0 B4R0.3 CP(C)(=O)Cl AT21855 [0,0,0,0,0,0|1,1,1]=3 1 B4R0.3 CP(C)(=S)Cl T71511 [0,0,0,0,0,0|1,2,0]=3 2 B4R0.3 CS(=O)(=O)[O-] A51091 [0,0,0,0,0,0|3,0,0]=3 3 B4R0.3 C[Ge](C)(C)Cl T71831 [0,0,0,0,0,0|2,0,0]=2 4 B4R0.3 C[N+](C)(C)C F15162 [0,0,0,0,0,0|1,0,0]=1 5 B4R0.3 C[P+](C)(C)C A12534 [0,0,0,0,0,0|1,1,0]=2 6 B4R0.3 C[Si](O)(O)O F20752 [0,0,0,0,0,0|3,0,1]=4 7 B4R0.3 O=S(=O)([O-])[O-] D98233 [0,0,0,0,0,0|4,0,0]=4 8 B4R0.3 O=[Re](=O)(=O)[O-] T71552 [0,0,0,0,0,0|4,0,0]=4 9 B4R0.3 [2H]C(C)(C)Br D99067 [0,0,0,0,0,0|3,0,0]=3 10 B4R0.3 [2H]C(C)(C)Cl D98394 [0,0,0,0,0,0|3,0,0]=3 11 B4R0.3 [2H]C(C)(C)I D98839 [0,0,0,0,0,0|3,0,0]=3 12 B4R0.3 [2H]C([2H])(C)Br D99303 [0,0,0,0,0,0|4,0,0]=4 13 B4R0.3 [2H]C([2H])(C)Cl D98462 [0,0,0,0,0,0|4,0,0]=4 14 B4R0.3 [2H]C([2H])(C)I D99166 [0,0,0,0,0,0|4,0,0]=4 15 B4R0.3 [2H]C([2H])(C)O D97863 [0,0,0,0,0,0|3,0,1]=4 16 B4R0.3 [2H][N+]([2H])([2H])[2H] D98072 [0,0,0,0,0,0|4,0,0]=4 17 B4R0.3 [2H][N+]([2H])([2H])[2H] D98351 [0,0,0,0,0,0|4,0,0]=4 18 B3R0.2 CC(=N)N T70291 [1,0,0,0,0,0|3,0,0]=4 19 B3R0.2 CC(=O)O 41449 [1,0,0,0,0,0|2,0,1]=4 20 B3R0.2 CC(=O)[O-] D76174 [1,0,0,0,0,0|2,0,0]=3 21 B3R0.2 CC(=O)[O-] F20820 [1,0,0,0,0,0|2,0,0]=3 22 B3R0.2 CC(=O)[O-] T72577 [1,0,0,0,0,0|2,0,0]=3 23 B3R0.2 CC(C)N T72805 [1,0,0,0,0,0|2,0,0]=3 24 B3R0.2 CC([15NH2])=O 41452 [1,0,0,0,0,0|2,0,1]=4 25 B3R0.2 C[13C](=O)[O-] D99050 [1,0,0,0,0,0|2,0,0]=3 26 B3R0.2 C[S@@](N)=O A10759 [1,0,0,0,0,0|2,0,1]=4 27 B3R0.2 O=C([O-])[O-] H11985 [1,0,0,0,0,0|3,0,0]=4 28 B3R0.2 O=[15N+]([O-])[O-] 41462 [1,0,0,0,0,0|2,0,1]=4 29 B3R0.2 O=[15N+]([O-])[O-] 41468 [1,0,0,0,0,0|2,0,1]=4 30 B3R0.2 [2H]C(=O)[O-] D97993 [1,0,0,0,0,0|3,0,0]=4 31 B3R0.2 [2H]N(C)C D98629 [1,0,0,0,0,0|1,0,1]=3 32 B3R0.2 [2H][C@@H](C)I D98644 [1,0,0,0,0,0|3,0,0]=4 33 B5R0.4 CC(C)(C)Cl=O D90846 [0,1,0,0,0,0|1,0,1]=3 34 B5R0.4 CC(C)(N)CF AT13343 [0,1,0,0,0,0|2,0,0]=3 35 B5R0.4 CC(C)(N)CN F16110 [0,1,0,0,0,0|2,0,0]=3 36 B5R0.4 [2H]C(C)(C)CO D98435 [0,1,0,0,0,0|2,0,0]=3 37 B5R0.4 [2H]C([2H])(C)CBr D99539 [0,1,0,0,0,0|3,0,0]=4 38 B5R0.4 [2H]C([2H])(C)CI D98693 [0,1,0,0,0,0|3,0,0]=4 39 B5R0.4 [2H]C([2H])(C)CO D98924 [0,1,0,0,0,0|3,0,0]=4 40 B5R0.4 [2H]C([2H])(C)NC D99751 [0,1,0,0,0,0|3,0,0]=4 41 B5R0.4 [2H]OC(C)(C)C D99425 [0,1,0,0,0,0|1,0,1]=3 42 B2R0.1 CCN T72544 [2,0,0,0,0,0|2,0,0]=4 43 B2R0.1 CNC 44403 [2,0,0,0,0,0|0,0,1]=3 44 B2R0.1 CON F16476 [2,0,0,0,0,0|2,0,0]=4 45 B2R0.1 O=[15N][O-] 41396 [2,0,0,0,0,0|1,0,1]=4 46 B4R0.1 C=C=C(C)C T72680 [1,1,0,0,0,0|1,0,1]=4 47 B4R0.1 CC(=O)CN D87844 [1,1,0,0,0,0|1,0,1]=4 48 B4R0.1 CC(C)CN T72053 [1,1,0,0,0,0|1,0,0]=3 49 B4R0.1 CC[C@H](C)N 90231 [1,1,0,0,0,0|2,0,0]=4 50 B4R0.1 CC[C@H](C)N N12286 [1,1,0,0,0,0|2,0,0]=4 51 B4R0.1 CC[C@H](C)N N12342 [1,1,0,0,0,0|2,0,0]=4 52 B4R0.1 C[C@H](S)CO AC8877 [1,1,0,0,0,0|1,1,0]=4 53 B4R0.1 C[C@H](S)CS T72965 [1,1,0,0,0,0|1,1,0]=4 54 B4R0.1 [2H]OC(C)C D98571 [1,1,0,0,0,0|1,0,1]=4 55 B6R0.5 C=CCC(C)(C)N 68260 [0,2,0,0,0,0|2,0,0]=4 56 B6R0.5 CC(C)(C)C#CI AT14291 [0,2,0,0,0,0|2,0,0]=4 57 B6R0.5 CC(C)(C)CON AT14507 [0,2,0,0,0,0|1,0,1]=4 58 B6R0.5 CC(C)(I)CCO AC4846 [0,2,0,0,0,0|2,0,0]=4 59 B6R0.5 CCCC(C)(C)C D87693 [0,2,0,0,0,0|2,0,0]=4 60 B6R0.5 CNCC(C)(C)F F53133 [0,2,0,0,0,0|2,0,0]=4 61 B6R0.5 C[N+](C)(C)CCO AC6994 [0,2,0,0,0,0|0,0,1]=3 62 B6R0.5 C[Si](C)(C)\C=C\Br 12164 [0,2,0,0,0,0|2,0,0]=4 63 B6R0.7 CC(C)(N)C(F)F AT13361 [0,2,0,0,0,0|2,0,0]=4 64 B6R0.7 C[C@H](N)C(C)(C)C F17437 [0,2,0,0,0,0|2,0,0]=4 65 B6R0.7 C[C@H](N)C(C)(C)O 86324 [0,2,0,0,0,0|1,0,1]=4 66 B6R0.7 C[C@H](N)C(C)(C)O 86840 [0,2,0,0,0,0|1,0,1]=4 67 B6R0.7 C[C@H](N)C(C)(C)O AC8680 [0,2,0,0,0,0|1,0,1]=4 68 B6R0.7 C[C@H](O)C(C)(C)N AC8763 [0,2,0,0,0,0|2,0,0]=4 69 B6R0.8 C=CC(C)(C)CO C77629 [0,2,0,0,0,0|2,0,0]=4 70 B6R0.8 CC(C)(CO)ON AT14544 [0,2,0,0,0,0|1,0,1]=4 71 B6R0.8 CCC(C)(Br)CC F20158 [0,2,0,0,0,0|2,0,0]=4 72 B6R0.8 CC[C@](C)(N)CO D75057 [0,2,0,0,0,0|2,0,0]=4 73 B6R0.8 CC[C@](C)(O)CO D78587 [0,2,0,0,0,0|1,0,1]=4 74 B6R0.8 CNC(C)(C)C#N F13452 [0,2,0,0,0,0|2,0,0]=4 75 B6R0.8 COC(C)(C)C#N AT24380 [0,2,0,0,0,0|2,0,0]=4 76 B6R0.8 COC(C)(C)CN D87550 [0,2,0,0,0,0|1,0,1]=4 77 B6R0.8 COC(C)(C)CN W19681 [0,2,0,0,0,0|1,0,1]=4 78 B6R0.8 CSC(C)(C)CCl AT13953 [0,2,0,0,0,0|1,1,0]=4 79 B6R0.8 CSC(C)(C)CN AT13938 [0,2,0,0,0,0|1,1,0]=4 80 B6R0.8 CSC(C)(C)CO AT13941 [0,2,0,0,0,0|1,0,1]=4 81 B6R0.8 C[C@](O)(CN)CO AT10630 [0,2,0,0,0,0|1,0,1]=4 82 B6R1.7 CC1(C#N)CC1 94087 [0,1,0,1,0,0|2,0,0]=4 83 B6R1.7 C[C@]1(CBr)CO1 AC6229 [0,1,0,1,0,0|1,0,1]=4 84 B6R1.7 NCC1(N)CC1 91266 [0,1,0,1,0,0|2,0,0]=4 85 B6R1.9 CC1(C)C[C@@H]1N AT11452 [0,1,0,1,0,0|2,0,0]=4 86 B6R1.10 CC1(F)CNC1 D79173 [0,1,0,1,0,0|2,0,0]=4