0 B5R0.1 C=C(Br)CCO CS-0204881 [0,0,0,0,0,0|1,1,2]=4 1 B5R0.1 C=C(C)CCCl CS-0685201 [0,0,0,0,0,0|1,0,2]=3 2 B5R0.1 C=C(C)CCN CS-0204885 [0,0,0,0,0,0|1,0,2]=3 3 B5R0.1 C=C(C)CNN CS-0742042 [0,0,0,0,0,0|2,0,2]=4 4 B5R0.1 CC#CC(C)=O CS-0245459 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.1 CC(=O)CCBr CS-0162440 [0,0,0,0,0,0|2,0,1]=3 6 B5R0.1 CC(=O)OCI CS-0943067 [0,0,0,0,0,0|3,0,0]=3 7 B5R0.1 CC(=O)\C=C\N CS-0250051 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.1 CC(C)=CCN CS-0434630 [0,0,0,0,0,0|1,0,0]=1 9 B5R0.1 CC(N)CCN CS-0262681 [0,0,0,0,0,0|2,0,2]=4 10 B5R0.1 CC(O)CCCl CS-0959567 [0,0,0,0,0,0|2,0,2]=4 11 B5R0.1 CCSC(C)=O CS-0206289 [0,0,0,0,0,0|3,0,0]=3 12 B5R0.1 CN(C)CCI CS-0524227 [0,0,0,0,0,0|2,0,1]=3 13 B5R0.1 CN(C)CCO CS-W009541 [0,0,0,0,0,0|1,1,1]=3 14 B5R0.1 CS(=O)CCN CS-0762173 [0,0,0,0,0,0|3,0,1]=4 15 B5R0.1 C[C@@H](O)CCN CS-0113150 [0,0,0,0,0,0|2,0,2]=4 16 B5R0.1 C[NH+](C)CC[NH3+] CS-0214071 [0,0,0,0,0,0|2,0,1]=3 17 B5R0.1 C\C(I)=C\CI CS-0503683 [0,0,0,0,0,0|2,0,0]=2 18 B5R0.1 N=C(N)CCO CS-0570174 [0,0,0,0,0,0|2,1,1]=4 19 B5R0.1 N=C(N)CCO CS-0698343 [0,0,0,0,0,0|2,1,1]=4 20 B5R0.1 NC(=O)NCO CS-0719447 [0,0,0,0,0,0|3,1,0]=4 21 B5R0.1 NCCC(=O)O CS-0214063 [0,0,0,0,0,0|3,0,1]=4 22 B5R0.1 NCCC(N)=O CS-0465599 [0,0,0,0,0,0|3,0,1]=4 23 B5R0.1 OCC=C(Cl)Cl CS-0962787 [0,0,0,0,0,0|2,1,0]=3 24 B4R0.1 C=C(Br)CN CS-0251869 [1,0,0,0,0,0|2,0,1]=4 25 B4R0.1 C=C[C@H](C)N CS-0196819 [1,0,0,0,0,0|1,0,2]=4 26 B4R0.1 CC(O)CN CS-0466165 [1,0,0,0,0,0|2,0,1]=4 27 B4R0.1 CC(S)CN CS-0231499 [1,0,0,0,0,0|2,0,1]=4 28 B4R0.1 CCS(C)=O CS-0772381 [1,0,0,0,0,0|2,0,1]=4 29 B4R0.1 CNC(=S)[S-] CS-0370878 [1,0,0,0,0,0|3,0,0]=4 30 B4R0.1 C[C@@H](N)CN CS-0341700 [1,0,0,0,0,0|2,0,1]=4 31 B4R0.1 N=C(N)CBr CS-0694615 [1,0,0,0,0,0|3,0,0]=4 32 B4R0.1 N=C(N)CF CS-0336061 [1,0,0,0,0,0|3,0,0]=4 33 B4R0.1 N=C(N)CN CS-0112951 [1,0,0,0,0,0|3,0,0]=4 34 B4R0.1 NC(=S)CF CS-0233322 [1,0,0,0,0,0|3,0,0]=4 35 B4R0.1 NCC(=O)O CS-0468679 [1,0,0,0,0,0|3,0,0]=4 36 B4R0.1 NCC(N)=S CS-0225666 [1,0,0,0,0,0|3,0,0]=4 37 B4R0.1 O=C(O)CS CS-0620475 [1,0,0,0,0,0|2,0,0]=3 38 B4R0.2 C=C=CCN CS-0695978 [1,0,0,0,0,0|1,0,2]=4 39 B4R0.2 CC#CCI CS-0233903 [1,0,0,0,0,0|1,0,2]=4 40 B4R0.2 CCCNC CS-0312281 [1,0,0,0,0,0|2,0,1]=4 41 B4R0.2 CCNCC CS-0214083 [1,0,0,0,0,0|2,0,1]=4 42 B4R0.2 COCCN CS-0468680 [1,0,0,0,0,0|2,0,1]=4 43 B4R0.2 OC\C=C\Cl CS-0224631 [1,0,0,0,0,0|1,1,0]=3 44 B6R0.1 CCC(C)CCCl CS-0257596 [0,1,0,0,0,0|1,0,2]=4 45 B6R0.1 CCCC(=O)CO CS-0239089 [0,1,0,0,0,0|2,0,1]=4 46 B6R0.1 CCCC(=O)SC CS-0323899 [0,1,0,0,0,0|2,0,1]=4 47 B6R0.1 CCCC(C)CBr CS-0296949 [0,1,0,0,0,0|1,0,2]=4 48 B6R0.1 CCCC(C)CCl CS-0621759 [0,1,0,0,0,0|1,0,2]=4 49 B6R0.1 CCNC(=O)CN CS-0213253 [0,1,0,0,0,0|3,0,0]=4 50 B6R0.1 CCNC(C)CC CS-0441021 [0,1,0,0,0,0|2,0,1]=4 51 B6R0.1 CCOC(=O)NC CS-0187425 [0,1,0,0,0,0|3,0,0]=4 52 B6R0.1 CCOC(C)CN CS-0148791 [0,1,0,0,0,0|2,0,1]=4 53 B6R0.1 CN[C@@H](C)CCO CS-0802797 [0,1,0,0,0,0|0,1,2]=4 54 B6R0.1 CN[C@H](C)CCO CS-0858605 [0,1,0,0,0,0|0,1,2]=4 55 B6R0.1 COC(=O)\C=C/Cl CS-0963707 [0,1,0,0,0,0|2,0,1]=4 56 B6R0.1 CSC(C)CCO CS-0242025 [0,1,0,0,0,0|0,1,2]=4 57 B6R0.1 C[C@H](CO)CCO CS-0197580 [0,1,0,0,0,0|0,1,2]=4 58 B6R0.1 N[C@H](CS)CCS CS-0146136 [0,1,0,0,0,0|1,0,2]=4 59 B6R0.1 O=C(CO)CCO CS-0734935 [0,1,0,0,0,0|1,1,1]=4 60 B6R0.2 CC(=O)\C=C(/C)N CS-0970843 [0,1,0,0,0,0|1,1,1]=4 61 B6R0.2 CC(C)=CC(N)=O CS-0237253 [0,1,0,0,0,0|0,1,1]=3 62 B6R0.2 CC(C)CC(C)N CS-0171946 [0,1,0,0,0,0|1,0,2]=4 63 B6R0.2 C[C@H](N)CN(C)C CS-0159972 [0,1,0,0,0,0|2,0,1]=4 64 B6R0.3 C=C(C)C(=O)CC CS-0245128 [0,1,0,0,0,0|1,0,1]=3 65 B6R0.3 CC(=O)C(=O)CCl CS-0239555 [0,1,0,0,0,0|2,0,0]=3 66 B6R0.3 CC(=O)C(C)CO CS-0132490 [0,1,0,0,0,0|1,1,1]=4 67 B6R0.3 CC(C)C(=O)CCl CS-0187851 [0,1,0,0,0,0|1,0,1]=3 68 B6R0.3 CC(C)C(C)CO CS-0752023 [0,1,0,0,0,0|0,1,2]=4 69 B6R0.3 CC(C)C(O)CO CS-0965839 [0,1,0,0,0,0|0,1,2]=4 70 B6R0.3 CC(CN)N(C)C CS-0159970 [0,1,0,0,0,0|2,0,1]=4 71 B6R0.3 CCC(=O)C(C)O CS-0242252 [0,1,0,0,0,0|2,0,1]=4 72 B6R0.3 CCN(C)C(C)=O CS-0187586 [0,1,0,0,0,0|3,0,0]=4 73 B6R0.3 CC[C@H](N)C(C)C CS-0215629 [0,1,0,0,0,0|1,0,2]=4 74 B6R0.3 CSC(=S)N(C)C CS-0504482 [0,1,0,0,0,0|3,0,0]=4 75 B6R0.3 N[C@@H](CS)C(=O)O CS-0516218 [0,1,0,0,0,0|2,0,1]=4 76 B6R0.4 C#CCCC(C)=O CS-0225157 [0,1,0,0,0,0|2,0,1]=4 77 B6R0.4 C=C(C)CCCBr CS-0217088 [0,1,0,0,0,0|1,0,2]=4 78 B6R0.4 C=C(C)CCCO CS-0132697 [0,1,0,0,0,0|0,1,2]=4 79 B6R0.4 C=CCNC(C)=O CS-0224602 [0,1,0,0,0,0|3,0,0]=4 80 B6R0.4 CC(=O)CCC#N CS-0237576 [0,1,0,0,0,0|2,0,1]=4 81 B6R0.4 CC(=O)SCC#N CS-0110092 [0,1,0,0,0,0|3,0,0]=4 82 B6R0.4 CC(C)CCON CS-0072030 [0,1,0,0,0,0|0,1,2]=4 83 B6R0.4 CC(C)NCC#N CS-0251174 [0,1,0,0,0,0|2,0,1]=4 84 B6R0.4 CC(C)NCC#N CS-0433313 [0,1,0,0,0,0|2,0,1]=4 85 B6R0.4 CC(C)OCC#N CS-0265172 [0,1,0,0,0,0|2,0,1]=4 86 B6R0.4 CC(C)SCCO CS-0317867 [0,1,0,0,0,0|0,1,2]=4 87 B6R0.4 CC(C)\C=C\CBr CS-0225920 [0,1,0,0,0,0|1,0,1]=3 88 B6R0.4 CCC#CC(C)=O CS-0214885 [0,1,0,0,0,0|2,0,1]=4 89 B6R0.4 CNCCC(C)=O CS-0119661 [0,1,0,0,0,0|2,0,1]=4 90 B6R0.4 COCCC(C)=O CS-0250048 [0,1,0,0,0,0|1,1,1]=4 91 B6R0.4 NC\C=C\C(=O)O CS-0201665 [0,1,0,0,0,0|3,0,0]=4 92 B6R0.4 O=C(O)\C=C\CO CS-0020662 [0,1,0,0,0,0|2,1,0]=4 93 B6R0.5 CC(C)(O)CCI CS-0233321 [0,1,0,0,0,0|1,0,2]=4 94 B6R0.5 C[Si](C)(C)CCN CS-0309063 [0,1,0,0,0,0|1,1,1]=4 95 B6R1.2 CC1=NSN=C1 CS-0331746 [0,0,0,1,0,0|2,0,0]=3 96 B6R1.2 CC1CCNC1 CS-0451382 [0,0,0,1,0,0|1,0,2]=4 97 B6R1.2 CC1COCO1 CS-0204301 [0,0,0,1,0,0|1,1,1]=4 98 B6R1.2 ClC1=NSC=C1 CS-0446031 [0,0,0,1,0,0|2,0,1]=4 99 B6R1.2 N=C1CCCS1 CS-0615573 [0,0,0,1,0,0|3,0,0]=4 100 B6R1.2 NC1=CSC=C1 CS-0183285 [0,0,0,1,0,0|1,0,2]=4 101 B6R1.2 NC1=CSN=C1 CS-0049320 [0,0,0,1,0,0|2,0,1]=4 102 B6R1.2 NC1CCSC1 CS-0046717 [0,0,0,1,0,0|1,0,2]=4 103 B6R1.2 O=C1CNCN1 CS-0361636 [0,0,0,1,0,0|3,0,0]=4 104 B6R1.2 O[C@@H]1CCSC1 CS-0171629 [0,0,0,1,0,0|1,0,2]=4 105 B6R1.2 SC1=CSC=C1 CS-0215996 [0,0,0,1,0,0|1,0,2]=4 106 B6R1.2 SC1CCSC1 CS-0232805 [0,0,0,1,0,0|1,0,2]=4 107 B6R1.3 Br\C=C\C1CC1 CS-0682792 [0,0,0,1,0,0|1,0,2]=4 108 B6R1.5 CC1CC(=O)N1 CS-0046688 [0,0,0,1,0,0|3,0,0]=4 109 B6R1.5 CC1CC(O)C1 CS-0055823 [0,0,0,1,0,0|0,1,2]=4 110 B6R1.5 C[C@@H]1C[C@@H](C)N1 CS-0434799 [0,0,0,1,0,0|2,0,1]=4 111 B6R1.5 C[C@H]1C[C@@H](C)N1 CS-0517867 [0,0,0,1,0,0|2,0,1]=4 112 B6R1.5 C[C@H]1C[C@@H](N)C1 CS-0049698 [0,0,0,1,0,0|1,0,2]=4 113 B6R1.5 C[C@H]1C[C@H](C)N1 CS-0162351 [0,0,0,1,0,0|2,0,1]=4 114 B6R1.8 CC1CC1CBr CS-0266125 [0,0,0,1,0,0|1,0,2]=4 115 B6R1.8 CC1CC1CO CS-0251356 [0,0,0,1,0,0|0,1,2]=4 116 B6R1.8 C[C@H]1C[C@H]1CO CS-0183080 [0,0,0,1,0,0|0,1,2]=4 117 B6R1.9 CC1(C)CC1N CS-0071402 [0,0,0,1,0,0|1,0,2]=4 118 B6R1.10 CC1(C)CCN1 CS-0057135 [0,0,0,1,0,0|1,0,2]=4 119 B3R0.1 C[Te][Te]C CS-0771445 [2,0,0,0,0,0|2,0,0]=4 120 B3R0.2 CC(=N)N CS-0180936 [2,0,0,0,0,0|2,0,0]=4 121 B3R0.2 CC(=O)O CS-1154102 [2,0,0,0,0,0|1,1,0]=4 122 B3R0.2 CC(=O)[O-] CS-0459253 [2,0,0,0,0,0|1,1,0]=4 123 B3R0.2 CC(=O)[O-] CS-0870965 [2,0,0,0,0,0|1,1,0]=4 124 B3R0.2 CC(C)O CS-1046195 [2,0,0,0,0,0|0,1,1]=4 125 B3R0.2 CN(C)O CS-0757536 [2,0,0,0,0,0|1,1,0]=4 126 B5R0.3 C=C(SC)SC CS-0622227 [1,1,0,0,0,0|1,0,1]=4 127 B5R0.3 CC(CI)CI CS-0512528 [1,1,0,0,0,0|1,0,1]=4 128 B5R0.3 CC(CN)CCl CS-0038279 [1,1,0,0,0,0|1,0,1]=4 129 B5R0.3 CC(CN)CN CS-0168145 [1,1,0,0,0,0|1,0,1]=4 130 B5R0.3 CNC(C)CO CS-0522344 [1,1,0,0,0,0|0,1,1]=4 131 B5R0.3 CN[C@H](C)CO CS-0697577 [1,1,0,0,0,0|0,1,1]=4 132 B5R0.3 CSC(=O)SC CS-0015824 [1,1,0,0,0,0|2,0,0]=4 133 B5R0.3 C[C@@H](CN)CO CS-0231467 [1,1,0,0,0,0|0,1,1]=4 134 B5R0.3 NCC(=O)CN CS-0181766 [1,1,0,0,0,0|2,0,0]=4 135 B5R0.3 NC\C(Cl)=C\Cl CS-0244984 [1,1,0,0,0,0|2,0,0]=4 136 B5R0.3 NNC(=O)CS CS-0524226 [1,1,0,0,0,0|2,0,0]=4 137 B5R0.4 CC(C)(N)CBr CS-0044806 [1,1,0,0,0,0|1,0,1]=4 138 B5R0.4 CC(C)(N)CF CS-0030310 [1,1,0,0,0,0|1,0,1]=4 139 B5R0.4 CC(C)(N)CO CS-0660148 [1,1,0,0,0,0|0,1,1]=4 140 B5R0.4 CP(C)(=O)CCl CS-0224734 [1,1,0,0,0,0|2,0,0]=4 141 B5R0.4 CSC(C)(C)C CS-0326865 [1,1,0,0,0,0|1,0,1]=4 142 B5R0.4 C[Si](C)(C)CBr CS-0196909 [1,1,0,0,0,0|1,1,0]=4 143 B5R0.5 C=C(C)C(=O)[O-] CS-0448042 [1,1,0,0,0,0|0,1,1]=4 144 B5R0.5 CC(=N)N(C)C CS-0231575 [1,1,0,0,0,0|1,0,0]=3 145 B5R0.5 CC(=O)N(C)C CS-0858406 [1,1,0,0,0,0|1,0,0]=3 146 B5R0.5 CC(=O)N(C)N CS-0535170 [1,1,0,0,0,0|2,0,0]=4 147 B5R0.5 CN(C)C(=S)[S-] CS-0187344 [1,1,0,0,0,0|1,0,1]=4 148 B5R0.2 CCO\C=C/Br CS-0037281 [1,1,0,0,0,0|2,0,0]=4 149 B5R0.2 CNCCSC CS-0039272 [1,1,0,0,0,0|1,0,1]=4 150 B5R0.2 CNCCSC CS-0713670 [1,1,0,0,0,0|1,0,1]=4 151 B5R0.2 C\C=C\CCBr CS-0245338 [1,1,0,0,0,0|1,0,0]=3 152 B5R0.2 N#C\C=C\CBr CS-0308157 [1,1,0,0,0,0|1,0,1]=4 153 B7R0.2 CC(C)NC(=O)CBr CS-0153998 [0,2,0,0,0,0|1,0,1]=4 154 B7R0.2 CC(C)NC(=O)CI CS-0365091 [0,2,0,0,0,0|1,0,1]=4 155 B7R0.2 CC(C)NC(=O)CN CS-0245520 [0,2,0,0,0,0|1,0,1]=4 156 B7R0.2 CCC(=O)CC(C)C CS-0205108 [0,2,0,0,0,0|1,0,1]=4 157 B7R0.2 CC\C(C)=C\C(=O)O CS-0006550 [0,2,0,0,0,0|0,1,1]=4 158 B7R0.2 CO\C(C)=C\C(C)=O CS-0517157 [0,2,0,0,0,0|0,1,1]=4 159 B7R0.3 CNC(=O)CCSC CS-0258625 [0,2,0,0,0,0|1,0,1]=4 160 B7R0.3 COC(=O)\C=C/CBr CS-0369102 [0,2,0,0,0,0|2,0,0]=4 161 B7R0.3 COC(=O)\C=C\CN CS-0457830 [0,2,0,0,0,0|2,0,0]=4 162 B7R0.5 CCCC(=O)C(C)C CS-0204265 [0,2,0,0,0,0|1,0,1]=4 163 B7R0.5 CCCC(=O)N(C)C CS-0322484 [0,2,0,0,0,0|2,0,0]=4 164 B7R0.5 CN(C)C(=O)CON CS-0238328 [0,2,0,0,0,0|1,1,0]=4 165 B7R0.5 CN(C)C(=O)OCCl CS-0139165 [0,2,0,0,0,0|2,0,0]=4 166 B7R0.7 CCC\C(C)=C\CO CS-0258444 [0,2,0,0,0,0|0,1,0]=3 167 B7R0.10 C=C(CC)C(=O)OC CS-0080800 [0,2,0,0,0,0|2,0,0]=4 168 B7R0.10 CCC(C)C(=O)CCl CS-0230637 [0,2,0,0,0,0|1,0,1]=4 169 B7R0.10 O=C(CS)C(=O)O[Na] CS-0231406 [0,2,0,0,0,0|2,0,0]=4 170 B7R0.10 OC\C(Br)=C(/Br)CO CS-0887438 [0,2,0,0,0,0|1,1,0]=4 171 B7R0.16 CC(Br)C(=O)N(C)C CS-0205313 [0,2,0,0,0,0|2,0,0]=4 172 B7R0.16 CC(C)=C(C)C(=O)O CS-0229947 [0,2,0,0,0,0|0,1,1]=4 173 B7R0.16 CC(C)=C(F)C(=O)O CS-0231240 [0,2,0,0,0,0|0,1,1]=4 174 B7R0.16 CC(N)C(=O)N(C)C CS-0272242 [0,2,0,0,0,0|2,0,0]=4 175 B7R0.16 CC(O)C(=O)N(C)C CS-0451515 [0,2,0,0,0,0|1,1,0]=4 176 B7R0.14 CC(C)(C)C(=O)CN CS-0183436 [0,2,0,0,0,0|1,0,1]=4 177 B7R0.6 CC(C)=CCC(=O)O CS-0453086 [0,2,0,0,0,0|0,1,0]=3 178 B7R0.8 CSCCC(C)(C)N CS-0698712 [0,2,0,0,0,0|0,0,2]=4 179 B5R1.4 C[C@@H]1C[C@H]1N CS-0197605 [1,0,0,1,0,0|1,0,1]=4 180 B5R1.4 C[C@H]1C[C@@H]1N CS-0214194 [1,0,0,1,0,0|1,0,1]=4 181 B5R1.4 C[C@H]1C[C@H]1N CS-0462910 [1,0,0,1,0,0|1,0,1]=4 182 B7R1.1 CCC1=CCCC1 CS-0449911 [0,1,0,1,0,0|1,0,0]=3 183 B7R1.1 NCC1=CCCC1 CS-0234177 [0,1,0,1,0,0|1,0,0]=3 184 B7R1.1 NCC1=NSC=C1 CS-0054865 [0,1,0,1,0,0|1,0,1]=4 185 B7R1.1 NCC1CCSC1 CS-0238070 [0,1,0,1,0,0|0,0,2]=4 186 B7R1.1 OCC1=CCCC1 CS-0234175 [0,1,0,1,0,0|1,0,0]=3 187 B7R1.1 OCC1=CSN=C1 CS-0378941 [0,1,0,1,0,0|1,0,1]=4 188 B7R1.2 CC1=CC(=O)SC1 CS-0282195 [0,1,0,1,0,0|0,0,1]=3 189 B7R1.2 CC1=COC(S)=N1 CS-0061363 [0,1,0,1,0,0|1,0,1]=4 190 B7R1.2 CC1=CSC(N)=C1 CS-0330230 [0,1,0,1,0,0|0,0,2]=4 191 B7R1.2 CC1=NSC(N)=C1 CS-0013032 [0,1,0,1,0,0|1,0,1]=4 192 B7R1.2 O=C1C=C[C@H](O)C1 CS-0113091 [0,1,0,1,0,0|1,1,0]=4 193 B7R1.3 BrC1=CCCNC1 CS-0341834 [0,1,0,1,0,0|2,0,0]=4 194 B7R1.3 CC1=CCNCC1 CS-0183605 [0,1,0,1,0,0|1,0,0]=3 195 B7R1.3 CN1CCSCC1 CS-0667426 [0,1,0,1,0,0|1,0,1]=4 196 B7R1.3 ClC1=CCCCC1 CS-0722835 [0,1,0,1,0,0|2,0,0]=4 197 B7R1.4 CC1=C(C)NC=C1 CS-0113700 [0,1,0,1,0,0|1,0,1]=4 198 B7R1.4 CC1=C(C)OC=C1 CS-0204333 [0,1,0,1,0,0|0,1,1]=4 199 B7R1.4 CC1=CNN=C1C CS-0211301 [0,1,0,1,0,0|2,0,0]=4 200 B7R1.4 CC1=NSC=C1N CS-0453433 [0,1,0,1,0,0|1,0,1]=4 201 B7R1.4 CC1COCC1=O CS-0566067 [0,1,0,1,0,0|0,1,1]=4 202 B7R1.4 CC1CSCC1=O CS-0309330 [0,1,0,1,0,0|0,0,1]=3 203 B7R1.4 CN1CCCC1=N CS-0231733 [0,1,0,1,0,0|2,0,0]=4 204 B7R1.6 OCC=C1CCC1 CS-0232584 [0,1,0,1,0,0|0,1,0]=3 205 B7R1.22 NCC(=O)C1CC1 CS-0139185 [0,1,0,1,0,0|1,0,1]=4 206 B7R1.20 O=C(O)C=C1CC1 CS-0265215 [0,1,0,1,0,0|0,1,1]=4