 35 B6R0.3 CCC(=O)C(=O)O DB04553 [1,1,0,0,0,0|2,0,0]=4 36 B6R0.3 CC[C@@H](C)C(=O)O DB03741 [1,1,0,0,0,0|2,0,0]=4 37 B6R0.3 CC[C@@H](N)C(=O)O DB04454 [1,1,0,0,0,0|2,0,0]=4 38 B6R0.4 CCCCC(=O)O DB02406 [1,1,0,0,0,0|2,0,0]=4 39 B6R0.4 CCCOC(C)=O DB01670 [1,1,0,0,0,0|0,0,0]=2 40 B6R0.5 CCOP(=O)(O)O DB03822 [1,1,0,0,0,0|2,0,0]=4 41 B8R0.30 CCOP(O)(=S)OCC DB07674 [0,2,0,0,0,0|1,0,1]=4 42 B6R1.2 O=C1CCCO1 DB04699 [1,0,0,1,0,0|0,0,0]=2 43 B6R1.1 C1CCOCC1 DB02412 [1,0,0,1,0,0|0,0,1]=3 44 B6R1.1 C1COCCO1 DB03316 [1,0,0,1,0,0|1,0,1]=4 45 B8R1.4 C[C@H]1CC=CC(=O)O1 DB14121 [0,1,0,1,0,0|0,0,1]=3 46 B8R1.2 O=CN1CCCCC1 DB04113 [0,1,0,1,0,0|2,0,0]=4