0 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 M14093 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.509 [*][N+](C)(C)CC1=CC=CC=C1 M15995 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.18 CC(=O)NC1=CC=CC=C1 M19489 [1,0,0,0,0,0|1,0,2]=4 3 B10R1.18 CC(=O)OC1=CC=CC=C1 M10882 [1,0,0,0,0,0|1,0,2]=4 4 B10R1.18 CC(=S)Nc1ccccc1 M27241 [1,0,0,0,0,0|1,1,1]=4 5 B10R1.18 O=C(O)CC1=CN=CC=C1 M15439 [1,0,0,0,0,0|2,0,1]=4 6 B10R1.18 O=C(O)Cc1ccccc1 M19689 [1,0,0,0,0,0|1,0,1]=3 7 B9R1.8 CCOC1=CC=CC=C1 M23245 [2,0,0,0,0,0|1,0,0]=3 8 B9R1.8 CNCc1ccccc1 M21326 [2,0,0,0,0,0|1,0,0]=3 9 B9R1.8 NCCc1ccccc1 M18943 [2,0,0,0,0,0|1,0,0]=3 10 B9R1.8 NCCc1ccccc1 M20880 [2,0,0,0,0,0|1,0,0]=3 11 B9R1.8 NCCc1ccccn1 M24275 [2,0,0,0,0,0|2,0,0]=4 12 B9R1.8 O=CCC1=CC=CC=C1 M17893 [2,0,0,0,0,0|0,0,2]=4 13 B9R1.8 OCCC1=CC=CC=C1 M15237 [2,0,0,0,0,0|0,0,0]=2 14 B9R1.8 OCCC1=CC=CC=N1 M10186 [2,0,0,0,0,0|1,0,0]=3 15 B9R1.8 O\N=C\c1ccccc1 M27255 [2,0,0,0,0,0|1,0,1]=4 16 B11R1.20 O=C(O)Cc1ccc(O)cc1 M18084 [1,1,0,0,0,0|1,0,1]=4 17 B11R1.20 [C@H](C)(N)Cc1ccc(O)cc1 M22223 [1,1,0,0,0,0|1,0,0]=3 18 B11R1.36 NC(C(=O)O)c1ccccc1 M26535 [1,1,0,0,0,0|1,0,1]=4 19 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 M18892 [1,1,0,0,0,0|1,0,1]=4 20 B11R1.36 O=C(O)C(O)c1ccccc1 M19671 [1,1,0,0,0,0|1,0,1]=4 21 B11R1.86 O=C(O)Cc1ccccc1O M20039 [1,1,0,0,0,0|1,0,1]=4 22 B11R1.157 CC(N)Cc1cccc(O)c1 M28405 [1,1,0,0,0,0|1,0,0]=3 23 B11R1.157 O=C(O)Cc1cccc(O)c1 M19649 [1,1,0,0,0,0|1,0,1]=4 24 B13R1.353 CC(C)(C)\[N+]([O-])=C\c1ccccc1 M27667 [0,1,0,0,0,1|1,0,1]=4 25 B13R1.512 C[N+](C)(C)CCC1=CC=C(O)C=C1 M29452 [0,1,0,0,0,1|2,0,0]=4 26 B13R1.275 CC[N+](C)(C)CC1=CC=CC=C1Br M20751 [0,2,0,0,0,0|2,0,0]=4 27 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 M13104 [1,0,0,1,0,0|1,0,0]=3 28 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 M21134 [1,0,0,1,0,0|1,0,0]=3 29 B13R2.103 CC1(CN)Cc2ccccc2C1 M28428 [0,1,0,1,0,0|1,0,0]=3 30 B9R1.6 CC(=O)c1ccccc1 M20888 [1,0,0,0,1,0|0,0,2]=4 31 B9R1.6 C[C@H](O)c1ccccc1 M19564 [1,0,0,0,1,0|0,0,0]=2 32 B9R1.6 O=C(O)C1=CC=CC=C1 M15503 [1,0,0,0,1,0|1,0,1]=4 33 B9R1.6 O=[PH](O)c1ccccc1 M27267 [1,0,0,0,1,0|2,0,0]=4 34 B9R1.6 OB(O)c1ccccc1 M27962 [1,0,0,0,1,0|2,0,0]=4 35 B11R1.91 CC(=O)CCC1=CC=CC=C1 M18315 [1,0,0,0,0,1|0,0,2]=4 36 B11R1.91 CC(=O)COc1ccccc1 M27826 [1,0,0,0,0,1|0,0,2]=4 37 B11R1.91 CC(=O)NCc1ccccc1 M22662 [1,0,0,0,0,1|0,0,2]=4 38 B11R1.91 CC(=O)OCc1ccccc1 M20248 [1,0,0,0,0,1|0,0,2]=4 39 B11R1.91 O=C(O)CCc1ccccc1 M18665 [1,0,0,0,0,1|1,0,1]=4