0 B4R0.2 C=CCCBr SC-17888 [0,0,0,0,0,0|3,0,0]=3 1 B4R0.2 C=CCNN SC-54870 [0,0,0,0,0,0|4,0,0]=4 2 B4R0.2 C=CCOC SC-62245 [0,0,0,0,0,0|3,0,0]=3 3 B4R0.2 CCCNN SC-66226 [0,0,0,0,0,0|3,0,0]=3 4 B4R0.2 CCCNN SC-88572 [0,0,0,0,0,0|3,0,0]=3 5 B4R0.2 CCCSC SC-88233 [0,0,0,0,0,0|3,0,0]=3 6 B4R0.2 CCNCC SC-25726 [0,0,0,0,0,0|2,0,1]=3 7 B4R0.2 CCOC=N SC-52423 [0,0,0,0,0,0|1,0,0]=1 8 B4R0.2 CC[NH2+]CC SC-20006 [0,0,0,0,0,0|2,0,1]=3 9 B4R0.2 CNCCO SC-26626 [0,0,0,0,0,0|2,0,2]=4 10 B4R0.2 COCC[O-] SC-67452 [0,0,0,0,0,0|2,0,2]=4 11 B4R0.2 CSCCN SC-40144 [0,0,0,0,0,0|3,0,1]=4 12 B4R0.2 C[SH+]CCCl SC-53966 [0,0,0,0,0,0|3,0,1]=4 13 B4R0.2 FCCCF SC-62358 [0,0,0,0,0,0|3,0,1]=4 14 B4R0.2 N#CCCS SC-66276 [0,0,0,0,0,0|3,0,1]=4 15 B4R0.2 NCCCCl SC-40009 [0,0,0,0,0,0|3,0,1]=4 16 B4R0.2 NCCCF SC-48630 [0,0,0,0,0,0|3,0,1]=4 17 B4R0.2 NCCCN SC-16220 [0,0,0,0,0,0|3,0,1]=4 18 B4R0.2 O=[Er]O[Er]=O SC-54378 [0,0,0,0,0,0|3,0,0]=3 19 B3R0.1 C#CCCl SC-15922 [1,0,0,0,0,0|2,0,1]=4 20 B3R0.1 C#CCN SC-15923 [1,0,0,0,0,0|2,0,1]=4 21 B3R0.1 CC#CI SC-88621 [1,0,0,0,0,0|1,0,2]=4 22 B3R0.1 COC=O SC-19116 [1,0,0,0,0,0|0,0,0]=1 23 B3R0.1 Cl\C=C\Cl SC-65915 [1,0,0,0,0,0|2,0,1]=4 24 B3R0.1 FCCF SC-58115 [1,0,0,0,0,0|2,0,1]=4 25 B3R0.1 ICCI SC-90216 [1,0,0,0,0,0|2,0,1]=4 26 B3R0.1 NCCBr SC-39967 [1,0,0,0,0,0|2,0,1]=4 27 B3R0.1 NCCI SC-40010 [1,0,0,0,0,0|2,0,1]=4 28 B3R0.1 O=CC=O SC-19118 [1,0,0,0,0,0|1,0,1]=3 29 B3R0.1 OCCO SC-47188 [1,0,0,0,0,0|1,0,2]=4 30 B3R0.1 [Li]CCC SC-50170 [1,0,0,0,0,0|1,0,1]=3 31 B5R0.1 C=C(C)CCI SC-35692 [0,1,0,0,0,0|3,0,0]=4 32 B5R0.1 C=CCC(C)O SC-49226 [0,1,0,0,0,0|2,0,0]=3 33 B5R0.1 CC(=O)NCO SC-19774 [0,1,0,0,0,0|2,0,0]=3 34 B5R0.1 CC(=O)\C=N\O SC-51367 [0,1,0,0,0,0|3,0,0]=4 35 B5R0.1 CC(Br)CCN SC-40141 [0,1,0,0,0,0|2,0,1]=4 36 B5R0.1 CC(C)=CCBr SC-61636 [0,1,0,0,0,0|3,0,0]=4 37 B5R0.1 CC(N)CCN SC-66926 [0,1,0,0,0,0|2,0,1]=4 38 B5R0.1 CNCC(=O)[O-] SC-18610 [0,1,0,0,0,0|2,0,0]=3 39 B5R0.1 CNCC(C)N SC-66085 [0,1,0,0,0,0|3,0,0]=4 40 B5R0.1 COCC(=O)O SC-22928 [0,1,0,0,0,0|2,0,0]=3 41 B5R0.1 COCC(C)=O SC-81373 [0,1,0,0,0,0|2,0,0]=3 42 B5R0.1 COCC(C)=S SC-42217 [0,1,0,0,0,0|2,1,0]=4 43 B5R0.1 COC[C@H](C)N SC-43750 [0,1,0,0,0,0|3,0,0]=4 44 B5R0.1 COC[C@H](C)N SC-51779 [0,1,0,0,0,0|3,0,0]=4 45 B5R0.1 CSCC(=N)N SC-59669 [0,1,0,0,0,0|3,0,0]=4 46 B5R0.1 CSCC(N)=O SC-27108 [0,1,0,0,0,0|2,0,0]=3 47 B5R0.1 C\C=C\C(=O)Cl SC-24539 [0,1,0,0,0,0|1,0,1]=3 48 B5R0.1 C\C=C\[N+](=O)[O-] SC-65946 [0,1,0,0,0,0|2,0,1]=4 49 B5R0.1 N#C[N-]C(N)=O SC-89055 [0,1,0,0,0,0|2,0,1]=4 50 B5R0.1 N=C(N)CCBr SC-59651 [0,1,0,0,0,0|3,0,0]=4 51 B5R0.1 N=C(N)CCCl SC-54448 [0,1,0,0,0,0|3,0,0]=4 52 B5R0.1 N=C(N)CCCl SC-58529 [0,1,0,0,0,0|3,0,0]=4 53 B5R0.1 N=C(N)CCN SC-69825 [0,1,0,0,0,0|3,0,0]=4 54 B5R0.1 O=C(O)CCF SC-53145 [0,1,0,0,0,0|2,0,0]=3 55 B5R0.2 BrCCCCBr SC-00339 [0,1,0,0,0,0|2,0,1]=4 56 B5R0.2 BrC\C=C/CBr SC-52925 [0,1,0,0,0,0|3,0,0]=4 57 B5R0.2 BrC\C=C\CBr SC-77851 [0,1,0,0,0,0|3,0,0]=4 58 B5R0.2 C#CCN=C=O SC-66030 [0,1,0,0,0,0|1,0,2]=4 59 B5R0.2 C#CCOCCl SC-52165 [0,1,0,0,0,0|1,0,2]=4 60 B5R0.2 C=CCCC#N SC-71297 [0,1,0,0,0,0|2,0,1]=4 61 B5R0.2 C=CCCC=C SC-65418 [0,1,0,0,0,0|2,0,1]=4 62 B5R0.2 C=CCCC=C SC-91437 [0,1,0,0,0,0|2,0,1]=4 63 B5R0.2 C=COCCC SC-13613 [0,1,0,0,0,0|1,0,0]=2 64 B5R0.2 CCC#CCO SC-65673 [0,1,0,0,0,0|1,0,2]=4 65 B5R0.2 CCCCNN SC-40662 [0,1,0,0,0,0|2,0,1]=4 66 B5R0.2 CCCCNN SC-41028 [0,1,0,0,0,0|2,0,1]=4 67 B5R0.2 CCCN=C=S SC-74675 [0,1,0,0,0,0|1,1,1]=4 68 B5R0.2 CCCNCC SC-02236 [0,1,0,0,0,0|2,0,1]=4 69 B5R0.2 CCNCCN SC-50818 [0,1,0,0,0,0|2,0,1]=4 70 B5R0.2 CCOCCN SC-47824 [0,1,0,0,0,0|1,0,1]=3 71 B5R0.2 CCSCCBr SC-16797 [0,1,0,0,0,0|1,1,1]=4 72 B5R0.2 CCSCCN SC-65401 [0,1,0,0,0,0|1,1,1]=4 73 B5R0.2 COCCCO SC-01427 [0,1,0,0,0,0|1,0,2]=4 74 B5R0.2 CSCCCO SC-54096 [0,1,0,0,0,0|1,0,2]=4 75 B5R0.2 C\C=C/OCC SC-15783 [0,1,0,0,0,0|1,0,0]=2 76 B5R0.2 NCCCCBr SC-39791 [0,1,0,0,0,0|2,0,1]=4 77 B5R0.2 NCCCCF SC-25718 [0,1,0,0,0,0|2,0,1]=4 78 B5R0.2 NC\C=C\CO SC-22303 [0,1,0,0,0,0|2,0,1]=4 79 B5R0.2 O=CNNC=O SC-87631 [0,1,0,0,0,0|2,0,1]=4 80 B5R0.2 OCCCCCl SC-17604 [0,1,0,0,0,0|1,0,2]=4 81 B5R0.3 C=CC(O)CBr SC-69913 [0,1,0,0,0,0|3,0,0]=4 82 B5R0.3 CCC(=N)NO SC-56228 [0,1,0,0,0,0|2,0,1]=4 83 B5R0.3 CCC(=O)CN SC-94912 [0,1,0,0,0,0|2,0,1]=4 84 B5R0.3 CCC(C)CBr SC-79299 [0,1,0,0,0,0|2,0,1]=4 85 B5R0.3 CCC(O)CN SC-40219 [0,1,0,0,0,0|2,0,1]=4 86 B5R0.3 CCC(O)OC SC-25588 [0,1,0,0,0,0|3,0,0]=4 87 B5R0.3 O=CC(O)CO SC-54496 [0,1,0,0,0,0|2,0,0]=3 88 B5R1.1 C1=CCC=C1 SC-49087 [0,0,0,1,0,0|2,0,1]=4 89 B5R1.1 C1=COCC1 SC-22656 [0,0,0,1,0,0|1,0,0]=2 90 B5R1.1 C1CNCN1 SC-97431 [0,0,0,1,0,0|2,0,1]=4 91 B5R1.3 CC[C@H]1CO1 SC-21973 [0,0,0,1,0,0|1,0,2]=4 92 B5R1.4 CC1CC1N SC-88485 [0,0,0,1,0,0|2,0,1]=4 93 B2R0.1 C=CO SC-48882 [2,0,0,0,0,0|1,0,0]=3 94 B2R0.1 CC[O-] SC-19450 [2,0,0,0,0,0|0,0,1]=3 95 B2R0.1 CC[O-] SC-67115 [2,0,0,0,0,0|0,0,1]=3 96 B2R0.1 CC[S-] SC-53724 [2,0,0,0,0,0|0,1,0]=3 97 B2R0.1 NCN SC-53958 [2,0,0,0,0,0|2,0,0]=4 98 B2R0.1 O=B[O-] SC-79389 [2,0,0,0,0,0|1,0,1]=4 99 B2R0.1 O=B[O-] SC-79498 [2,0,0,0,0,0|1,0,1]=4 100 B2R0.1 O=C[O-] SC-18403 [2,0,0,0,0,0|0,0,1]=3 101 B2R0.1 O=C[O-] SC-27162 [2,0,0,0,0,0|0,0,1]=3 102 B2R0.1 O=C[O-] SC-80003 [2,0,0,0,0,0|0,0,1]=3 103 B2R0.1 O=C[O-] SC-81757 [2,0,0,0,0,0|0,0,1]=3 104 B2R0.1 O=P[O-] SC-18223 [2,0,0,0,0,0|1,0,1]=4 105 B2R0.1 O=[Se]=O SC-18268 [2,0,0,0,0,0|1,0,1]=4 106 B2R0.1 O=[Si]=O SC-25876 [2,0,0,0,0,0|0,1,1]=4 107 B2R0.1 [Li]CC SC-69937 [2,0,0,0,0,0|1,0,0]=3 108 B4R0.1 C#CC(C)C SC-83017 [1,1,0,0,0,0|1,0,1]=4 109 B4R0.1 C=C(Cl)CCl SC-62204 [1,1,0,0,0,0|2,0,0]=4 110 B4R0.1 C=C(N)OC SC-01201 [1,1,0,0,0,0|1,0,0]=3 111 B4R0.1 C=CC(=O)Cl SC-18188 [1,1,0,0,0,0|0,0,2]=4 112 B4R0.1 C=CC(=O)[O-] SC-80823 [1,1,0,0,0,0|0,0,2]=4 113 B4R0.1 CC(=O)NN SC-16358 [1,1,0,0,0,0|2,0,0]=4 114 B4R0.1 CC(C)CBr SC-16381 [1,1,0,0,0,0|1,0,1]=4 115 B4R0.1 CC(Cl)CN SC-40273 [1,1,0,0,0,0|1,0,1]=4 116 B4R0.1 CCC(=N)N SC-39291 [1,1,0,0,0,0|1,0,0]=3 117 B4R0.1 CCN(C)C SC-05626 [1,1,0,0,0,0|1,0,1]=4 118 B4R0.1 COC(=N)N SC-46936 [1,1,0,0,0,0|1,0,0]=3 119 B4R0.1 COC(=N)N SC-65775 [1,1,0,0,0,0|1,0,0]=3 120 B4R0.1 COC(=O)[O-] SC-65186 [1,1,0,0,0,0|0,0,0]=2 121 B4R0.1 COC(N)=O SC-46315 [1,1,0,0,0,0|0,0,0]=2 122 B4R0.1 COC(N)=[NH2+] SC-15893 [1,1,0,0,0,0|1,0,0]=3 123 B4R0.1 C[C@@H](Cl)CO SC-70277 [1,1,0,0,0,0|0,0,2]=4 124 B4R0.1 N=C(N)CF SC-40566 [1,1,0,0,0,0|2,0,0]=4 125 B4R0.1 N=C(N)CN SC-58417 [1,1,0,0,0,0|2,0,0]=4 126 B4R0.1 NCC(=O)O SC-26815 [1,1,0,0,0,0|1,0,0]=3 127 B4R0.1 O=C(Cl)CCl SC-18214 [1,1,0,0,0,0|1,0,0]=3 128 B4R0.1 O=C(O)CO SC-85771 [1,1,0,0,0,0|1,0,0]=3 129 B4R0.1 O=C([O-])CBr SC-50549 [1,1,0,0,0,0|1,0,0]=3 130 B4R0.1 O=C([O-])CO SC-89096 [1,1,0,0,0,0|1,0,0]=3 131 B6R0.1 C=CC(=O)OCC SC-19398 [0,2,0,0,0,0|0,0,0]=2 132 B6R0.1 C=CC[C@@H](O)CCl SC-30233 [0,2,0,0,0,0|2,0,0]=4 133 B6R0.1 C=CC[C@H](O)CCl SC-31067 [0,2,0,0,0,0|2,0,0]=4 134 B6R0.1 CC#CC(=O)NN SC-50891 [0,2,0,0,0,0|1,0,1]=4 135 B6R0.1 COC(=O)CCCl SC-19880 [0,2,0,0,0,0|2,0,0]=4 136 B6R0.2 C=C(C)CC(=O)O SC-31698 [0,2,0,0,0,0|1,0,1]=4 137 B6R0.2 CC(=O)CC(C)=O SC-68118 [0,2,0,0,0,0|1,0,1]=4 138 B6R0.2 CC(=O)NC(N)=O SC-87858 [0,2,0,0,0,0|1,0,1]=4 139 B6R0.2 CC(=O)[CH-]C(C)=O SC-19438 [0,2,0,0,0,0|1,0,1]=4 140 B6R0.2 CC(C)CC(=N)N SC-40541 [0,2,0,0,0,0|2,0,0]=4 141 B6R0.2 CC(O)CC(=O)[O-] SC-85388 [0,2,0,0,0,0|1,0,0]=3 142 B6R0.2 CN(C)CC(=O)O SC-09555 [0,2,0,0,0,0|2,0,0]=4 143 B6R0.2 CN(C)CC(=O)O SC-51828 [0,2,0,0,0,0|2,0,0]=4 144 B6R0.2 [C@@H](C)(N)CC(=O)O SC-26546 [0,2,0,0,0,0|1,0,0]=3 145 B6R0.3 CC(=O)C(=O)CBr SC-66140 [0,2,0,0,0,0|2,0,0]=4 146 B6R0.3 CCC(C)C(=N)N SC-40567 [0,2,0,0,0,0|2,0,0]=4 147 B6R0.3 CCC(C)C(=O)O SC-22738 [0,2,0,0,0,0|1,0,0]=3 148 B6R0.3 CCC(Cl)C(=O)O SC-96228 [0,2,0,0,0,0|1,0,0]=3 149 B6R0.3 CCC(O)C(=N)N SC-41904 [0,2,0,0,0,0|2,0,0]=4 150 B6R0.3 CCC(O)C(=O)O SC-88990 [0,2,0,0,0,0|1,0,0]=3 151 B6R0.3 CCN(C)C(=O)Cl SC-18616 [0,2,0,0,0,0|1,0,0]=3 152 B6R0.3 CC[C@@H](Cl)C(=O)O SC-52915 [0,2,0,0,0,0|1,0,0]=3 153 B6R0.3 NC(=O)C(N)CO SC-53653 [0,2,0,0,0,0|2,0,0]=4 154 B6R0.3 NC[C@H](N)C(=O)O SC-10204 [0,2,0,0,0,0|2,0,0]=4 155 B6R0.3 N[C@@H](CCl)C(=O)O SC-21241 [0,2,0,0,0,0|2,0,0]=4 156 B6R0.3 N[C@@H](CS)C(=O)O SC-09429 [0,2,0,0,0,0|2,0,0]=4 157 B6R0.3 [C@H](O)(CN)C(=O)O SC-18368 [0,2,0,0,0,0|2,0,0]=4 158 B6R0.4 C=C(C)CCCBr SC-32900 [0,2,0,0,0,0|2,0,0]=4 159 B6R0.4 C=C(C)CCCO SC-14313 [0,2,0,0,0,0|2,0,0]=4 160 B6R0.4 C=CCNC(C)=O SC-48071 [0,2,0,0,0,0|1,0,1]=4 161 B6R0.4 C=COCC(C)C SC-19102 [0,2,0,0,0,0|1,0,0]=3 162 B6R0.4 CC(=O)NCCCl SC-49821 [0,2,0,0,0,0|1,0,0]=3 163 B6R0.4 CC(=O)OCCO SC-95931 [0,2,0,0,0,0|0,0,0]=2 164 B6R0.4 CC(C)=CCCO SC-52391 [0,2,0,0,0,0|2,0,0]=4 165 B6R0.4 CC(C)=NNC=O SC-26098 [0,2,0,0,0,0|1,0,1]=4 166 B6R0.4 CC(C)OCCN SC-47370 [0,2,0,0,0,0|1,0,1]=4 167 B6R0.4 CCCOC(=O)Cl SC-19101 [0,2,0,0,0,0|0,0,0]=2 168 B6R0.4 COCCC(=N)N SC-40396 [0,2,0,0,0,0|2,0,0]=4 169 B6R0.4 N#CCCC(=O)O SC-49854 [0,2,0,0,0,0|1,0,1]=4 170 B6R0.4 N=C(N)CCCBr SC-59652 [0,2,0,0,0,0|2,0,0]=4 171 B6R0.4 N=C(N)CCCCl SC-55395 [0,2,0,0,0,0|2,0,0]=4 172 B6R0.4 N=C(N)CCCO SC-70213 [0,2,0,0,0,0|2,0,0]=4 173 B6R0.4 N=C(N)NCCO SC-60351 [0,2,0,0,0,0|2,0,0]=4 174 B6R0.4 NC(=O)CCCO SC-12258 [0,2,0,0,0,0|1,0,0]=3 175 B6R0.4 O=C(Cl)OCCF SC-53156 [0,2,0,0,0,0|0,0,0]=2 176 B6R0.4 O=C(O)CCCBr SC-02994 [0,2,0,0,0,0|1,0,0]=3 177 B6R0.5 C=CCC(C)(C)O SC-70433 [0,2,0,0,0,0|2,0,0]=4 178 B6R0.5 CCCS(=O)(=O)Cl SC-26826 [0,2,0,0,0,0|2,0,0]=4 179 B6R0.5 CCOP(=S)(Cl)Cl SC-84035 [0,2,0,0,0,0|1,1,0]=4 180 B6R0.6 C=CCCCC=O SC-34117 [0,2,0,0,0,0|1,0,0]=3 181 B6R0.6 C=CCCCCN SC-34878 [0,2,0,0,0,0|2,0,0]=4 182 B6R0.6 C=CCCCCO SC-44461 [0,2,0,0,0,0|2,0,0]=4 183 B6R0.6 C=CCCCC[Zn+] SC-89392 [0,2,0,0,0,0|2,0,0]=4 184 B6R0.6 C=CCOCCI SC-50512 [0,2,0,0,0,0|1,0,0]=3 185 B6R0.6 C=CCOCCO SC-25613 [0,2,0,0,0,0|1,0,0]=3 186 B6R0.6 CCOCCCN SC-74768 [0,2,0,0,0,0|1,0,1]=4 187 B6R0.6 COCCCC=O SC-88270 [0,2,0,0,0,0|1,0,0]=3 188 B6R0.6 ClCCOCCCl SC-19085 [0,2,0,0,0,0|1,0,1]=4 189 B6R0.6 N#CCOCCN SC-51422 [0,2,0,0,0,0|1,0,1]=4 190 B6R0.6 NCCOCCCl SC-88571 [0,2,0,0,0,0|1,0,1]=4 191 B6R0.6 O=C=NCCCCl SC-77667 [0,2,0,0,0,0|1,0,1]=4 192 B6R0.6 OCCOCCCl SC-25834 [0,2,0,0,0,0|0,0,2]=4 193 B6R1.2 CC1CCOC1 SC-48311 [0,1,0,1,0,0|1,0,1]=4 194 B6R1.2 ClC1CCOC1 SC-47840 [0,1,0,1,0,0|1,0,1]=4 195 B6R1.2 O=C1CCON1 SC-95997 [0,1,0,1,0,0|0,0,0]=2 196 B6R1.2 O=C1CCSC1 SC-00014 [0,1,0,1,0,0|0,1,0]=3 197 B6R1.2 O=C1OCCO1 SC-46725 [0,1,0,1,0,0|0,0,0]=2 198 B6R1.2 S=C1C=CCC1 SC-42975 [0,1,0,1,0,0|1,1,0]=4 199 B6R1.11 CC(=O)C1CO1 SC-70647 [0,1,0,1,0,0|2,0,0]=4 200 B6R1.11 CC(=S)C1CC1 SC-42755 [0,1,0,1,0,0|1,1,0]=4 201 B6R1.11 O=C(O)C1CS1 SC-70775 [0,1,0,1,0,0|2,0,0]=4 202 B6R1.6 ICC1CCO1 SC-48435 [0,1,0,1,0,0|1,0,1]=4