0 B3R0.2 C=C(C)[Mg+] SC-70280 [0,0,0,0,0,0|3,0,0]=3 1 B3R0.2 CB(O)O SC-00749 [0,0,0,0,0,0|3,0,0]=3 2 B3R0.2 CC(=N)N SC-19002 [0,0,0,0,0,0|1,0,0]=1 3 B3R0.2 CC(=O)O SC-16774 [0,0,0,0,0,0|2,0,0]=2 4 B3R0.2 CC(=O)O SC-27909 [0,0,0,0,0,0|2,0,0]=2 5 B3R0.2 CC(=O)[O-] SC-03583 [0,0,0,0,0,0|2,0,1]=3 6 B3R0.2 CC(=O)[O-] SC-12688 [0,0,0,0,0,0|2,0,1]=3 7 B3R0.2 CC(=O)[O-] SC-18918 [0,0,0,0,0,0|2,0,1]=3 8 B3R0.2 CC(=O)[O-] SC-18995 [0,0,0,0,0,0|2,0,1]=3 9 B3R0.2 CC(=O)[O-] SC-26584 [0,0,0,0,0,0|2,0,1]=3 10 B3R0.2 CC(=O)[O-] SC-46842 [0,0,0,0,0,0|2,0,1]=3 11 B3R0.2 CC(=O)[O-] SC-81401 [0,0,0,0,0,0|2,0,1]=3 12 B3R0.2 CC(=O)[O-] SC-88396 [0,0,0,0,0,0|2,0,1]=3 13 B3R0.2 CC(=O)[O-] SC-93306 [0,0,0,0,0,0|2,0,1]=3 14 B3R0.2 CC(C)[O-] SC-43831 [0,0,0,0,0,0|2,0,2]=4 15 B3R0.2 CC(C)[O-] SC-94197 [0,0,0,0,0,0|2,0,2]=4 16 B3R0.2 CC(N)=O SC-18410 [0,0,0,0,0,0|1,0,1]=2 17 B3R0.2 CC(N)=S SC-17261 [0,0,0,0,0,0|1,1,0]=2 18 B3R0.2 CC([O-])=S SC-15916 [0,0,0,0,0,0|2,0,1]=3 19 B3R0.2 CN(C)C SC-46902 [0,0,0,0,0,0|4,0,0]=4 20 B3R0.2 CS(=O)[O-] SC-19511 [0,0,0,0,0,0|3,0,1]=4 21 B3R0.2 C[PH](C)=O SC-72909 [0,0,0,0,0,0|3,0,1]=4 22 B3R0.2 C[S+](C)C SC-68838 [0,0,0,0,0,0|4,0,0]=4 23 B3R0.2 C[S+](C)C SC-97925 [0,0,0,0,0,0|4,0,0]=4 24 B3R0.2 FB(F)F SC-92085 [0,0,0,0,0,0|4,0,0]=4 25 B3R0.2 FC(Br)Br SC-53486 [0,0,0,0,0,0|3,0,1]=4 26 B3R0.2 IC(I)I SC-16447 [0,0,0,0,0,0|3,0,1]=4 27 B3R0.2 N=C(N)Cl SC-77353 [0,0,0,0,0,0|1,0,0]=1 28 B3R0.2 N=C(N)N SC-18582 [0,0,0,0,0,0|1,0,0]=1 29 B3R0.2 NC(=S)S SC-18554 [0,0,0,0,0,0|1,1,0]=2 30 B3R0.2 NC(N)=O SC-75453 [0,0,0,0,0,0|0,0,2]=2 31 B3R0.2 NC(N)=O SC-81784 [0,0,0,0,0,0|0,0,2]=2 32 B3R0.2 O=C(O)O SC-18529 [0,0,0,0,0,0|2,0,0]=2 33 B3R0.2 O=C([O-])O SC-80213 [0,0,0,0,0,0|2,0,0]=2 34 B3R0.2 O=C([O-])[O-] SC-97647 [0,0,0,0,0,0|2,0,1]=3 35 B3R0.2 O=P(=O)[O-] SC-79336 [0,0,0,0,0,0|3,0,1]=4 36 B3R0.2 O=S(Br)Br SC-85525 [0,0,0,0,0,0|3,0,1]=4 37 B3R0.2 O=[N+]([O-])[O-] SC-18940 [0,0,0,0,0,0|3,0,1]=4 38 B3R0.2 O=[N+]([O-])[O-] SC-47221 [0,0,0,0,0,0|3,0,1]=4 39 B3R0.2 O=[N+]([O-])[O-] SC-65376 [0,0,0,0,0,0|3,0,1]=4 40 B3R0.2 O=[N+]([O-])[O-] SC-69859 [0,0,0,0,0,0|3,0,1]=4 41 B3R0.2 O=[N+]([O-])[O-] SC-84846 [0,0,0,0,0,0|3,0,1]=4 42 B3R0.2 O=[Ti]([O-])F SC-79800 [0,0,0,0,0,0|3,0,1]=4 43 B3R0.2 O=[V](=O)[O-] SC-53201 [0,0,0,0,0,0|3,0,1]=4 44 B3R0.2 S=C(Cl)Cl SC-26745 [0,0,0,0,0,0|2,1,0]=3 45 B2R0.1 BrCBr SC-16380 [1,0,0,0,0,0|2,0,1]=4 46 B2R0.1 C#C[Mg+] SC-72854 [1,0,0,0,0,0|2,0,1]=4 47 B2R0.1 C=C[CH2-] SC-62552 [1,0,0,0,0,0|2,0,0]=3 48 B2R0.1 CC#N SC-43555 [1,0,0,0,0,0|1,0,2]=4 49 B2R0.1 CCI SC-46828 [1,0,0,0,0,0|2,0,1]=4 50 B2R0.1 CC[O-] SC-70475 [1,0,0,0,0,0|1,0,2]=4 51 B2R0.1 CC[O-] SC-94198 [1,0,0,0,0,0|1,0,2]=4 52 B2R0.1 CC[S-] SC-53819 [1,0,0,0,0,0|1,1,1]=4 53 B2R0.1 CNO SC-62256 [1,0,0,0,0,0|2,0,0]=3 54 B2R0.1 CON SC-18435 [1,0,0,0,0,0|2,0,0]=3 55 B2R0.1 ClCBr SC-06619 [1,0,0,0,0,0|2,0,1]=4 56 B2R0.1 ClCI SC-22871 [1,0,0,0,0,0|2,0,1]=4 57 B2R0.1 FCI SC-48569 [1,0,0,0,0,0|2,0,1]=4 58 B2R0.1 ICI SC-16458 [1,0,0,0,0,0|2,0,1]=4 59 B2R0.1 N#CN SC-16012 [1,0,0,0,0,0|0,0,2]=3 60 B2R0.1 N=CN SC-09552 [1,0,0,0,0,0|0,0,0]=1 61 B2R0.1 N=CN SC-21161 [1,0,0,0,0,0|0,0,0]=1 62 B2R0.1 NC=O SC-46172 [1,0,0,0,0,0|0,0,1]=2 63 B2R0.1 NC=S SC-15964 [1,0,0,0,0,0|0,1,0]=2 64 B2R0.1 O=C[O-] SC-83358 [1,0,0,0,0,0|1,0,1]=3 65 B2R0.1 O=N[O-] SC-79816 [1,0,0,0,0,0|2,0,1]=4 66 B2R0.1 O=[Ge]=O SC-19469 [1,0,0,0,0,0|1,1,1]=4 67 B2R0.1 O=[Si]=O SC-89620 [1,0,0,0,0,0|1,1,1]=4 68 B2R0.1 O=[Te]=O SC-81428 [1,0,0,0,0,0|2,0,1]=4 69 B2R0.1 [2H]O[2H] SC-19688 [1,0,0,0,0,0|3,0,0]=4 70 B2R0.1 [BH3-]C#N SC-15952 [1,0,0,0,0,0|1,0,2]=4 71 B2R0.1 [CH2-]CC SC-50030 [1,0,0,0,0,0|2,0,1]=4 72 B4R0.1 C#CC(=O)O SC-46968 [0,1,0,0,0,0|2,0,0]=3 73 B4R0.1 C#CC(C)N SC-52789 [0,1,0,0,0,0|2,0,1]=4 74 B4R0.1 C#CC(C)N SC-A2988 [0,1,0,0,0,0|2,0,1]=4 75 B4R0.1 C#CC(C)O SC-26644 [0,1,0,0,0,0|2,0,1]=4 76 B4R0.1 C=C(Br)CBr SC-46621 [0,1,0,0,0,0|3,0,0]=4 77 B4R0.1 C=C(C)C=O SC-83411 [0,1,0,0,0,0|2,0,1]=4 78 B4R0.1 C=C(C)CBr SC-50158 [0,1,0,0,0,0|3,0,0]=4 79 B4R0.1 C=C(C)CF SC-89300 [0,1,0,0,0,0|3,0,0]=4 80 B4R0.1 C=C(C)CN SC-43404 [0,1,0,0,0,0|2,0,0]=3 81 B4R0.1 C=C(C)CN SC-84159 [0,1,0,0,0,0|2,0,0]=3 82 B4R0.1 C=CC(=O)[O-] SC-19971 [0,1,0,0,0,0|2,0,1]=4 83 B4R0.1 C=CC(C)O SC-43661 [0,1,0,0,0,0|2,0,1]=4 84 B4R0.1 C=C[C@H](C)N SC-67439 [0,1,0,0,0,0|2,0,1]=4 85 B4R0.1 CC(=O)C#N SC-51001 [0,1,0,0,0,0|1,0,2]=4 86 B4R0.1 CC(=O)C=O SC-74380 [0,1,0,0,0,0|2,0,1]=4 87 B4R0.1 CC(=O)CBr SC-20936 [0,1,0,0,0,0|2,0,1]=4 88 B4R0.1 CC(=O)CN SC-28532 [0,1,0,0,0,0|1,0,1]=3 89 B4R0.1 CC(=O)CN SC-89750 [0,1,0,0,0,0|1,0,1]=3 90 B4R0.1 CC(=O)NO SC-18498 [0,1,0,0,0,0|1,0,1]=3 91 B4R0.1 CC(Br)CO SC-A3571 [0,1,0,0,0,0|2,0,1]=4 92 B4R0.1 CC(C)=CBr SC-52196 [0,1,0,0,0,0|3,0,0]=4 93 B4R0.1 CC(C)=NN SC-92874 [0,1,0,0,0,0|2,0,0]=3 94 B4R0.1 CC(C)=NO SC-25907 [0,1,0,0,0,0|2,0,0]=3 95 B4R0.1 CC(C)NN SC-21077 [0,1,0,0,0,0|2,0,1]=4 96 B4R0.1 CC(C)NN SC-73657 [0,1,0,0,0,0|2,0,1]=4 97 B4R0.1 CC(C)NO SC-A3794 [0,1,0,0,0,0|2,0,1]=4 98 B4R0.1 CC(C)ON SC-87607 [0,1,0,0,0,0|2,0,1]=4 99 B4R0.1 CC(N)C#N SC-92053 [0,1,0,0,0,0|1,0,2]=4 100 B4R0.1 CC(N)CO SC-18397 [0,1,0,0,0,0|1,0,1]=3 101 B4R0.1 CCB(O)O SC-04516 [0,1,0,0,0,0|3,0,0]=4 102 B4R0.1 CCC(=N)N SC-53846 [0,1,0,0,0,0|1,0,0]=2 103 B4R0.1 CCC(=O)O SC-22887 [0,1,0,0,0,0|2,0,0]=3 104 B4R0.1 CCC(=O)[O-] SC-47286 [0,1,0,0,0,0|2,0,1]=4 105 B4R0.1 CCC(C)O SC-01234 [0,1,0,0,0,0|2,0,1]=4 106 B4R0.1 CCC(N)=O SC-18213 [0,1,0,0,0,0|1,0,1]=3 107 B4R0.1 CC[C@H](C)N SC-81828 [0,1,0,0,0,0|2,0,1]=4 108 B4R0.1 CC[C@H](C)O SC-04418 [0,1,0,0,0,0|2,0,1]=4 109 B4R0.1 CNC(=N)N SC-18775 [0,1,0,0,0,0|1,0,0]=2 110 B4R0.1 CNC(=N)N SC-78334 [0,1,0,0,0,0|1,0,0]=2 111 B4R0.1 CNC(C)C SC-04732 [0,1,0,0,0,0|2,0,1]=4 112 B4R0.1 CNC(N)=O SC-15862 [0,1,0,0,0,0|0,0,2]=3 113 B4R0.1 CNN(C)C SC-41461 [0,1,0,0,0,0|3,0,0]=4 114 B4R0.1 COC(Cl)Cl SC-04782 [0,1,0,0,0,0|2,0,1]=4 115 B4R0.1 COP(Cl)Cl SC-92048 [0,1,0,0,0,0|3,0,0]=4 116 B4R0.1 CSC(=N)N SC-97881 [0,1,0,0,0,0|0,1,0]=2 117 B4R0.1 C[C@@H](N)CN SC-08946 [0,1,0,0,0,0|1,0,2]=4 118 B4R0.1 C[C@@H](N)CO SC-03772 [0,1,0,0,0,0|1,0,1]=3 119 B4R0.1 C[C@@H](O)CN SC-03087 [0,1,0,0,0,0|1,0,1]=3 120 B4R0.1 C[C@@H](O)CO SC-04433 [0,1,0,0,0,0|2,0,1]=4 121 B4R0.1 C[C@H](Cl)CO SC-98590 [0,1,0,0,0,0|2,0,1]=4 122 B4R0.1 C[C@H](N)CN SC-08947 [0,1,0,0,0,0|1,0,2]=4 123 B4R0.1 C[C@H](N)CO SC-03066 [0,1,0,0,0,0|1,0,1]=3 124 B4R0.1 C[C@H](O)CCl SC-99597 [0,1,0,0,0,0|2,0,1]=4 125 B4R0.1 C[C@H](O)CN SC-03088 [0,1,0,0,0,0|1,0,1]=3 126 B4R0.1 C[C@H](O)CO SC-04434 [0,1,0,0,0,0|2,0,1]=4 127 B4R0.1 C\C(N)=N\O SC-29589 [0,1,0,0,0,0|1,0,0]=2 128 B4R0.1 C\C=C(\C)Br SC-91379 [0,1,0,0,0,0|3,0,0]=4 129 B4R0.1 N=C(N)CCl SC-69732 [0,1,0,0,0,0|1,0,0]=2 130 B4R0.1 N=C(N)CO SC-41719 [0,1,0,0,0,0|0,0,0]=1 131 B4R0.1 N=C(N)CO SC-50460 [0,1,0,0,0,0|0,0,0]=1 132 B4R0.1 N=C(N)NN SC-15685 [0,1,0,0,0,0|1,0,0]=2 133 B4R0.1 N=C(N)NN SC-16383 [0,1,0,0,0,0|1,0,0]=2 134 B4R0.1 N=C(N)NN SC-A2698 [0,1,0,0,0,0|1,0,0]=2 135 B4R0.1 NC(=O)CBr SC-17752 [0,1,0,0,0,0|1,0,1]=3 136 B4R0.1 NC(=O)CI SC-18913 [0,1,0,0,0,0|1,0,1]=3 137 B4R0.1 NC(=O)NO SC-17803 [0,1,0,0,0,0|1,0,0]=2 138 B4R0.1 NCC(=O)O SC-26884 [0,1,0,0,0,0|1,0,0]=2 139 B4R0.1 NCC(F)F SC-43926 [0,1,0,0,0,0|2,0,1]=4 140 B4R0.1 NCC(N)=O SC-09567 [0,1,0,0,0,0|0,0,2]=3 141 B4R0.1 NCC(N)=O SC-18427 [0,1,0,0,0,0|0,0,2]=3 142 B4R0.1 NNC(N)=O SC-18463 [0,1,0,0,0,0|0,0,2]=3 143 B4R0.1 NNC(N)=O SC-47308 [0,1,0,0,0,0|0,0,2]=3 144 B4R0.1 O=C(Br)CBr SC-18428 [0,1,0,0,0,0|2,0,1]=4 145 B4R0.1 O=C(Cl)CBr SC-49267 [0,1,0,0,0,0|2,0,1]=4 146 B4R0.1 O=C(O)CBr SC-18211 [0,1,0,0,0,0|2,0,0]=3 147 B4R0.1 O=C(O)CO SC-23119 [0,1,0,0,0,0|2,0,0]=3 148 B4R0.1 O=C(O)CO SC-26092 [0,1,0,0,0,0|2,0,0]=3 149 B4R0.1 O=C([O-])CI SC-80290 [0,1,0,0,0,0|2,0,1]=4 150 B4R0.1 O=CC(=O)O SC-25819 [0,1,0,0,0,0|2,0,0]=3 151 B4R0.1 OCC(F)F SC-16815 [0,1,0,0,0,0|2,0,1]=4 152 B4R0.1 ON=C(Br)Br SC-48802 [0,1,0,0,0,0|2,0,0]=3 153 B4R0.1 [C@@H](C)(O)C#C SC-47963 [0,1,0,0,0,0|2,0,1]=4 154 B4R0.1 [C@H](C)(O)C#C SC-47962 [0,1,0,0,0,0|2,0,1]=4 155 B4R0.3 CC(C)(C)N SC-72371 [0,1,0,0,0,0|2,0,1]=4 156 B4R0.3 CP(=O)(O)O SC-70367 [0,1,0,0,0,0|3,0,0]=4 157 B4R0.3 CS(C)(=N)=O SC-82490 [0,1,0,0,0,0|2,0,1]=4 158 B4R0.3 CS(N)(=O)=O SC-15857 [0,1,0,0,0,0|2,0,1]=4 159 B4R0.3 NS(=O)(=O)Cl SC-26177 [0,1,0,0,0,0|2,0,1]=4 160 B4R0.3 NS(N)(=O)=O SC-15253 [0,1,0,0,0,0|1,0,2]=4 161 B4R0.3 O=S(=O)(O)O SC-21121 [0,1,0,0,0,0|3,0,0]=4 162 B4R0.3 O=S(=O)(O)O SC-65219 [0,1,0,0,0,0|3,0,0]=4 163 B4R0.3 [2H]C([2H])([2H])N SC-13756 [0,1,0,0,0,0|2,0,1]=4 164 B4R0.3 [2H]C([2H])([2H])N SC-A4445 [0,1,0,0,0,0|2,0,1]=4 165 B4R1.2 NC1CC1 SC-13654 [0,0,0,1,0,0|2,0,1]=4 166 B4R1.2 OC1CC1 SC-48540 [0,0,0,1,0,0|2,0,1]=4 167 B1R0.1 B=B SC-49506 [2,0,0,0,0,0|2,0,0]=4 168 B1R0.1 C=O SC-94146 [2,0,0,0,0,0|0,0,1]=3 169 B1R0.1 CN SC-10208 [2,0,0,0,0,0|0,0,1]=3 170 B1R0.1 C[O-] SC-19003 [2,0,0,0,0,0|0,0,2]=4 171 B1R0.1 C[O-] SC-27858 [2,0,0,0,0,0|0,0,2]=4 172 B1R0.1 C[Re+6] SC-21619 [2,0,0,0,0,0|1,0,1]=4 173 B1R0.1 NN SC-27009 [2,0,0,0,0,0|0,0,1]=3 174 B1R0.1 NN SC-80655 [2,0,0,0,0,0|0,0,1]=3 175 B1R0.1 NO SC-25787 [2,0,0,0,0,0|0,0,0]=2 176 B1R0.1 [C-]#[O+] SC-24442 [2,0,0,0,0,0|0,0,2]=4 177 B1R0.1 [O-]Cl SC-75090 [2,0,0,0,0,0|1,0,1]=4 178 B3R0.1 Br\C=C\Br SC-73800 [1,1,0,0,0,0|2,0,0]=4 179 B3R0.1 C=CCN SC-13610 [1,1,0,0,0,0|1,0,0]=3 180 B3R0.1 C=C[CH-]C SC-90438 [1,1,0,0,0,0|2,0,0]=4 181 B3R0.1 CCNN SC-47438 [1,1,0,0,0,0|1,0,1]=4 182 B3R0.1 CCNN SC-88458 [1,1,0,0,0,0|1,0,1]=4 183 B3R0.1 CCNO SC-82856 [1,1,0,0,0,0|1,0,1]=4 184 B3R0.1 CCO[NH3+] SC-76549 [1,1,0,0,0,0|1,0,1]=4 185 B3R0.1 CN=C=S SC-27104 [1,1,0,0,0,0|0,1,1]=4 186 B3R0.1 CNNC SC-92981 [1,1,0,0,0,0|2,0,0]=4 187 B3R0.1 CNOC SC-17494 [1,1,0,0,0,0|2,0,0]=4 188 B3R0.1 CNOC SC-74340 [1,1,0,0,0,0|2,0,0]=4 189 B3R0.1 COCBr SC-13660 [1,1,0,0,0,0|1,0,1]=4 190 B3R0.1 C\C=C\Br SC-50117 [1,1,0,0,0,0|2,0,0]=4 191 B3R0.1 C\C=N\O SC-16388 [1,1,0,0,0,0|1,0,0]=3 192 B3R0.1 N#CCN SC-16069 [1,1,0,0,0,0|0,0,2]=4 193 B3R0.1 N#CCN SC-46133 [1,1,0,0,0,0|0,0,2]=4 194 B3R0.1 NCCBr SC-11569 [1,1,0,0,0,0|1,0,1]=4 195 B3R0.1 NCCCl SC-15450 [1,1,0,0,0,0|1,0,1]=4 196 B3R0.1 NCCCl SC-40145 [1,1,0,0,0,0|1,0,1]=4 197 B3R0.1 NCCF SC-66629 [1,1,0,0,0,0|1,0,1]=4 198 B3R0.1 NCCF SC-89351 [1,1,0,0,0,0|1,0,1]=4 199 B3R0.1 NNC=O SC-22540 [1,1,0,0,0,0|0,0,1]=3 200 B3R0.1 OCCBr SC-26949 [1,1,0,0,0,0|1,0,1]=4 201 B3R0.1 OCCF SC-22570 [1,1,0,0,0,0|1,0,1]=4 202 B3R0.1 OCCI SC-46883 [1,1,0,0,0,0|1,0,1]=4 203 B3R0.1 OCCO SC-A3578 [1,1,0,0,0,0|1,0,1]=4 204 B5R0.1 C#CCC(=O)O SC-40344 [0,2,0,0,0,0|2,0,0]=4 205 B5R0.1 C=C(C)OCC SC-18086 [0,2,0,0,0,0|2,0,0]=4 206 B5R0.1 C=CCC(=O)O SC-49093 [0,2,0,0,0,0|2,0,0]=4 207 B5R0.1 C=COC(C)=O SC-79059 [0,2,0,0,0,0|2,0,0]=4 208 B5R0.1 CC#CC(=O)O SC-76460 [0,2,0,0,0,0|2,0,0]=4 209 B5R0.1 CC(=O)CCO SC-65678 [0,2,0,0,0,0|2,0,0]=4 210 B5R0.1 CC(=O)OCBr SC-44237 [0,2,0,0,0,0|2,0,0]=4 211 B5R0.1 CC(=O)\C=N/O SC-89466 [0,2,0,0,0,0|1,0,1]=4 212 B5R0.1 CC(=O)\C=N\O SC-68143 [0,2,0,0,0,0|1,0,1]=4 213 B5R0.1 CC(C)=CCN SC-51952 [0,2,0,0,0,0|2,0,0]=4 214 B5R0.1 CC(C)=CCO SC-77150 [0,2,0,0,0,0|2,0,0]=4 215 B5R0.1 CC(N)CCO SC-82589 [0,2,0,0,0,0|1,0,1]=4 216 B5R0.1 CCCC(=N)N SC-19347 [0,2,0,0,0,0|1,0,0]=3 217 B5R0.1 CCCC(N)=O SC-46377 [0,2,0,0,0,0|1,0,1]=4 218 B5R0.1 CCN=C(N)N SC-15057 [0,2,0,0,0,0|1,0,0]=3 219 B5R0.1 CCOC(=S)[S-] SC-62877 [0,2,0,0,0,0|2,0,0]=4 220 B5R0.1 CCOC(C)=N SC-02547 [0,2,0,0,0,0|1,0,0]=3 221 B5R0.1 CCOC(C)=N SC-A3540 [0,2,0,0,0,0|1,0,0]=3 222 B5R0.1 CCOC(N)=O SC-16133 [0,2,0,0,0,0|1,0,0]=3 223 B5R0.1 CCSC(=N)N SC-20585 [0,2,0,0,0,0|0,1,0]=3 224 B5R0.1 CCSC(=N)N SC-53442 [0,2,0,0,0,0|0,1,0]=3 225 B5R0.1 CNCC(=O)O SC-10425 [0,2,0,0,0,0|1,0,0]=3 226 B5R0.1 CNCC(N)=O SC-10429 [0,2,0,0,0,0|0,0,2]=4 227 B5R0.1 CNNC(N)=S SC-74513 [0,2,0,0,0,0|0,1,1]=4 228 B5R0.1 COCC(=N)N SC-41213 [0,2,0,0,0,0|0,0,0]=2 229 B5R0.1 COCC(=N)N SC-73218 [0,2,0,0,0,0|0,0,0]=2 230 B5R0.1 COCC(=O)Cl SC-27381 [0,2,0,0,0,0|2,0,0]=4 231 B5R0.1 COCC(C)N SC-48787 [0,2,0,0,0,0|1,0,1]=4 232 B5R0.1 COC[C@@H](C)N SC-47724 [0,2,0,0,0,0|1,0,1]=4 233 B5R0.1 CSNC(C)=O SC-28667 [0,2,0,0,0,0|1,0,1]=4 234 B5R0.1 C[C@@H](N)CCO SC-48293 [0,2,0,0,0,0|1,0,1]=4 235 B5R0.1 C\C=C/C(=O)O SC-25924 [0,2,0,0,0,0|2,0,0]=4 236 B5R0.1 N#CCC(=O)O SC-18648 [0,2,0,0,0,0|1,0,1]=4 237 B5R0.1 N#CCC(N)=O SC-26759 [0,2,0,0,0,0|0,0,2]=4 238 B5R0.1 NCCC(=O)O SC-10014 [0,2,0,0,0,0|1,0,0]=3 239 B5R0.1 NCCC(N)=O SC-48688 [0,2,0,0,0,0|0,0,2]=4 240 B5R0.1 NCCC(N)=O SC-84499 [0,2,0,0,0,0|0,0,2]=4 241 B5R0.1 O=C(O)CCBr SC-18441 [0,2,0,0,0,0|2,0,0]=4 242 B5R0.1 O=C(O)CCS SC-22642 [0,2,0,0,0,0|2,0,0]=4 243 B5R0.3 C#CC(=O)OC SC-27849 [0,2,0,0,0,0|2,0,0]=4 244 B5R0.3 C=C(CO)CO SC-17984 [0,2,0,0,0,0|2,0,0]=4 245 B5R0.3 C=C[C@H](N)CO SC-88199 [0,2,0,0,0,0|1,0,1]=4 246 B5R0.3 CCC(=O)NN SC-25039 [0,2,0,0,0,0|1,0,1]=4 247 B5R0.3 CCC(N)CO SC-21072 [0,2,0,0,0,0|1,0,1]=4 248 B5R0.3 CC\C(N)=N\O SC-28960 [0,2,0,0,0,0|1,0,0]=3 249 B5R0.3 CNC(=O)CBr SC-27946 [0,2,0,0,0,0|1,0,1]=4 250 B5R0.3 CNC(=O)CN SC-47802 [0,2,0,0,0,0|0,0,2]=4 251 B5R0.3 CNC(=O)OC SC-97890 [0,2,0,0,0,0|1,0,0]=3 252 B5R0.3 COC(=O)C#N SC-49091 [0,2,0,0,0,0|1,0,1]=4 253 B5R0.3 COC(=O)CBr SC-15855 [0,2,0,0,0,0|2,0,0]=4 254 B5R0.3 COC(=O)CN SC-09571 [0,2,0,0,0,0|1,0,0]=3 255 B5R0.3 COC(=O)CN SC-49390 [0,2,0,0,0,0|1,0,0]=3 256 B5R0.3 COC(=O)CO SC-28291 [0,2,0,0,0,0|2,0,0]=4 257 B5R0.3 COC(=O)CS SC-54102 [0,2,0,0,0,0|2,0,0]=4 258 B5R0.3 COC(C)CN SC-A4864 [0,2,0,0,0,0|1,0,1]=4 259 B5R0.3 CS\C(N)=N\N SC-47788 [0,2,0,0,0,0|0,1,0]=3 260 B5R0.3 NC(CO)CO SC-16669 [0,2,0,0,0,0|1,0,1]=4 261 B5R0.3 NCC(O)CO SC-15511 [0,2,0,0,0,0|1,0,1]=4 262 B5R0.3 NC[C@@H](O)CO SC-06146 [0,2,0,0,0,0|1,0,1]=4 263 B5R0.3 NC[C@H](O)CCl SC-89081 [0,2,0,0,0,0|1,0,1]=4 264 B5R0.3 NNC(=O)CO SC-83204 [0,2,0,0,0,0|1,0,0]=3 265 B5R0.3 O=C(CO)CO SC-07450 [0,2,0,0,0,0|2,0,0]=4 266 B5R0.3 [C@H](N)(CC)CO SC-08958 [0,2,0,0,0,0|1,0,1]=4 267 B5R0.3 [C@H](O)(CN)CO SC-05739 [0,2,0,0,0,0|1,0,1]=4 268 B5R0.4 CC(C)(N)CO SC-00654 [0,2,0,0,0,0|1,0,1]=4 269 B5R0.4 CC(C)(O)CN SC-14245 [0,2,0,0,0,0|1,0,1]=4 270 B5R0.4 NCP(=O)(O)O SC-86885 [0,2,0,0,0,0|2,0,0]=4 271 B5R0.4 NOS(=O)(=O)O SC-18714 [0,2,0,0,0,0|2,0,0]=4 272 B5R0.5 C=C(C)C(N)=O SC-74591 [0,2,0,0,0,0|1,0,1]=4 273 B5R0.5 C=C(F)C(=O)O SC-47473 [0,2,0,0,0,0|2,0,0]=4 274 B5R0.5 CC(=O)C(=O)O SC-17382 [0,2,0,0,0,0|2,0,0]=4 275 B5R0.5 CC(=O)N(C)C SC-54108 [0,2,0,0,0,0|1,0,1]=4 276 B5R0.5 CC(Br)C(N)=O SC-97497 [0,2,0,0,0,0|1,0,1]=4 277 B5R0.5 CC(C)C(=N)N SC-13079 [0,2,0,0,0,0|1,0,0]=3 278 B5R0.5 CC(F)C(=O)O SC-83429 [0,2,0,0,0,0|2,0,0]=4 279 B5R0.5 CC(N)C(=O)O SC-09271 [0,2,0,0,0,0|1,0,0]=3 280 B5R0.5 CC(N)C(N)=O SC-94219 [0,2,0,0,0,0|0,0,2]=4 281 B5R0.5 CC(O)C(=O)[O-] SC-19308 [0,2,0,0,0,0|2,0,0]=4 282 B5R0.5 CC(O)C(=O)[O-] SC-25623 [0,2,0,0,0,0|2,0,0]=4 283 B5R0.5 CC(O)C(=O)[O-] SC-75139 [0,2,0,0,0,0|2,0,0]=4 284 B5R0.5 CC(S)C(=O)O SC-74563 [0,2,0,0,0,0|2,0,0]=4 285 B5R0.5 CN(C)C(=O)Cl SC-15201 [0,2,0,0,0,0|1,0,1]=4 286 B5R0.5 CN(C)C(=S)Cl SC-15756 [0,2,0,0,0,0|1,1,0]=4 287 B5R0.5 CN(C)C(N)=S SC-A2077 [0,2,0,0,0,0|0,1,1]=4 288 B5R0.5 C[C@@H](Br)C(=O)O SC-08843 [0,2,0,0,0,0|2,0,0]=4 289 B5R0.5 C[C@@H](Cl)C(=O)O SC-06610 [0,2,0,0,0,0|2,0,0]=4 290 B5R0.5 C[C@@H](N)C(=O)O SC-09270 [0,2,0,0,0,0|1,0,0]=3 291 B5R0.5 C[C@@H](N)C(N)=O SC-09289 [0,2,0,0,0,0|0,0,2]=4 292 B5R0.5 C[C@@H](O)C(N)=O SC-92873 [0,2,0,0,0,0|1,0,0]=3 293 B5R0.5 C[C@H](Cl)C(=O)O SC-03218 [0,2,0,0,0,0|2,0,0]=4 294 B5R0.5 C[C@H](N)C(=O)O SC-09272 [0,2,0,0,0,0|1,0,0]=3 295 B5R0.5 C[C@H](N)C(N)=O SC-03542 [0,2,0,0,0,0|0,0,2]=4 296 B5R0.5 C[C@H](O)C(N)=O SC-73228 [0,2,0,0,0,0|1,0,0]=3 297 B5R0.5 NC(=O)C(=O)[O-] SC-52623 [0,2,0,0,0,0|1,0,1]=4 298 B5R0.5 O=C(O)C(Cl)Cl SC-18205 [0,2,0,0,0,0|2,0,0]=4 299 B5R0.5 O=C(O)C(F)Br SC-49620 [0,2,0,0,0,0|2,0,0]=4 300 B5R0.5 O=C(O)C(F)F SC-25529 [0,2,0,0,0,0|2,0,0]=4 301 B5R0.5 [2H]C(=O)N(C)C SC-97589 [0,2,0,0,0,0|1,0,1]=4 302 B5R0.5 [C@@H](C)(Br)C(=O)O SC-03475 [0,2,0,0,0,0|2,0,0]=4 303 B5R1.2 NC1COC1 SC-20809 [0,1,0,1,0,0|1,0,1]=4 304 B5R1.2 O=C1CCN1 SC-44172 [0,1,0,1,0,0|1,0,1]=4 305 B5R1.2 O=C1CNC1 SC-48283 [0,1,0,1,0,0|1,0,1]=4 306 B5R1.2 O=C1COC1 SC-21889 [0,1,0,1,0,0|2,0,0]=4 307 B5R1.2 OC1CNC1 SC-04637 [0,1,0,1,0,0|1,0,1]=4 308 B5R1.2 OC1CNC1 SC-19998 [0,1,0,1,0,0|1,0,1]=4