0 B5R0.1 C=C(C)CCI SC-35692 [0,0,0,0,0,0|1,0,2]=3 1 B5R0.1 C=CCC(C)O SC-49226 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.1 CC(=O)NCO SC-19774 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.1 CC(Br)CCN SC-40141 [0,0,0,0,0,0|1,0,0]=1 4 B5R0.1 CC(C)=CCBr SC-61636 [0,0,0,0,0,0|1,0,2]=3 5 B5R0.1 CC(N)CCN SC-66926 [0,0,0,0,0,0|1,0,0]=1 6 B5R0.1 CNCC(C)N SC-66085 [0,0,0,0,0,0|3,0,0]=3 7 B5R0.1 COCC(C)=O SC-81373 [0,0,0,0,0,0|3,0,1]=4 8 B5R0.1 COCC(C)=S SC-42217 [0,0,0,0,0,0|3,0,1]=4 9 B5R0.1 COC[C@H](C)N SC-43750 [0,0,0,0,0,0|3,0,0]=3 10 B5R0.1 COC[C@H](C)N SC-51779 [0,0,0,0,0,0|3,0,0]=3 11 B5R0.1 N=C(N)CCBr SC-59651 [0,0,0,0,0,0|3,0,1]=4 12 B5R0.1 N=C(N)CCCl SC-54448 [0,0,0,0,0,0|3,0,1]=4 13 B5R0.1 N=C(N)CCCl SC-58529 [0,0,0,0,0,0|3,0,1]=4 14 B5R0.1 N=C(N)CCN SC-69825 [0,0,0,0,0,0|2,0,1]=3 15 B5R0.1 O=C(O)CCF SC-53145 [0,0,0,0,0,0|3,0,1]=4 16 B4R0.1 C#CC(C)C SC-83017 [1,0,0,0,0,0|0,0,2]=3 17 B4R0.1 CC(=O)NN SC-16358 [1,0,0,0,0,0|2,0,1]=4 18 B4R0.1 CC(C)CBr SC-16381 [1,0,0,0,0,0|1,0,0]=2 19 B4R0.1 CC(Cl)CN SC-40273 [1,0,0,0,0,0|1,0,0]=2 20 B4R0.1 CCC(=N)N SC-39291 [1,0,0,0,0,0|2,0,1]=4 21 B4R0.1 CCN(C)C SC-05626 [1,0,0,0,0,0|1,0,0]=2 22 B4R0.1 C[C@@H](Cl)CO SC-70277 [1,0,0,0,0,0|2,0,0]=3 23 B4R0.1 N=C(N)CN SC-58417 [1,0,0,0,0,0|2,0,1]=4 24 B4R0.1 NCC(=O)O SC-26815 [1,0,0,0,0,0|2,0,1]=4 25 B4R0.1 NCC(Br)Br SC-40061 [1,0,0,0,0,0|2,0,0]=3 26 B4R0.1 NCC(Cl)Cl SC-40282 [1,0,0,0,0,0|2,0,0]=3 27 B4R0.2 C=CCCBr SC-17888 [1,0,0,0,0,0|1,0,2]=4 28 B4R0.2 C=CCNN SC-54870 [1,0,0,0,0,0|1,0,2]=4 29 B4R0.2 C=CCOC SC-62245 [1,0,0,0,0,0|2,0,1]=4 30 B4R0.2 CCCNN SC-66226 [1,0,0,0,0,0|1,0,0]=2 31 B4R0.2 CCCNN SC-88572 [1,0,0,0,0,0|1,0,0]=2 32 B4R0.2 CCCSC SC-88233 [1,0,0,0,0,0|2,0,0]=3 33 B4R0.2 CCNCC SC-25726 [1,0,0,0,0,0|2,0,0]=3 34 B4R0.2 CCOC=N SC-52423 [1,0,0,0,0,0|1,0,2]=4 35 B4R0.2 CC[NH2+]CC SC-20006 [1,0,0,0,0,0|2,0,0]=3 36 B4R0.2 CNCCO SC-26626 [1,0,0,0,0,0|2,0,0]=3 37 B4R0.2 COCC[O-] SC-67452 [1,0,0,0,0,0|2,0,0]=3 38 B4R0.2 CSCCN SC-40144 [1,0,0,0,0,0|1,0,0]=2 39 B4R0.2 C[SH+]CCCl SC-53966 [1,0,0,0,0,0|2,0,0]=3 40 B4R0.2 FCCCF SC-62358 [1,0,0,0,0,0|2,0,0]=3 41 B4R0.2 N#CCCS SC-66276 [1,0,0,0,0,0|1,0,2]=4 42 B4R0.2 NCCCCl SC-40009 [1,0,0,0,0,0|1,0,0]=2 43 B4R0.2 NCCCF SC-48630 [1,0,0,0,0,0|1,0,0]=2 44 B4R0.2 NCCCN SC-16220 [1,0,0,0,0,0|1,0,0]=2 45 B6R0.1 C=C(CCl)CCCl SC-29978 [0,1,0,0,0,0|1,0,2]=4 46 B6R0.1 C=CC[C@@H](O)CCl SC-30233 [0,1,0,0,0,0|2,0,1]=4 47 B6R0.1 C=CC[C@H](O)CCl SC-31067 [0,1,0,0,0,0|2,0,1]=4 48 B6R0.1 CCC(O)COC SC-95930 [0,1,0,0,0,0|3,0,0]=4 49 B6R0.1 CCCC(Br)CC SC-87780 [0,1,0,0,0,0|2,0,0]=3 50 B6R0.1 CCCC(C)NN SC-38965 [0,1,0,0,0,0|2,0,0]=3 51 B6R0.1 CCCC(O)CN SC-35839 [0,1,0,0,0,0|2,0,0]=3 52 B6R0.1 CCCC(O)CO SC-65083 [0,1,0,0,0,0|2,0,0]=3 53 B6R0.1 CCNC(C)CN SC-29669 [0,1,0,0,0,0|2,0,0]=3 54 B6R0.1 CC[C@@H](N)COC SC-48788 [0,1,0,0,0,0|3,0,0]=4 55 B6R0.1 CC[C@H](N)COC SC-48789 [0,1,0,0,0,0|3,0,0]=4 56 B6R0.1 CN(CO)CCO SC-42099 [0,1,0,0,0,0|2,0,0]=3 57 B6R0.1 COC(=O)CCCl SC-19880 [0,1,0,0,0,0|2,0,1]=4 58 B6R0.1 CSCC(C)NN SC-14209 [0,1,0,0,0,0|3,0,0]=4 59 B6R0.1 CSCC(N)CO SC-69757 [0,1,0,0,0,0|3,0,0]=4 60 B6R0.2 CC(C)CC(=N)N SC-40541 [0,1,0,0,0,0|0,0,1]=2 61 B6R0.2 CC(C)CC(C)Br SC-26522 [0,1,0,0,0,0|1,0,0]=2 62 B6R0.2 CC(O)CC(=O)[O-] SC-85388 [0,1,0,0,0,0|2,0,1]=4 63 B6R0.2 CN(C)CC(=O)O SC-09555 [0,1,0,0,0,0|2,0,1]=4 64 B6R0.2 CN(C)CC(=O)O SC-51828 [0,1,0,0,0,0|2,0,1]=4 65 B6R0.2 CN(C)CC(N)=S SC-62281 [0,1,0,0,0,0|1,0,1]=3 66 B6R0.2 CN(C)CN(C)C SC-65765 [0,1,0,0,0,0|3,0,0]=4 67 B6R0.2 C[C@H](O)C[C@H](C)O SC-06528 [0,1,0,0,0,0|2,0,0]=3 68 B6R0.2 [C@@H](C)(N)CC(=O)O SC-26546 [0,1,0,0,0,0|2,0,1]=4 69 B6R0.3 CC(Br)C(=O)NN SC-40152 [0,1,0,0,0,0|2,0,1]=4 70 B6R0.3 CC(C)C(=O)O[SiH3] SC-65279 [0,1,0,0,0,0|2,0,1]=4 71 B6R0.3 CC(CN)N(C)C SC-29496 [0,1,0,0,0,0|1,0,0]=2 72 B6R0.3 CC(Cl)C(=O)NN SC-39740 [0,1,0,0,0,0|2,0,1]=4 73 B6R0.3 CC(O)C(=O)CCl SC-52977 [0,1,0,0,0,0|2,0,1]=4 74 B6R0.3 CCC(=O)C(C)Br SC-52663 [0,1,0,0,0,0|2,0,1]=4 75 B6R0.3 CCC(=O)N(C)C SC-46819 [0,1,0,0,0,0|2,0,1]=4 76 B6R0.3 CN(C)C(=O)CN SC-48680 [0,1,0,0,0,0|1,0,1]=3 77 B6R0.3 C[C@H](O)[C@@H](N)CO SC-54023 [0,1,0,0,0,0|2,0,0]=3 78 B6R0.3 NC[C@H](N)C(=O)O SC-10204 [0,1,0,0,0,0|2,0,1]=4 79 B6R0.3 [C@H](O)(CN)C(=O)O SC-18368 [0,1,0,0,0,0|2,0,1]=4 80 B6R0.4 C=C(C)CCCBr SC-32900 [0,1,0,0,0,0|1,0,2]=4 81 B6R0.4 C=C(C)CCCO SC-14313 [0,1,0,0,0,0|1,0,2]=4 82 B6R0.4 C=COCC(C)C SC-19102 [0,1,0,0,0,0|1,0,1]=3 83 B6R0.4 CC(=O)NCCCl SC-49821 [0,1,0,0,0,0|2,0,1]=4 84 B6R0.4 CC(=O)OCCO SC-95931 [0,1,0,0,0,0|2,0,1]=4 85 B6R0.4 CC(Br)CCCBr SC-74609 [0,1,0,0,0,0|2,0,0]=3 86 B6R0.4 CC(C)=CCCO SC-52391 [0,1,0,0,0,0|1,0,1]=3 87 B6R0.4 CC(C)CCCO SC-67391 [0,1,0,0,0,0|1,0,0]=2 88 B6R0.4 CC(C)OCCN SC-47370 [0,1,0,0,0,0|0,0,0]=1 89 B6R0.4 CCCNC(C)C SC-50047 [0,1,0,0,0,0|1,0,0]=2 90 B6R0.4 NCCCC(F)F SC-25475 [0,1,0,0,0,0|2,0,0]=3 91 B6R0.5 C=CCC(C)(C)O SC-70433 [0,1,0,0,0,0|1,0,1]=3 92 B6R0.5 CC(C)(C)CCBr SC-47082 [0,1,0,0,0,0|1,0,0]=2 93 B6R0.5 CC(C)(C)CCO SC-05864 [0,1,0,0,0,0|1,0,0]=2 94 B6R0.5 CC(C)(C)N=C=S SC-54566 [0,1,0,0,0,0|2,0,1]=4 95 B6R0.5 COCC(C)(C)O SC-48938 [0,1,0,0,0,0|2,0,0]=3 96 B6R0.5 CSCC(C)(C)N SC-50334 [0,1,0,0,0,0|2,0,0]=3 97 B6R0.5 C[N+](C)(C)CCO SC-58008 [0,1,0,0,0,0|2,0,0]=3 98 B6R0.5 NCCS(=O)(=O)O SC-19115 [0,1,0,0,0,0|3,0,0]=4 99 B6R0.5 NCCS(N)(=O)=O SC-84191 [0,1,0,0,0,0|3,0,0]=4 100 B6R1.2 CC1CCOC1 SC-48311 [0,0,0,1,0,0|1,0,0]=2 101 B6R1.2 ClC1CCOC1 SC-47840 [0,0,0,1,0,0|2,0,0]=3 102 B6R1.2 NC1CCCC1 SC-26627 [0,0,0,1,0,0|2,0,0]=3 103 B6R1.2 O=C1CCSC1 SC-00014 [0,0,0,1,0,0|2,0,1]=4 104 B6R1.2 OC1CCSC1 SC-53391 [0,0,0,1,0,0|2,0,0]=3 105 B6R1.2 [C@@H]1(N)CCNC1 SC-00475 [0,0,0,1,0,0|1,0,0]=2 106 B6R1.2 [C@@H]1(N)CCNC1 SC-00476 [0,0,0,1,0,0|1,0,0]=2 107 B6R1.3 CCNC1CC1 SC-34607 [0,0,0,1,0,0|2,0,0]=3 108 B6R1.5 N[C@H]1C[C@@H](O)C1 SC-51721 [0,0,0,1,0,0|1,0,0]=2 109 B6R1.10 CC1(C)CCN1 SC-70092 [0,0,0,1,0,0|0,0,0]=1 110 B6R1.10 CC1(O)CNC1 SC-96329 [0,0,0,1,0,0|3,0,0]=4 111 B6R1.11 CC(=O)C1CO1 SC-70647 [0,0,0,1,0,0|2,0,1]=4 112 B6R1.11 CC(=S)C1CC1 SC-42755 [0,0,0,1,0,0|2,0,1]=4 113 B3R0.1 C#CCN SC-15923 [2,0,0,0,0,0|0,0,2]=4 114 B3R0.1 FCCF SC-58115 [2,0,0,0,0,0|2,0,0]=4 115 B3R0.1 ICCI SC-90216 [2,0,0,0,0,0|2,0,0]=4 116 B3R0.1 NCCBr SC-39967 [2,0,0,0,0,0|1,0,0]=3 117 B3R0.1 NCCI SC-40010 [2,0,0,0,0,0|1,0,0]=3 118 B3R0.1 OCCO SC-47188 [2,0,0,0,0,0|2,0,0]=4 119 B3R0.1 [Li]CCC SC-50170 [2,0,0,0,0,0|1,0,0]=3 120 B3R0.2 CC(C)=O SC-20986 [2,0,0,0,0,0|1,0,1]=4 121 B3R0.2 CC(C)[O-] SC-15122 [2,0,0,0,0,0|1,0,0]=3 122 B3R0.2 CC(C)[O-] SC-25162 [2,0,0,0,0,0|1,0,0]=3 123 B3R0.2 CN(C)Br SC-53113 [2,0,0,0,0,0|2,0,0]=4 124 B3R0.2 CN(C)Cl SC-43613 [2,0,0,0,0,0|2,0,0]=4 125 B3R0.2 CP(C)Cl SC-48837 [2,0,0,0,0,0|2,0,0]=4 126 B3R0.2 C[S+](C)Br SC-73660 [2,0,0,0,0,0|2,0,0]=4 127 B3R0.2 C[SnH2+](C)C SC-49273 [2,0,0,0,0,0|1,0,0]=3 128 B5R0.3 CC(CCl)CBr SC-62287 [1,1,0,0,0,0|1,0,0]=3 129 B5R0.3 CC(CN)CCl SC-40011 [1,1,0,0,0,0|0,0,0]=2 130 B5R0.3 CC(CN)CN SC-50225 [1,1,0,0,0,0|0,0,0]=2 131 B5R0.3 CC(CO)CO SC-20510 [1,1,0,0,0,0|1,0,0]=3 132 B5R0.3 CCC(=O)CN SC-94912 [1,1,0,0,0,0|1,0,1]=4 133 B5R0.3 CCC(C)CBr SC-79299 [1,1,0,0,0,0|0,0,0]=2 134 B5R0.3 CCC(O)CN SC-40219 [1,1,0,0,0,0|1,0,0]=3 135 B5R0.3 CCC(O)OC SC-25588 [1,1,0,0,0,0|1,0,0]=3 136 B5R0.3 COC(C)CO SC-97662 [1,1,0,0,0,0|1,0,0]=3 137 B5R0.3 NCC(Br)CBr SC-40146 [1,1,0,0,0,0|1,0,0]=3 138 B5R0.3 NCC(Cl)CCl SC-40268 [1,1,0,0,0,0|1,0,0]=3 139 B5R0.3 NCC(O)CN SC-80923 [1,1,0,0,0,0|1,0,0]=3 140 B5R0.3 NC[C@H](O)CO SC-45873 [1,1,0,0,0,0|1,0,0]=3 141 B5R0.3 OC[C@H](O)CCl SC-05684 [1,1,0,0,0,0|2,0,0]=4 142 B5R0.4 C=CC(C)(C)N SC-36956 [1,1,0,0,0,0|0,0,2]=4 143 B5R0.4 CC(C)(C)CN SC-22562 [1,1,0,0,0,0|0,0,0]=2 144 B5R0.4 CC(C)(C)NN SC-54873 [1,1,0,0,0,0|1,0,0]=3 145 B5R0.4 CCC(C)(C)I SC-70421 [1,1,0,0,0,0|0,0,0]=2 146 B5R0.4 CC[N+](C)(C)[O-] SC-20985 [1,1,0,0,0,0|1,0,0]=3 147 B5R0.4 CNC(C)(C)C SC-89153 [1,1,0,0,0,0|1,0,0]=3 148 B5R0.4 C[Si](C)(C)CO SC-58225 [1,1,0,0,0,0|1,1,0]=4 149 B5R0.4 NCC(Cl)(Cl)Cl SC-40297 [1,1,0,0,0,0|2,0,0]=4 150 B5R0.5 CC(=O)C(C)Br SC-44476 [1,1,0,0,0,0|1,0,1]=4 151 B5R0.5 CC(=S)C(C)S SC-42614 [1,1,0,0,0,0|1,0,1]=4 152 B5R0.5 CC(C)C(C)N SC-27570 [1,1,0,0,0,0|0,0,0]=2 153 B5R0.5 CC(Cl)C(=N)N SC-39558 [1,1,0,0,0,0|1,0,1]=4 154 B5R0.5 CC(Cl)C(N)=O SC-50401 [1,1,0,0,0,0|1,0,1]=4 155 B5R0.5 [C@@H](C)(N)C(N)=O SC-22084 [1,1,0,0,0,0|1,0,1]=4 156 B5R0.2 BrCCCCBr SC-00339 [1,1,0,0,0,0|1,0,0]=3 157 B5R0.2 C=COCCC SC-13613 [1,1,0,0,0,0|1,0,1]=4 158 B5R0.2 CCC#CCO SC-65673 [1,1,0,0,0,0|1,0,1]=4 159 B5R0.2 CCCCNN SC-40662 [1,1,0,0,0,0|0,0,0]=2 160 B5R0.2 CCCCNN SC-41028 [1,1,0,0,0,0|0,0,0]=2 161 B5R0.2 CCCN=C=S SC-74675 [1,1,0,0,0,0|1,0,1]=4 162 B5R0.2 CCCNCC SC-02236 [1,1,0,0,0,0|1,0,0]=3 163 B5R0.2 CCNCCN SC-50818 [1,1,0,0,0,0|0,0,0]=2 164 B5R0.2 CCOCCN SC-47824 [1,1,0,0,0,0|0,0,0]=2 165 B5R0.2 CCSCCBr SC-16797 [1,1,0,0,0,0|1,0,0]=3 166 B5R0.2 CCSCCN SC-65401 [1,1,0,0,0,0|0,0,0]=2 167 B5R0.2 COCCCO SC-01427 [1,1,0,0,0,0|1,0,0]=3 168 B5R0.2 CSCCCO SC-54096 [1,1,0,0,0,0|1,0,0]=3 169 B5R0.2 NCCCCBr SC-39791 [1,1,0,0,0,0|0,0,0]=2 170 B5R0.2 NCCCCF SC-25718 [1,1,0,0,0,0|0,0,0]=2 171 B5R0.2 NC\C=C\CO SC-22303 [1,1,0,0,0,0|0,0,2]=4 172 B5R0.2 OCCCCCl SC-17604 [1,1,0,0,0,0|1,0,0]=3 173 B7R0.2 CC(C)CC(C)NN SC-38647 [0,2,0,0,0,0|0,0,0]=2 174 B7R0.2 CC(C)C\C(N)=N/O SC-56230 [0,2,0,0,0,0|0,0,1]=3 175 B7R0.2 CC(CCl)CN(C)C SC-49474 [0,2,0,0,0,0|2,0,0]=4 176 B7R0.2 CC(CO)CN(C)C SC-49500 [0,2,0,0,0,0|2,0,0]=4 177 B7R0.2 CCC(O)CC(C)O SC-95923 [0,2,0,0,0,0|2,0,0]=4 178 B7R0.3 C=CCCC(C)CC SC-69778 [0,2,0,0,0,0|1,0,0]=3 179 B7R0.3 C=CCCC(O)CN SC-34956 [0,2,0,0,0,0|2,0,0]=4 180 B7R0.3 CSCCC(C)NN SC-38760 [0,2,0,0,0,0|2,0,0]=4 181 B7R0.3 CSCC[C@H](N)CO SC-08986 [0,2,0,0,0,0|2,0,0]=4 182 B7R0.5 CCC[C@@H](C)C(=O)O SC-43566 [0,2,0,0,0,0|1,0,1]=4 183 B7R0.5 CCC[C@H](C)C(=O)O SC-67603 [0,2,0,0,0,0|1,0,1]=4 184 B7R0.5 NCCC(O)C(=O)O SC-16245 [0,2,0,0,0,0|1,0,1]=4 185 B7R0.7 CCCC(C)CNN SC-42603 [0,2,0,0,0,0|1,0,0]=3 186 B7R0.7 CCCC(O)CCO SC-51686 [0,2,0,0,0,0|2,0,0]=4 187 B7R0.7 CCCN(C)CCC SC-85868 [0,2,0,0,0,0|2,0,0]=4 188 B7R0.7 COCC(C)COC SC-66246 [0,2,0,0,0,0|2,0,0]=4 189 B7R0.10 BrCC(Br)C(Br)CBr SC-58002 [0,2,0,0,0,0|2,0,0]=4 190 B7R0.10 CCC(C)C(C)NN SC-38614 [0,2,0,0,0,0|1,0,0]=3 191 B7R0.11 COCC(C)(C)CN SC-49388 [0,2,0,0,0,0|2,0,0]=4 192 B7R0.12 CCC(CC)CNN SC-59903 [0,2,0,0,0,0|1,0,0]=3 193 B7R0.12 CCN(CC)CCCl SC-77606 [0,2,0,0,0,0|2,0,0]=4 194 B7R0.12 CCN(CC)CCN SC-70938 [0,2,0,0,0,0|1,0,0]=3 195 B7R0.12 CCNC(CC)CN SC-29936 [0,2,0,0,0,0|2,0,0]=4 196 B7R0.12 COC(CCN)OC SC-40178 [0,2,0,0,0,0|0,0,0]=2 197 B7R0.9 CC(C)(C)CC(=O)O SC-22389 [0,2,0,0,0,0|1,0,1]=4 198 B7R0.9 CC(C)(O)CC(=N)N SC-13198 [0,2,0,0,0,0|0,0,1]=3 199 B7R0.9 CC(C)CS(N)(=O)=O SC-34991 [0,2,0,0,0,0|1,0,0]=3 200 B7R0.16 CC(C)C(O)C(=O)O SC-08874 [0,2,0,0,0,0|1,0,1]=4 201 B7R0.16 CC(C)N(C)C(C)C SC-52794 [0,2,0,0,0,0|2,0,0]=4 202 B7R0.16 CC(C)P(Cl)C(C)C SC-04272 [0,2,0,0,0,0|2,0,0]=4 203 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O SC-09895 [0,2,0,0,0,0|1,0,1]=4 204 B7R0.16 [C@@H](Cl)(C(=O)O)C(C)C SC-03021 [0,2,0,0,0,0|1,0,1]=4 205 B7R0.14 CC(C)(C)C(O)CN SC-34706 [0,2,0,0,0,0|0,0,0]=2 206 B7R0.14 CC(C)(C)[C@@H](N)CO SC-32092 [0,2,0,0,0,0|1,0,0]=3 207 B7R0.14 CC(C)(C)[C@H](N)CO SC-31514 [0,2,0,0,0,0|1,0,0]=3 208 B7R0.14 CCC(=O)C(C)(C)C SC-67983 [0,2,0,0,0,0|1,0,1]=4 209 B7R0.14 NCC(O)C(F)(F)F SC-35630 [0,2,0,0,0,0|2,0,0]=4 210 B7R0.15 CCC(CN)N(C)C SC-29729 [0,2,0,0,0,0|1,0,0]=3 211 B7R0.15 CCC(NN)C(C)C SC-39162 [0,2,0,0,0,0|1,0,0]=3 212 B7R0.4 CC(=O)NCCCN SC-51489 [0,2,0,0,0,0|1,0,1]=4 213 B7R0.4 CCCCCC(C)O SC-81258 [0,2,0,0,0,0|2,0,0]=4 214 B7R0.4 CN(C)CC#CCO SC-49122 [0,2,0,0,0,0|2,0,0]=4 215 B7R0.4 CN(C)CCCCBr SC-48986 [0,2,0,0,0,0|2,0,0]=4 216 B7R0.6 CC(=O)CCN(C)C SC-53808 [0,2,0,0,0,0|1,0,1]=4 217 B7R0.6 CC(C)CCC(C)O SC-53086 [0,2,0,0,0,0|1,0,0]=3 218 B7R0.6 CN(C)CCC(=N)N SC-40941 [0,2,0,0,0,0|1,0,0]=3 219 B7R0.6 CN(C)CCC(=O)O SC-84792 [0,2,0,0,0,0|2,0,0]=4 220 B7R0.6 CN(C)CCN(C)C SC-98070 [0,2,0,0,0,0|1,0,0]=3 221 B7R0.8 C=CCCC(C)(C)O SC-54598 [0,2,0,0,0,0|1,0,0]=3 222 B7R0.8 C=CCC[Si](C)(C)C SC-34310 [0,2,0,0,0,0|1,1,0]=4 223 B7R0.8 CC(C)(C)CN=C=O SC-52558 [0,2,0,0,0,0|1,0,1]=4 224 B7R0.8 CC(C)(C)CN=C=S SC-25293 [0,2,0,0,0,0|1,0,1]=4 225 B7R0.8 CC(C)(C)NCC#N SC-70732 [0,2,0,0,0,0|0,0,2]=4 226 B7R0.8 CC(C)(C)OCCO SC-21080 [0,2,0,0,0,0|1,0,0]=3 227 B7R0.8 CC(C)(C)SCCN SC-43870 [0,2,0,0,0,0|0,0,0]=2 228 B7R0.8 CP(=O)(O)CCCN SC-51052 [0,2,0,0,0,0|2,0,0]=4 229 B7R0.8 CS(=O)(=O)NCCN SC-50959 [0,2,0,0,0,0|2,0,0]=4 230 B5R1.2 ClC1CNC1 SC-43920 [1,0,0,1,0,0|1,0,0]=3 231 B5R1.3 CC[C@H]1CO1 SC-21973 [1,0,0,1,0,0|1,0,0]=3 232 B5R1.3 OCC1CS1 SC-70773 [1,0,0,1,0,0|2,0,0]=4 233 B5R1.4 CC1CC1N SC-88485 [1,0,0,1,0,0|0,0,0]=2 234 B5R1.1 C1CNCN1 SC-97431 [1,0,0,1,0,0|1,0,0]=3 235 B7R1.1 CNC1CCOC1 SC-14941 [0,1,0,1,0,0|1,0,0]=3 236 B7R1.1 CN[C@H]1CCNC1 SC-08954 [0,1,0,1,0,0|0,0,0]=2 237 B7R1.1 COC1CCCC1 SC-82890 [0,1,0,1,0,0|1,0,0]=3 238 B7R1.1 CO[C@H]1CCNC1 SC-51991 [0,1,0,1,0,0|0,0,0]=2 239 B7R1.1 ClCC1CCCC1 SC-52756 [0,1,0,1,0,0|1,0,0]=3 240 B7R1.1 ICC1CCCC1 SC-19498 [0,1,0,1,0,0|1,0,0]=3 241 B7R1.1 NCC1CCOC1 SC-35383 [0,1,0,1,0,0|1,0,0]=3 242 B7R1.1 NNC1CCSC1 SC-59920 [0,1,0,1,0,0|2,0,0]=4 243 B7R1.1 OCC1CCNC1 SC-19805 [0,1,0,1,0,0|0,0,0]=2 244 B7R1.1 OC[C@@H]1CCCO1 SC-68774 [0,1,0,1,0,0|2,0,0]=4 245 B7R1.2 CC1CCC(=O)N1 SC-89347 [0,1,0,1,0,0|2,0,0]=4 246 B7R1.2 CC1CCC(N)C1 SC-50487 [0,1,0,1,0,0|0,0,0]=2 247 B7R1.2 CC1CNC(=O)N1 SC-65644 [0,1,0,1,0,0|1,0,1]=4 248 B7R1.2 CC1CNC(=O)N1 SC-67475 [0,1,0,1,0,0|1,0,1]=4 249 B7R1.2 CC1CNC(C)C1 SC-69891 [0,1,0,1,0,0|0,0,0]=2 250 B7R1.2 CN1CC[C@H](N)C1 SC-66196 [0,1,0,1,0,0|1,0,0]=3 251 B7R1.2 C[C@@H]1CCC(=O)O1 SC-65777 [0,1,0,1,0,0|2,0,0]=4 252 B7R1.2 C[C@@H]1COC(=O)C1 SC-45465 [0,1,0,1,0,0|1,0,1]=4 253 B7R1.2 C[C@@H]1C[C@H](O)CN1 SC-51782 [0,1,0,1,0,0|1,0,0]=3 254 B7R1.2 C[C@H]1CCC(=O)O1 SC-86851 [0,1,0,1,0,0|2,0,0]=4 255 B7R1.2 NC1CCC(O)C1 SC-45420 [0,1,0,1,0,0|1,0,0]=3 256 B7R1.2 NC1CNC(=O)C1 SC-68325 [0,1,0,1,0,0|1,0,1]=4 257 B7R1.2 NN1CCC(O)C1 SC-29741 [0,1,0,1,0,0|1,0,0]=3 258 B7R1.2 N[C@H]1CNC(=O)C1 SC-52716 [0,1,0,1,0,0|1,0,1]=4 259 B7R1.2 OC1CCC(O)C1 SC-66165 [0,1,0,1,0,0|2,0,0]=4 260 B7R1.3 BrC1CCCNC1 SC-24227 [0,1,0,1,0,0|1,0,0]=3 261 B7R1.3 CC1CNCCN1 SC-46321 [0,1,0,1,0,0|0,0,0]=2 262 B7R1.3 CC1OCCCO1 SC-49961 [0,1,0,1,0,0|2,0,0]=4 263 B7R1.3 CN1CC=CCC1 SC-20668 [0,1,0,1,0,0|2,0,0]=4 264 B7R1.3 CN1CC=CCC1 SC-43820 [0,1,0,1,0,0|2,0,0]=4 265 B7R1.3 CN1CCOCC1 SC-47177 [0,1,0,1,0,0|2,0,0]=4 266 B7R1.3 C[C@@H]1CCCCN1 SC-66098 [0,1,0,1,0,0|1,0,0]=3 267 B7R1.3 C[C@@H]1CNCCN1 SC-16922 [0,1,0,1,0,0|0,0,0]=2 268 B7R1.3 C[C@@H]1COCCN1 SC-53986 [0,1,0,1,0,0|1,0,0]=3 269 B7R1.3 ClC1CCNCC1 SC-24517 [0,1,0,1,0,0|1,0,0]=3 270 B7R1.3 FC1CCNCC1 SC-43923 [0,1,0,1,0,0|1,0,0]=3 271 B7R1.3 OC1CCCNC1 SC-06015 [0,1,0,1,0,0|1,0,0]=3 272 B7R1.3 OC1CCNCC1 SC-45566 [0,1,0,1,0,0|1,0,0]=3 273 B7R1.4 CC1CCCC1=S SC-42934 [0,1,0,1,0,0|1,0,1]=4 274 B7R1.4 CC1CCCC1N SC-71052 [0,1,0,1,0,0|1,0,0]=3 275 B7R1.4 ClC1CCOC1Cl SC-62355 [0,1,0,1,0,0|2,0,0]=4 276 B7R1.4 NC1CCCC1N SC-66238 [0,1,0,1,0,0|2,0,0]=4 277 B7R1.4 NC1CCNC1=O SC-48795 [0,1,0,1,0,0|1,0,1]=4 278 B7R1.4 NC1CCNC1=O SC-51089 [0,1,0,1,0,0|1,0,1]=4 279 B7R1.4 N[C@@H]1CCC[C@@H]1O SC-27358 [0,1,0,1,0,0|2,0,0]=4 280 B7R1.4 O=C1NCC[C@@H]1O SC-21960 [0,1,0,1,0,0|1,0,1]=4 281 B7R1.4 O[C@H]1COC[C@H]1O SC-49236 [0,1,0,1,0,0|2,0,0]=4 282 B7R1.4 [C@H]1(N)CCC[C@@H]1O SC-20046 [0,1,0,1,0,0|2,0,0]=4 283 B7R1.5 CC1CC1CNN SC-60063 [0,1,0,1,0,0|0,0,0]=2 284 B7R1.6 CCNC1CNC1 SC-70012 [0,1,0,1,0,0|2,0,0]=4 285 B7R1.6 COCC1CNC1 SC-89956 [0,1,0,1,0,0|2,0,0]=4 286 B7R1.6 N#CCC1CCC1 SC-39102 [0,1,0,1,0,0|0,0,2]=4 287 B7R1.10 CCN1CC(N)C1 SC-48560 [0,1,0,1,0,0|1,0,0]=3 288 B7R1.10 NC1CC(CO)C1 SC-88222 [0,1,0,1,0,0|0,0,0]=2 289 B7R1.10 NC[C@H]1C[C@@H](O)C1 SC-52916 [0,1,0,1,0,0|1,0,0]=3 290 B7R1.10 OCC1CC(F)C1 SC-25285 [0,1,0,1,0,0|1,0,0]=3 291 B7R1.22 CC(NN)C1CC1 SC-39260 [0,1,0,1,0,0|1,0,0]=3 292 B7R1.22 COC(=O)C1CN1 SC-43747 [0,1,0,1,0,0|1,0,1]=4 293 B7R1.22 NCC(O)C1CC1 SC-35505 [0,1,0,1,0,0|0,0,0]=2 294 B7R1.25 CC1(CO)CNC1 SC-67286 [0,1,0,1,0,0|2,0,0]=4 295 B7R1.12 CC1CC1C(=O)Cl SC-60998 [0,1,0,1,0,0|1,0,1]=4 296 B7R1.12 CC1CC1C(=O)O SC-71058 [0,1,0,1,0,0|1,0,1]=4 297 B7R1.16 C[C@]1(O)C[C@@H](N)C1 SC-52969 [0,1,0,1,0,0|0,0,0]=2 298 B7R1.20 N=C(N)CC1CC1 SC-40484 [0,1,0,1,0,0|0,0,1]=3 299 B7R1.7 N#CCCN1CC1 SC-40382 [0,1,0,1,0,0|1,0,1]=4 300 B7R1.14 CC1(N)CCCC1 SC-38076 [0,1,0,1,0,0|1,0,0]=3 301 B7R1.14 CC1(O)CCCC1 SC-26720 [0,1,0,1,0,0|1,0,0]=3 302 B7R1.26 CC(C)(O)C1CC1 SC-22018 [0,1,0,1,0,0|1,0,0]=3