0 B3R0.1 C#CCCl SC-15922 [0,0,0,0,0,0|1,0,2]=3 1 B3R0.1 C#CCN SC-15923 [0,0,0,0,0,0|1,0,2]=3 2 B3R0.1 CC#CI SC-88621 [0,0,0,0,0,0|1,0,2]=3 3 B3R0.1 COC=O SC-19116 [0,0,0,0,0,0|1,1,1]=3 4 B3R0.1 Cl\C=C\Cl SC-65915 [0,0,0,0,0,0|2,0,2]=4 5 B3R0.1 FCCF SC-58115 [0,0,0,0,0,0|2,0,0]=2 6 B3R0.1 ICCI SC-90216 [0,0,0,0,0,0|2,0,0]=2 7 B3R0.1 NCCBr SC-39967 [0,0,0,0,0,0|2,0,0]=2 8 B3R0.1 NCCI SC-40010 [0,0,0,0,0,0|2,0,0]=2 9 B3R0.1 O=CC=O SC-19118 [0,0,0,0,0,0|1,1,2]=4 10 B3R0.1 OCCO SC-47188 [0,0,0,0,0,0|1,1,0]=2 11 B3R0.1 [Li]CCC SC-50170 [0,0,0,0,0,0|1,0,0]=1 12 B2R0.1 C=CO SC-48882 [1,0,0,0,0,0|0,1,2]=4 13 B2R0.1 CC[O-] SC-19450 [1,0,0,0,0,0|0,1,0]=2 14 B2R0.1 CC[O-] SC-67115 [1,0,0,0,0,0|0,1,0]=2 15 B2R0.1 CC[S-] SC-53724 [1,0,0,0,0,0|0,0,1]=2 16 B2R0.1 F[Xe]F SC-62262 [1,0,0,0,0,0|3,0,0]=4 17 B2R0.1 N#C[O-] SC-62212 [1,0,0,0,0,0|1,1,1]=4 18 B2R0.1 N#C[S-] SC-46930 [1,0,0,0,0,0|1,0,2]=4 19 B2R0.1 N#C[S-] SC-47009 [1,0,0,0,0,0|1,0,2]=4 20 B2R0.1 N#C[Se-] SC-50220 [1,0,0,0,0,0|1,1,1]=4 21 B2R0.1 N=C=N SC-90000 [1,0,0,0,0,0|2,0,1]=4 22 B2R0.1 NCN SC-53958 [1,0,0,0,0,0|2,0,0]=3 23 B2R0.1 O=B[O-] SC-79389 [1,0,0,0,0,0|2,1,0]=4 24 B2R0.1 O=B[O-] SC-79498 [1,0,0,0,0,0|2,1,0]=4 25 B2R0.1 O=C[O-] SC-18403 [1,0,0,0,0,0|1,1,1]=4 26 B2R0.1 O=C[O-] SC-27162 [1,0,0,0,0,0|1,1,1]=4 27 B2R0.1 O=C[O-] SC-80003 [1,0,0,0,0,0|1,1,1]=4 28 B2R0.1 O=C[O-] SC-81757 [1,0,0,0,0,0|1,1,1]=4 29 B2R0.1 O=P[O-] SC-18223 [1,0,0,0,0,0|2,1,0]=4 30 B2R0.1 O=[Se]=O SC-18268 [1,0,0,0,0,0|2,1,0]=4 31 B2R0.1 O=[Si]=O SC-25876 [1,0,0,0,0,0|1,2,0]=4 32 B2R0.1 [Li]CC SC-69937 [1,0,0,0,0,0|1,0,0]=2 33 B2R0.1 [O-]S[O-] SC-80408 [1,0,0,0,0,0|2,1,0]=4 34 B4R0.1 C#CC(C)C SC-83017 [0,1,0,0,0,0|1,0,1]=3 35 B4R0.1 C=C(Cl)CCl SC-62204 [0,1,0,0,0,0|1,0,2]=4 36 B4R0.1 C=C(N)OC SC-01201 [0,1,0,0,0,0|2,0,1]=4 37 B4R0.1 CC(=O)NN SC-16358 [0,1,0,0,0,0|2,0,1]=4 38 B4R0.1 CC(C)CBr SC-16381 [0,1,0,0,0,0|1,0,0]=2 39 B4R0.1 CC(Cl)CN SC-40273 [0,1,0,0,0,0|1,0,0]=2 40 B4R0.1 CCC(=N)N SC-39291 [0,1,0,0,0,0|1,0,1]=3 41 B4R0.1 CCN(C)C SC-05626 [0,1,0,0,0,0|2,0,0]=3 42 B4R0.1 COC(=N)N SC-46936 [0,1,0,0,0,0|2,0,1]=4 43 B4R0.1 COC(=N)N SC-65775 [0,1,0,0,0,0|2,0,1]=4 44 B4R0.1 COC(=O)[O-] SC-65186 [0,1,0,0,0,0|1,1,1]=4 45 B4R0.1 COC(N)=O SC-46315 [0,1,0,0,0,0|1,1,1]=4 46 B4R0.1 COC(N)=[NH2+] SC-15893 [0,1,0,0,0,0|2,0,1]=4 47 B4R0.1 C[C@@H](Cl)CO SC-70277 [0,1,0,0,0,0|0,1,0]=2 48 B4R0.1 N=C(N)CF SC-40566 [0,1,0,0,0,0|2,0,1]=4 49 B4R0.1 N=C(N)CN SC-58417 [0,1,0,0,0,0|2,0,1]=4 50 B4R0.1 NCC(=O)O SC-26815 [0,1,0,0,0,0|1,1,1]=4 51 B4R0.1 NCC(Br)Br SC-40061 [0,1,0,0,0,0|2,0,0]=3 52 B4R0.1 NCC(Cl)Cl SC-40282 [0,1,0,0,0,0|2,0,0]=3 53 B4R0.1 O=C(Cl)CCl SC-18214 [0,1,0,0,0,0|1,1,1]=4 54 B4R0.1 O=C(O)CO SC-85771 [0,1,0,0,0,0|1,1,1]=4 55 B4R0.1 O=C([O-])CBr SC-50549 [0,1,0,0,0,0|1,1,1]=4 56 B4R0.1 O=C([O-])CO SC-89096 [0,1,0,0,0,0|1,1,1]=4 57 B4R0.2 C=CCCBr SC-17888 [0,1,0,0,0,0|1,0,1]=3 58 B4R0.2 C=CCNN SC-54870 [0,1,0,0,0,0|1,0,2]=4 59 B4R0.2 C=CCOC SC-62245 [0,1,0,0,0,0|1,0,1]=3 60 B4R0.2 C=NCC#N SC-77260 [0,1,0,0,0,0|1,0,2]=4 61 B4R0.2 CCCNN SC-66226 [0,1,0,0,0,0|1,0,0]=2 62 B4R0.2 CCCNN SC-88572 [0,1,0,0,0,0|1,0,0]=2 63 B4R0.2 CCCSC SC-88233 [0,1,0,0,0,0|0,0,0]=1 64 B4R0.2 CCNCC SC-25726 [0,1,0,0,0,0|1,0,0]=2 65 B4R0.2 CCOC=N SC-52423 [0,1,0,0,0,0|1,0,1]=3 66 B4R0.2 CC[NH2+]CC SC-20006 [0,1,0,0,0,0|1,0,0]=2 67 B4R0.2 CNCCO SC-26626 [0,1,0,0,0,0|0,1,0]=2 68 B4R0.2 COCC[O-] SC-67452 [0,1,0,0,0,0|0,1,0]=2 69 B4R0.2 CSCCN SC-40144 [0,1,0,0,0,0|1,0,0]=2 70 B4R0.2 C[SH+]CCCl SC-53966 [0,1,0,0,0,0|1,0,0]=2 71 B4R0.2 FCCCF SC-62358 [0,1,0,0,0,0|1,0,0]=2 72 B4R0.2 N#CCCS SC-66276 [0,1,0,0,0,0|0,0,1]=2 73 B4R0.2 NCCCCl SC-40009 [0,1,0,0,0,0|1,0,0]=2 74 B4R0.2 NCCCF SC-48630 [0,1,0,0,0,0|1,0,0]=2 75 B4R0.2 NCCCN SC-16220 [0,1,0,0,0,0|1,0,0]=2 76 B1R0.1 B#N SC-19176 [2,0,0,0,0,0|2,0,0]=4 77 B1R0.1 [C-]#[Hf+] SC-19486 [2,0,0,0,0,0|1,0,1]=4 78 B1R0.1 [C-]#[SiH2+] SC-66877 [2,0,0,0,0,0|0,1,1]=4 79 B1R0.1 [C-]#[Zr+] SC-19026 [2,0,0,0,0,0|1,0,1]=4 80 B1R0.1 [O+]#[Si-] SC-65372 [2,0,0,0,0,0|0,2,0]=4 81 B3R0.2 C=C(C)Br SC-25629 [1,1,0,0,0,0|0,0,2]=4 82 B3R0.2 CB(O)O SC-73705 [1,1,0,0,0,0|1,1,0]=4 83 B3R0.2 CC(=O)Cl SC-18262 [1,1,0,0,0,0|0,1,1]=4 84 B3R0.2 CC(=O)O SC-18360 [1,1,0,0,0,0|0,1,1]=4 85 B3R0.2 CC(=O)[O-] SC-18378 [1,1,0,0,0,0|0,1,1]=4 86 B3R0.2 CC(=O)[O-] SC-18482 [1,1,0,0,0,0|0,1,1]=4 87 B3R0.2 CC(=O)[O-] SC-25242 [1,1,0,0,0,0|0,1,1]=4 88 B3R0.2 CC(=O)[O-] SC-27311 [1,1,0,0,0,0|0,1,1]=4 89 B3R0.2 CC(=O)[O-] SC-46276 [1,1,0,0,0,0|0,1,1]=4 90 B3R0.2 CC(=O)[O-] SC-46872 [1,1,0,0,0,0|0,1,1]=4 91 B3R0.2 CC(=O)[O-] SC-80851 [1,1,0,0,0,0|0,1,1]=4 92 B3R0.2 CC(=O)[O-] SC-81149 [1,1,0,0,0,0|0,1,1]=4 93 B3R0.2 CC(=O)[O-] SC-81231 [1,1,0,0,0,0|0,1,1]=4 94 B3R0.2 CC(=O)[O-] SC-81521 [1,1,0,0,0,0|0,1,1]=4 95 B3R0.2 CC(=S)S SC-49352 [1,1,0,0,0,0|0,0,1]=3 96 B3R0.2 CC(C)=O SC-20986 [1,1,0,0,0,0|0,0,1]=3 97 B3R0.2 CC(C)[O-] SC-15122 [1,1,0,0,0,0|0,0,0]=2 98 B3R0.2 CC(C)[O-] SC-25162 [1,1,0,0,0,0|0,0,0]=2 99 B3R0.2 CN(C)Br SC-53113 [1,1,0,0,0,0|1,0,0]=3 100 B3R0.2 CN(C)Cl SC-43613 [1,1,0,0,0,0|1,0,0]=3 101 B3R0.2 CP(C)Cl SC-48837 [1,1,0,0,0,0|1,0,0]=3 102 B3R0.2 C[S+](C)Br SC-73660 [1,1,0,0,0,0|1,0,0]=3 103 B3R0.2 C[SnH2+](C)C SC-49273 [1,1,0,0,0,0|1,0,0]=3 104 B3R0.2 ClC(Br)Br SC-57887 [1,1,0,0,0,0|2,0,0]=4 105 B5R0.1 C=C(C)CCI SC-35692 [0,2,0,0,0,0|1,0,0]=3 106 B5R0.1 C=CCC(C)O SC-49226 [0,2,0,0,0,0|1,0,0]=3 107 B5R0.1 CC(=O)NCO SC-19774 [0,2,0,0,0,0|0,1,1]=4 108 B5R0.1 CC(Br)CCN SC-40141 [0,2,0,0,0,0|1,0,0]=3 109 B5R0.1 CC(C)=CCBr SC-61636 [0,2,0,0,0,0|1,0,1]=4 110 B5R0.1 CC(N)CCN SC-66926 [0,2,0,0,0,0|1,0,0]=3 111 B5R0.1 CNCC(=O)[O-] SC-18610 [0,2,0,0,0,0|0,1,1]=4 112 B5R0.1 CNCC(C)N SC-66085 [0,2,0,0,0,0|1,0,0]=3 113 B5R0.1 COCC(=O)O SC-22928 [0,2,0,0,0,0|0,1,1]=4 114 B5R0.1 COCC(C)=O SC-81373 [0,2,0,0,0,0|0,1,1]=4 115 B5R0.1 COCC(C)=S SC-42217 [0,2,0,0,0,0|0,0,2]=4 116 B5R0.1 COC[C@H](C)N SC-43750 [0,2,0,0,0,0|0,1,0]=3 117 B5R0.1 COC[C@H](C)N SC-51779 [0,2,0,0,0,0|0,1,0]=3 118 B5R0.1 CSCC(=N)N SC-59669 [0,2,0,0,0,0|1,0,1]=4 119 B5R0.1 CSCC(N)=O SC-27108 [0,2,0,0,0,0|0,1,1]=4 120 B5R0.1 N=C(N)CCBr SC-59651 [0,2,0,0,0,0|1,0,1]=4 121 B5R0.1 N=C(N)CCCl SC-54448 [0,2,0,0,0,0|1,0,1]=4 122 B5R0.1 N=C(N)CCCl SC-58529 [0,2,0,0,0,0|1,0,1]=4 123 B5R0.1 N=C(N)CCN SC-69825 [0,2,0,0,0,0|1,0,1]=4 124 B5R0.1 O=C(O)CCF SC-53145 [0,2,0,0,0,0|0,1,1]=4 125 B5R0.3 C=C(CBr)CBr SC-43603 [0,2,0,0,0,0|1,0,1]=4 126 B5R0.3 C=CC(O)CBr SC-69913 [0,2,0,0,0,0|1,0,1]=4 127 B5R0.3 CC(CCl)CBr SC-62287 [0,2,0,0,0,0|1,0,0]=3 128 B5R0.3 CC(CN)CCl SC-40011 [0,2,0,0,0,0|1,0,0]=3 129 B5R0.3 CC(CN)CN SC-50225 [0,2,0,0,0,0|1,0,0]=3 130 B5R0.3 CC(CO)CO SC-20510 [0,2,0,0,0,0|0,1,0]=3 131 B5R0.3 CCC(=N)NO SC-56228 [0,2,0,0,0,0|0,1,1]=4 132 B5R0.3 CCC(=O)CN SC-94912 [0,2,0,0,0,0|1,0,0]=3 133 B5R0.3 CCC(C)CBr SC-79299 [0,2,0,0,0,0|1,0,0]=3 134 B5R0.3 CCC(O)CN SC-40219 [0,2,0,0,0,0|0,1,0]=3 135 B5R0.3 CCC(O)OC SC-25588 [0,2,0,0,0,0|0,1,0]=3 136 B5R0.3 CNC(=O)CCl SC-27694 [0,2,0,0,0,0|1,0,1]=4 137 B5R0.3 CNC(=O)CO SC-48574 [0,2,0,0,0,0|0,1,1]=4 138 B5R0.3 COC(C)CO SC-97662 [0,2,0,0,0,0|0,1,0]=3 139 B5R0.3 NCC(Br)CBr SC-40146 [0,2,0,0,0,0|1,0,0]=3 140 B5R0.3 NCC(Cl)CCl SC-40268 [0,2,0,0,0,0|1,0,0]=3 141 B5R0.3 NCC(O)CN SC-80923 [0,2,0,0,0,0|1,0,0]=3 142 B5R0.3 NC[C@H](O)CO SC-45873 [0,2,0,0,0,0|0,1,0]=3 143 B5R0.3 O=C(CF)CF SC-49840 [0,2,0,0,0,0|1,0,1]=4 144 B5R0.3 O=CC(O)CO SC-54496 [0,2,0,0,0,0|0,1,1]=4 145 B5R0.3 OC[C@H](O)CCl SC-05684 [0,2,0,0,0,0|0,1,0]=3 146 B5R0.4 C=CC(C)(C)N SC-36956 [0,2,0,0,0,0|1,0,1]=4 147 B5R0.4 CC(C)(C)CN SC-22562 [0,2,0,0,0,0|1,0,0]=3 148 B5R0.4 CC(C)(C)NN SC-54873 [0,2,0,0,0,0|2,0,0]=4 149 B5R0.4 CCC(C)(C)I SC-70421 [0,2,0,0,0,0|1,0,0]=3 150 B5R0.4 CC[N+](C)(C)[O-] SC-20985 [0,2,0,0,0,0|1,1,0]=4 151 B5R0.4 CNC(C)(C)C SC-89153 [0,2,0,0,0,0|2,0,0]=4 152 B5R0.4 C[Si](C)(C)CO SC-58225 [0,2,0,0,0,0|0,2,0]=4 153 B5R0.4 NCC(Cl)(Cl)Cl SC-40297 [0,2,0,0,0,0|2,0,0]=4 154 B5R0.4 OCC(Cl)(Cl)Cl SC-16089 [0,2,0,0,0,0|1,1,0]=4 155 B5R0.5 CC(=O)C(C)Br SC-44476 [0,2,0,0,0,0|0,1,1]=4 156 B5R0.5 CC(=S)C(C)S SC-42614 [0,2,0,0,0,0|0,0,1]=3 157 B5R0.5 CC(C)C(C)N SC-27570 [0,2,0,0,0,0|1,0,0]=3 158 B5R0.5 CC(Cl)C(=N)N SC-39558 [0,2,0,0,0,0|1,0,1]=4 159 B5R0.5 CC(Cl)C(N)=O SC-50401 [0,2,0,0,0,0|0,1,1]=4 160 B5R0.5 CC(O)C(=O)O SC-15841 [0,2,0,0,0,0|0,1,1]=4 161 B5R0.5 CC(O)C(=O)O SC-18578 [0,2,0,0,0,0|0,1,1]=4 162 B5R0.5 CC(O)C(=O)[O-] SC-15837 [0,2,0,0,0,0|0,1,1]=4 163 B5R0.5 CC(O)C(=O)[O-] SC-18033 [0,2,0,0,0,0|0,1,1]=4 164 B5R0.5 CC(O)C(=O)[O-] SC-46260 [0,2,0,0,0,0|0,1,1]=4 165 B5R0.5 FC(Cl)C(F)Cl SC-54139 [0,2,0,0,0,0|2,0,0]=4 166 B5R0.5 [C@@H](C)(N)C(N)=O SC-22084 [0,2,0,0,0,0|0,1,1]=4 167 B5R0.2 BrCCCCBr SC-00339 [0,2,0,0,0,0|1,0,0]=3 168 B5R0.2 BrC\C=C/CBr SC-52925 [0,2,0,0,0,0|1,0,1]=4 169 B5R0.2 BrC\C=C\CBr SC-77851 [0,2,0,0,0,0|1,0,1]=4 170 B5R0.2 C#CCOCCl SC-52165 [0,2,0,0,0,0|1,0,1]=4 171 B5R0.2 C=CCCC#N SC-71297 [0,2,0,0,0,0|1,0,1]=4 172 B5R0.2 C=CCCC=C SC-65418 [0,2,0,0,0,0|1,0,1]=4 173 B5R0.2 C=CCCC=C SC-91437 [0,2,0,0,0,0|1,0,1]=4 174 B5R0.2 C=COCCC SC-13613 [0,2,0,0,0,0|0,1,0]=3 175 B5R0.2 CCC#CCO SC-65673 [0,2,0,0,0,0|0,1,0]=3 176 B5R0.2 CCCCNN SC-40662 [0,2,0,0,0,0|1,0,0]=3 177 B5R0.2 CCCCNN SC-41028 [0,2,0,0,0,0|1,0,0]=3 178 B5R0.2 CCCN=C=S SC-74675 [0,2,0,0,0,0|0,0,1]=3 179 B5R0.2 CCCNCC SC-02236 [0,2,0,0,0,0|1,0,0]=3 180 B5R0.2 CCNCCN SC-50818 [0,2,0,0,0,0|1,0,0]=3 181 B5R0.2 CCOCCN SC-47824 [0,2,0,0,0,0|1,0,0]=3 182 B5R0.2 CCSCCBr SC-16797 [0,2,0,0,0,0|1,0,0]=3 183 B5R0.2 CCSCCN SC-65401 [0,2,0,0,0,0|1,0,0]=3 184 B5R0.2 COCCCO SC-01427 [0,2,0,0,0,0|0,1,0]=3 185 B5R0.2 CSCCCO SC-54096 [0,2,0,0,0,0|0,0,0]=2 186 B5R0.2 C\C=C/OCC SC-15783 [0,2,0,0,0,0|1,0,1]=4 187 B5R0.2 NCCCCBr SC-39791 [0,2,0,0,0,0|1,0,0]=3 188 B5R0.2 NCCCCF SC-25718 [0,2,0,0,0,0|1,0,0]=3 189 B5R0.2 NC\C=C\CO SC-22303 [0,2,0,0,0,0|0,1,1]=4 190 B5R0.2 OCCCCCl SC-17604 [0,2,0,0,0,0|0,1,0]=3 191 B5R1.2 ClC1CNC1 SC-43920 [0,1,0,1,0,0|1,0,0]=3 192 B5R1.3 CC[C@H]1CO1 SC-21973 [0,1,0,1,0,0|0,1,0]=3 193 B5R1.3 OCC1CS1 SC-70773 [0,1,0,1,0,0|0,0,0]=2 194 B5R1.4 CC1CC1N SC-88485 [0,1,0,1,0,0|1,0,0]=3 195 B5R1.1 C1=COCC1 SC-22656 [0,1,0,1,0,0|0,1,1]=4 196 B5R1.1 C1CNCN1 SC-97431 [0,1,0,1,0,0|1,0,0]=3