0 B3R0.2 C=C(C)[Mg+] SC-70280 [0,0,0,0,0,0|3,0,1]=4 1 B3R0.2 CB(O)O SC-00749 [0,0,0,0,0,0|4,0,0]=4 2 B3R0.2 CC(=N)N SC-19002 [0,0,0,0,0,0|3,0,1]=4 3 B3R0.2 CC(=O)O SC-16774 [0,0,0,0,0,0|3,0,1]=4 4 B3R0.2 CC(=O)O SC-27909 [0,0,0,0,0,0|3,0,1]=4 5 B3R0.2 CC(=O)[O-] SC-03583 [0,0,0,0,0,0|3,0,1]=4 6 B3R0.2 CC(=O)[O-] SC-12688 [0,0,0,0,0,0|3,0,1]=4 7 B3R0.2 CC(=O)[O-] SC-18918 [0,0,0,0,0,0|3,0,1]=4 8 B3R0.2 CC(=O)[O-] SC-18995 [0,0,0,0,0,0|3,0,1]=4 9 B3R0.2 CC(=O)[O-] SC-26584 [0,0,0,0,0,0|3,0,1]=4 10 B3R0.2 CC(=O)[O-] SC-46842 [0,0,0,0,0,0|3,0,1]=4 11 B3R0.2 CC(=O)[O-] SC-81401 [0,0,0,0,0,0|3,0,1]=4 12 B3R0.2 CC(=O)[O-] SC-88396 [0,0,0,0,0,0|3,0,1]=4 13 B3R0.2 CC(=O)[O-] SC-93306 [0,0,0,0,0,0|3,0,1]=4 14 B3R0.2 CC(C)[O-] SC-43831 [0,0,0,0,0,0|3,0,0]=3 15 B3R0.2 CC(C)[O-] SC-94197 [0,0,0,0,0,0|3,0,0]=3 16 B3R0.2 CC(N)=O SC-18410 [0,0,0,0,0,0|3,0,1]=4 17 B3R0.2 CC(N)=S SC-17261 [0,0,0,0,0,0|3,0,1]=4 18 B3R0.2 CC([O-])=S SC-15916 [0,0,0,0,0,0|3,0,1]=4 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|4,0,0]=4 21 B3R0.2 C[PH](C)=O SC-72909 [0,0,0,0,0,0|4,0,0]=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|1,3,0]=4 25 B3R0.2 FC(Br)Br SC-53486 [0,0,0,0,0,0|0,3,0]=3 26 B3R0.2 IC(I)I SC-16447 [0,0,0,0,0,0|0,3,0]=3 27 B3R0.2 N=C(N)Cl SC-77353 [0,0,0,0,0,0|2,0,1]=3 28 B3R0.2 N=C(N)N SC-18582 [0,0,0,0,0,0|3,0,1]=4 29 B3R0.2 NC(=S)S SC-18554 [0,0,0,0,0,0|3,0,1]=4 30 B3R0.2 NC(N)=O SC-75453 [0,0,0,0,0,0|3,0,1]=4 31 B3R0.2 NC(N)=O SC-81784 [0,0,0,0,0,0|3,0,1]=4 32 B3R0.2 O=C(O)O SC-18529 [0,0,0,0,0,0|3,0,1]=4 33 B3R0.2 O=C([O-])O SC-80213 [0,0,0,0,0,0|3,0,1]=4 34 B3R0.2 O=C([O-])[O-] SC-97647 [0,0,0,0,0,0|3,0,1]=4 35 B3R0.2 O=P(=O)[O-] SC-79336 [0,0,0,0,0,0|4,0,0]=4 36 B3R0.2 O=S(Br)Br SC-85525 [0,0,0,0,0,0|2,2,0]=4 37 B3R0.2 O=[N+]([O-])[O-] SC-18940 [0,0,0,0,0,0|4,0,0]=4 38 B3R0.2 O=[N+]([O-])[O-] SC-47221 [0,0,0,0,0,0|4,0,0]=4 39 B3R0.2 O=[N+]([O-])[O-] SC-65376 [0,0,0,0,0,0|4,0,0]=4 40 B3R0.2 O=[N+]([O-])[O-] SC-69859 [0,0,0,0,0,0|4,0,0]=4 41 B3R0.2 O=[N+]([O-])[O-] SC-84846 [0,0,0,0,0,0|4,0,0]=4 42 B3R0.2 O=[Ti]([O-])F SC-79800 [0,0,0,0,0,0|3,1,0]=4 43 B3R0.2 O=[V](=O)[O-] SC-53201 [0,0,0,0,0,0|4,0,0]=4 44 B3R0.2 S=C(Cl)Cl SC-26745 [0,0,0,0,0,0|1,0,1]=2 45 B2R0.1 BrCBr SC-16380 [1,0,0,0,0,0|0,2,0]=3 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|2,0,1]=4 48 B2R0.1 CC#N SC-43555 [1,0,0,0,0,0|2,0,1]=4 49 B2R0.1 CCI SC-46828 [1,0,0,0,0,0|1,1,0]=3 50 B2R0.1 CC[O-] SC-70475 [1,0,0,0,0,0|2,0,0]=3 51 B2R0.1 CC[O-] SC-94198 [1,0,0,0,0,0|2,0,0]=3 52 B2R0.1 CC[S-] SC-53819 [1,0,0,0,0,0|2,0,0]=3 53 B2R0.1 CNO SC-62256 [1,0,0,0,0,0|3,0,0]=4 54 B2R0.1 CON SC-18435 [1,0,0,0,0,0|3,0,0]=4 55 B2R0.1 ClCBr SC-06619 [1,0,0,0,0,0|0,1,0]=2 56 B2R0.1 ClCI SC-22871 [1,0,0,0,0,0|0,1,0]=2 57 B2R0.1 FCI SC-48569 [1,0,0,0,0,0|0,2,0]=3 58 B2R0.1 ICI SC-16458 [1,0,0,0,0,0|0,2,0]=3 59 B2R0.1 N#CN SC-16012 [1,0,0,0,0,0|2,0,1]=4 60 B2R0.1 N=CN SC-09552 [1,0,0,0,0,0|2,0,1]=4 61 B2R0.1 N=CN SC-21161 [1,0,0,0,0,0|2,0,1]=4 62 B2R0.1 NC=O SC-46172 [1,0,0,0,0,0|2,0,1]=4 63 B2R0.1 NC=S SC-15964 [1,0,0,0,0,0|2,0,1]=4 64 B2R0.1 O=C[O-] SC-83358 [1,0,0,0,0,0|2,0,1]=4 65 B2R0.1 O=N[O-] SC-79816 [1,0,0,0,0,0|3,0,0]=4 66 B2R0.1 O=[Ge]=O SC-19469 [1,0,0,0,0,0|2,1,0]=4 67 B2R0.1 O=[Si]=O SC-89620 [1,0,0,0,0,0|2,1,0]=4 68 B2R0.1 O=[Te]=O SC-81428 [1,0,0,0,0,0|3,0,0]=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|2,0,1]=4 71 B2R0.1 [CH2-]CC SC-50030 [1,0,0,0,0,0|2,0,0]=3 72 B4R0.1 C#CC(C)N SC-52789 [0,1,0,0,0,0|3,0,0]=4 73 B4R0.1 C#CC(C)N SC-A2988 [0,1,0,0,0,0|3,0,0]=4 74 B4R0.1 C#CC(C)O SC-26644 [0,1,0,0,0,0|3,0,0]=4 75 B4R0.1 C=CC(C)O SC-43661 [0,1,0,0,0,0|3,0,0]=4 76 B4R0.1 C=C[C@H](C)N SC-67439 [0,1,0,0,0,0|3,0,0]=4 77 B4R0.1 CC(Br)C#N SC-48220 [0,1,0,0,0,0|2,1,0]=4 78 B4R0.1 CC(Br)CO SC-A3571 [0,1,0,0,0,0|2,1,0]=4 79 B4R0.1 CC(C)NN SC-21077 [0,1,0,0,0,0|3,0,0]=4 80 B4R0.1 CC(C)NN SC-73657 [0,1,0,0,0,0|3,0,0]=4 81 B4R0.1 CC(C)NO SC-A3794 [0,1,0,0,0,0|3,0,0]=4 82 B4R0.1 CC(C)ON SC-87607 [0,1,0,0,0,0|3,0,0]=4 83 B4R0.1 CC(Cl)C#N SC-53702 [0,1,0,0,0,0|2,0,0]=3 84 B4R0.1 CC(N)C#N SC-92053 [0,1,0,0,0,0|3,0,0]=4 85 B4R0.1 CC(N)CO SC-18397 [0,1,0,0,0,0|3,0,0]=4 86 B4R0.1 CC(S)CS SC-A2768 [0,1,0,0,0,0|3,0,0]=4 87 B4R0.1 CCC(C)O SC-01234 [0,1,0,0,0,0|3,0,0]=4 88 B4R0.1 CC[C@H](C)N SC-81828 [0,1,0,0,0,0|3,0,0]=4 89 B4R0.1 CC[C@H](C)O SC-04418 [0,1,0,0,0,0|3,0,0]=4 90 B4R0.1 CNC(C)C SC-04732 [0,1,0,0,0,0|3,0,0]=4 91 B4R0.1 COC(Cl)Cl SC-04782 [0,1,0,0,0,0|1,0,0]=2 92 B4R0.1 COP(Cl)Cl SC-92048 [0,1,0,0,0,0|2,0,0]=3 93 B4R0.1 C[C@@H](N)CN SC-08946 [0,1,0,0,0,0|3,0,0]=4 94 B4R0.1 C[C@@H](N)CO SC-03772 [0,1,0,0,0,0|3,0,0]=4 95 B4R0.1 C[C@@H](O)CN SC-03087 [0,1,0,0,0,0|3,0,0]=4 96 B4R0.1 C[C@@H](O)CO SC-04433 [0,1,0,0,0,0|3,0,0]=4 97 B4R0.1 C[C@H](Cl)CO SC-98590 [0,1,0,0,0,0|2,0,0]=3 98 B4R0.1 C[C@H](N)CN SC-08947 [0,1,0,0,0,0|3,0,0]=4 99 B4R0.1 C[C@H](N)CO SC-03066 [0,1,0,0,0,0|3,0,0]=4 100 B4R0.1 C[C@H](O)CCl SC-99597 [0,1,0,0,0,0|2,0,0]=3 101 B4R0.1 C[C@H](O)CN SC-03088 [0,1,0,0,0,0|3,0,0]=4 102 B4R0.1 C[C@H](O)CO SC-04434 [0,1,0,0,0,0|3,0,0]=4 103 B4R0.1 FC(F)CBr SC-21856 [0,1,0,0,0,0|0,3,0]=4 104 B4R0.1 FC(F)CI SC-82530 [0,1,0,0,0,0|0,3,0]=4 105 B4R0.1 N#CC(Cl)Cl SC-46671 [0,1,0,0,0,0|1,0,0]=2 106 B4R0.1 N=C(N)CCl SC-69732 [0,1,0,0,0,0|2,0,1]=4 107 B4R0.1 NCC(F)F SC-43926 [0,1,0,0,0,0|1,2,0]=4 108 B4R0.1 O=C(Cl)CBr SC-49267 [0,1,0,0,0,0|1,1,1]=4 109 B4R0.1 OCC(F)F SC-16815 [0,1,0,0,0,0|1,2,0]=4 110 B4R0.1 [C@@H](C)(O)C#C SC-47963 [0,1,0,0,0,0|3,0,0]=4 111 B4R0.1 [C@H](C)(O)C#C SC-47962 [0,1,0,0,0,0|3,0,0]=4 112 B4R0.3 BrC(Br)(Br)Br SC-15129 [0,1,0,0,0,0|0,3,0]=4 113 B4R0.3 CC(C)(C)N SC-72371 [0,1,0,0,0,0|3,0,0]=4 114 B4R0.3 CC(C)(C)[Mg+] SC-69024 [0,1,0,0,0,0|3,0,0]=4 115 B4R0.3 CC(C)(C)[O-] SC-45240 [0,1,0,0,0,0|3,0,0]=4 116 B4R0.3 CC(C)(C)[O-] SC-47436 [0,1,0,0,0,0|3,0,0]=4 117 B4R0.3 C[Si](C)(C)Cl SC-25617 [0,1,0,0,0,0|2,1,0]=4 118 B4R0.3 Cl[Au-](Cl)(Cl)Cl SC-52760 [0,1,0,0,0,0|1,0,0]=2 119 B4R0.3 Cl[Pt-2](Cl)(Cl)Cl SC-19181 [0,1,0,0,0,0|1,0,0]=2 120 B4R0.3 FC(F)(F)[S-] SC-98208 [0,1,0,0,0,0|0,3,0]=4 121 B4R0.3 NS(=O)(=O)Cl SC-26177 [0,1,0,0,0,0|3,0,0]=4 122 B4R0.3 [2H]C([2H])([2H])I SC-49382 [0,1,0,0,0,0|2,1,0]=4 123 B4R0.3 [2H]C([2H])([2H])N SC-13756 [0,1,0,0,0,0|3,0,0]=4 124 B4R0.3 [2H]C([2H])([2H])N SC-A4445 [0,1,0,0,0,0|3,0,0]=4 125 B4R1.2 BrC1CC1 SC-13617 [0,0,0,1,0,0|2,1,0]=4 126 B4R1.2 CC1CC1 SC-53150 [0,0,0,1,0,0|3,0,0]=4 127 B4R1.2 NC1CC1 SC-13654 [0,0,0,1,0,0|3,0,0]=4 128 B4R1.2 OC1CC1 SC-48540 [0,0,0,1,0,0|3,0,0]=4 129 B1R0.1 B=B SC-49506 [2,0,0,0,0,0|2,0,0]=4 130 B1R0.1 C=O SC-94146 [2,0,0,0,0,0|1,0,1]=4 131 B1R0.1 CN SC-10208 [2,0,0,0,0,0|1,0,0]=3 132 B1R0.1 C[O-] SC-19003 [2,0,0,0,0,0|1,0,0]=3 133 B1R0.1 C[O-] SC-27858 [2,0,0,0,0,0|1,0,0]=3 134 B1R0.1 C[Re+6] SC-21619 [2,0,0,0,0,0|1,0,0]=3 135 B1R0.1 NN SC-27009 [2,0,0,0,0,0|2,0,0]=4 136 B1R0.1 NN SC-80655 [2,0,0,0,0,0|2,0,0]=4 137 B1R0.1 NO SC-25787 [2,0,0,0,0,0|2,0,0]=4 138 B1R0.1 [C-]#[O+] SC-24442 [2,0,0,0,0,0|1,0,1]=4 139 B1R0.1 [O-]Cl SC-75090 [2,0,0,0,0,0|1,0,0]=3 140 B3R0.1 C=CCN SC-13610 [1,1,0,0,0,0|2,0,0]=4 141 B3R0.1 CCC[Zn+] SC-92929 [1,1,0,0,0,0|2,0,0]=4 142 B3R0.1 CCNN SC-47438 [1,1,0,0,0,0|2,0,0]=4 143 B3R0.1 CCNN SC-88458 [1,1,0,0,0,0|2,0,0]=4 144 B3R0.1 CCNO SC-82856 [1,1,0,0,0,0|2,0,0]=4 145 B3R0.1 CCO[NH3+] SC-76549 [1,1,0,0,0,0|2,0,0]=4 146 B3R0.1 COCBr SC-13660 [1,1,0,0,0,0|1,1,0]=4 147 B3R0.1 ClCCBr SC-16459 [1,1,0,0,0,0|0,1,0]=3 148 B3R0.1 ClCCI SC-93145 [1,1,0,0,0,0|0,1,0]=3 149 B3R0.1 FCCBr SC-16577 [1,1,0,0,0,0|0,2,0]=4 150 B3R0.1 N#CCN SC-16069 [1,1,0,0,0,0|2,0,0]=4 151 B3R0.1 N#CCN SC-46133 [1,1,0,0,0,0|2,0,0]=4 152 B3R0.1 NCCBr SC-11569 [1,1,0,0,0,0|1,1,0]=4 153 B3R0.1 NCCCl SC-15450 [1,1,0,0,0,0|1,0,0]=3 154 B3R0.1 NCCCl SC-40145 [1,1,0,0,0,0|1,0,0]=3 155 B3R0.1 NCCF SC-66629 [1,1,0,0,0,0|1,1,0]=4 156 B3R0.1 NCCF SC-89351 [1,1,0,0,0,0|1,1,0]=4 157 B3R0.1 OCCBr SC-26949 [1,1,0,0,0,0|1,1,0]=4 158 B3R0.1 OCCF SC-22570 [1,1,0,0,0,0|1,1,0]=4 159 B3R0.1 OCCI SC-46883 [1,1,0,0,0,0|1,1,0]=4 160 B3R0.1 OCCO SC-A3578 [1,1,0,0,0,0|2,0,0]=4 161 B3R0.1 SCCS SC-27058 [1,1,0,0,0,0|2,0,0]=4 162 B5R0.1 O=C(Cl)CCCl SC-16310 [0,2,0,0,0,0|1,0,1]=4 163 B5R0.3 C=C(CCl)CCl SC-21050 [0,2,0,0,0,0|1,0,1]=4 164 B5R0.3 C=CC(Cl)CCl SC-A3373 [0,2,0,0,0,0|1,0,0]=3 165 B5R0.3 NC[C@H](O)CCl SC-89081 [0,2,0,0,0,0|2,0,0]=4 166 B5R0.3 O=CC(Cl)C=O SC-43728 [0,2,0,0,0,0|2,0,0]=4 167 B5R0.3 OC[C@@H](O)CCl SC-05423 [0,2,0,0,0,0|2,0,0]=4 168 B5R0.4 CC(C)(C)CCl SC-48963 [0,2,0,0,0,0|2,0,0]=4 169 B5R0.4 CC(C)(O)CCl SC-05342 [0,2,0,0,0,0|2,0,0]=4 170 B5R0.4 CCC(Cl)(Cl)Cl SC-76666 [0,2,0,0,0,0|0,0,0]=2 171 B5R0.4 COP(=O)(Cl)Cl SC-10249 [0,2,0,0,0,0|2,0,0]=4 172 B5R0.4 O=S(=O)(Cl)CCl SC-54024 [0,2,0,0,0,0|2,0,0]=4 173 B5R0.5 CC(=O)C(C)Cl SC-46981 [0,2,0,0,0,0|2,0,0]=4 174 B5R0.5 CC(Cl)C(Cl)Cl SC-25006 [0,2,0,0,0,0|0,0,0]=2 175 B5R0.5 C[C@@H](Cl)C(=O)O SC-06610 [0,2,0,0,0,0|2,0,0]=4 176 B5R0.5 C[C@H](Cl)C(=O)O SC-03218 [0,2,0,0,0,0|2,0,0]=4 177 B5R0.5 O=C(O)C(Cl)Cl SC-18205 [0,2,0,0,0,0|1,0,0]=3 178 B5R0.5 O=C([O-])C(Cl)Cl SC-15953 [0,2,0,0,0,0|1,0,0]=3 179 B5R1.3 ClCC1CC1 SC-27742 [0,1,0,1,0,0|2,0,0]=4 180 B5R1.3 ClC[C@@H]1CO1 SC-06234 [0,1,0,1,0,0|2,0,0]=4 181 B5R1.3 ClC[C@H]1CO1 SC-04973 [0,1,0,1,0,0|2,0,0]=4