0 B5R0.1 C=CC[C@H](C)O OR304051 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.1 CC(C)=CCBr OR46013 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.1 CC(C)=CCCl OR22167 [0,0,0,0,0,0|2,0,2]=4 3 B5R0.1 CC(C)=C[Mg]Br OR320001 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.1 CC(C)=C[Mg]Cl OR320002 [0,0,0,0,0,0|3,0,1]=4 5 B5R0.1 CC(C)CC#N OR52674 [0,0,0,0,0,0|2,0,1]=3 6 B5R0.1 CC(C)CCI OR8220 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.1 CC(C)CCN OR12816 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.1 CC(C)CCO OR460021 [0,0,0,0,0,0|1,1,1]=3 9 B5R0.1 CC(C)CNN OR0203 [0,0,0,0,0,0|3,0,0]=3 10 B5R0.1 CC(C)C[Mg]Br OR52618 [0,0,0,0,0,0|3,0,0]=3 11 B5R0.1 CC(C)N=C=S OR30306 [0,0,0,0,0,0|0,0,0]=0 12 B5R0.1 CC(O)CC#N OR2847 [0,0,0,0,0,0|3,0,1]=4 13 B5R0.1 CCCC(C)N OR10075 [0,0,0,0,0,0|3,0,1]=4 14 B5R0.1 CN(C)CCN OR6514 [0,0,0,0,0,0|3,0,1]=4 15 B5R0.1 C[C@@H](O)CCO OR2223 [0,0,0,0,0,0|2,1,1]=4 16 B4R0.1 C#CC(C)O OR01834 [1,0,0,0,0,0|2,0,1]=4 17 B4R0.1 C#C[C@@H](C)O OR16943 [1,0,0,0,0,0|2,0,1]=4 18 B4R0.1 C#C[C@H](C)O OR40593 [1,0,0,0,0,0|2,0,1]=4 19 B4R0.1 C=CC(C)C OR460043 [1,0,0,0,0,0|1,0,1]=3 20 B4R0.1 C=CC(C)Cl OR55516 [1,0,0,0,0,0|2,0,1]=4 21 B4R0.1 CC(C)=CCl OR16424 [1,0,0,0,0,0|1,0,2]=4 22 B4R0.1 CC(C)C=O OR322092 [1,0,0,0,0,0|0,1,1]=3 23 B4R0.1 CC(C)CI OR2195 [1,0,0,0,0,0|1,0,1]=3 24 B4R0.1 CC(C)NN OR7919 [1,0,0,0,0,0|1,0,1]=3 25 B4R0.1 CC(C)NO OR59437 [1,0,0,0,0,0|0,1,1]=3 26 B4R0.1 CC(C)ON OR933332 [1,0,0,0,0,0|2,0,0]=3 27 B4R0.1 CC(C)[Mg]Br OR320105 [1,0,0,0,0,0|2,0,0]=3 28 B4R0.1 CC(C)[Mg]Br OR320106 [1,0,0,0,0,0|2,0,0]=3 29 B4R0.1 CC(C)[Mg]Cl OR320107 [1,0,0,0,0,0|2,0,0]=3 30 B4R0.1 CCC(C)Br OR4335 [1,0,0,0,0,0|2,0,1]=4 31 B4R0.1 CCC(C)Cl OR460003 [1,0,0,0,0,0|2,0,1]=4 32 B4R0.1 CCC(C)I OR5340 [1,0,0,0,0,0|2,0,1]=4 33 B4R0.1 CC[C@@H](C)N OR59999 [1,0,0,0,0,0|2,0,1]=4 34 B4R0.1 CC[C@@H](C)O OR304038 [1,0,0,0,0,0|2,0,1]=4 35 B4R0.1 CC[C@H](C)N OR60000 [1,0,0,0,0,0|2,0,1]=4 36 B4R0.1 CC[C@H](C)O OR4619 [1,0,0,0,0,0|2,0,1]=4 37 B4R0.1 CN(C)C#N OR12758 [1,0,0,0,0,0|2,0,1]=4 38 B4R0.1 C[C@@H](N)CO OR0903 [1,0,0,0,0,0|1,1,1]=4 39 B4R0.1 C[C@@H](O)CN OR304058 [1,0,0,0,0,0|2,0,1]=4 40 B4R0.1 C[C@H](N)CO OR5875 [1,0,0,0,0,0|1,1,1]=4 41 B4R0.1 C[C@H](O)CN OR30797 [1,0,0,0,0,0|2,0,1]=4 42 B4R0.1 C\C(N)=N\O OR30585 [1,0,0,0,0,0|1,1,1]=4 43 B4R0.2 C#CCCC OR5512 [1,0,0,0,0,0|2,0,1]=4 44 B4R0.2 C#COCC OR4769 [1,0,0,0,0,0|2,0,1]=4 45 B4R0.2 C=CCCC OR5326 [1,0,0,0,0,0|2,0,1]=4 46 B4R0.2 CCCC#N OR9437 [1,0,0,0,0,0|2,0,1]=4 47 B4R0.2 CCCCBr OR460056 [1,0,0,0,0,0|2,0,1]=4 48 B4R0.2 CCCCI OR3174 [1,0,0,0,0,0|2,0,1]=4 49 B4R0.2 CCOC=O OR28814 [1,0,0,0,0,0|1,1,1]=4 50 B6R0.1 O=C=NC(=O)CCl OR59429 [0,1,0,0,0,0|1,1,1]=4 51 B6R0.2 CC(=O)CC(C)C OR61047 [0,1,0,0,0,0|1,1,1]=4 52 B6R0.2 CC(C)CB(O)O OR14160 [0,1,0,0,0,0|2,1,0]=4 53 B6R0.2 CC(C)CC(=O)O OR2260 [0,1,0,0,0,0|1,1,1]=4 54 B6R0.2 CC(C)CC(N)=O OR22499 [0,1,0,0,0,0|1,1,1]=4 55 B6R0.2 CC(C)NC(C)C OR1090 [0,1,0,0,0,0|1,0,2]=4 56 B6R0.2 CC(C)NC(C)C OR12657 [0,1,0,0,0,0|1,0,2]=4 57 B6R0.2 CC(C)OC(C)C OR30780 [0,1,0,0,0,0|2,0,1]=4 58 B6R0.3 CC(C)C(=N)NO OR40109 [0,1,0,0,0,0|2,1,0]=4 59 B6R0.3 CC(C)C(=O)CBr OR346253 [0,1,0,0,0,0|2,0,1]=4 60 B6R0.3 CC(C)C(N)CO OR17684 [0,1,0,0,0,0|1,1,1]=4 61 B6R0.3 CC(C)[C@@H](N)CO OR5885 [0,1,0,0,0,0|1,1,1]=4 62 B6R0.3 CC(C)[C@H](N)CO OR5874 [0,1,0,0,0,0|1,1,1]=4 63 B6R0.4 CC(C)CN=C=S OR28903 [0,1,0,0,0,0|0,0,0]=1 64 B6R0.5 CC(C)(C)C[Mg]Cl OR320003 [0,1,0,0,0,0|3,0,0]=4 65 B6R0.5 CC(C)(C)N=C=S OR322172 [0,1,0,0,0,0|0,0,0]=1 66 B6R0.5 CC(C)(C)ON=O OR2337 [0,1,0,0,0,0|2,1,0]=4 67 B6R0.5 CC(C)(O)CCN OR60244 [0,1,0,0,0,0|2,0,1]=4 68 B6R0.5 CC(C)(O)CCO OR16608 [0,1,0,0,0,0|1,1,1]=4 69 B6R0.5 CCCC(C)(C)N OR30986 [0,1,0,0,0,0|2,0,1]=4 70 B6R1.2 CC1CCCN1 OR30527 [0,0,0,1,0,0|1,0,2]=4 71 B6R1.2 CC1CCCO1 OR42160 [0,0,0,1,0,0|2,0,1]=4 72 B6R1.2 CC1CCNC1 OR313066 [0,0,0,1,0,0|2,0,1]=4 73 B6R1.2 C[C@@H]1CCCN1 OR15684 [0,0,0,1,0,0|1,0,2]=4 74 B6R1.2 C[C@@H]1CCCN1 OR18417 [0,0,0,1,0,0|1,0,2]=4 75 B6R1.2 C[C@@H]1CCCN1 OR4617 [0,0,0,1,0,0|1,0,2]=4 76 B6R1.2 C[C@H]1CCCN1 OR460046 [0,0,0,1,0,0|1,0,2]=4 77 B6R1.2 C[C@H]1CCCN1 OR4618 [0,0,0,1,0,0|1,0,2]=4 78 B6R1.2 C[C@H]1CCNC1 OR313067 [0,0,0,1,0,0|2,0,1]=4 79 B6R1.3 BrCCC1CC1 OR41170 [0,0,0,1,0,0|2,0,1]=4 80 B6R1.3 CCNC1CC1 OR470784 [0,0,0,1,0,0|1,0,2]=4 81 B6R1.3 NCCC1CC1 OR19507 [0,0,0,1,0,0|2,0,1]=4 82 B6R1.3 O=C=NC1CC1 OR307001 [0,0,0,1,0,0|0,1,0]=2 83 B6R1.3 S=C=NC1CC1 OR30127 [0,0,0,1,0,0|0,0,0]=1 84 B6R1.10 CC1(C)CNC1 OR313047 [0,0,0,1,0,0|3,0,0]=4 85 B6R1.10 CC1(C)COC1 OR309099 [0,0,0,1,0,0|3,0,0]=4 86 B3R0.1 C#CCC OR19587 [2,0,0,0,0,0|1,0,1]=4 87 B3R0.1 C=CCC OR8591 [2,0,0,0,0,0|1,0,1]=4 88 B3R0.1 CCC=O OR17251 [2,0,0,0,0,0|0,1,1]=4 89 B3R0.1 CCCC OR8385 [2,0,0,0,0,0|1,0,1]=4 90 B3R0.1 CCCCl OR460042 [2,0,0,0,0,0|1,0,1]=4 91 B3R0.1 CCCI OR4541 [2,0,0,0,0,0|1,0,1]=4 92 B3R0.1 CCCN OR15743 [2,0,0,0,0,0|1,0,1]=4 93 B3R0.1 CCNC OR30626 [2,0,0,0,0,0|0,0,2]=4 94 B3R0.1 CCNN OR939620 [2,0,0,0,0,0|1,0,1]=4 95 B3R0.1 CC[Mg]Br OR320091 [2,0,0,0,0,0|2,0,0]=4 96 B3R0.1 CC[Mg]Br OR320094 [2,0,0,0,0,0|2,0,0]=4 97 B3R0.2 C=C(C)C OR40492 [2,0,0,0,0,0|0,0,2]=4 98 B3R0.2 CC(=N)N OR30204 [2,0,0,0,0,0|1,0,1]=4 99 B3R0.2 CC(C)I OR4540 [2,0,0,0,0,0|1,0,0]=3 100 B3R0.2 CC(C)N OR61315 [2,0,0,0,0,0|0,0,1]=3 101 B3R0.2 CC(Cl)Cl OR3712 [2,0,0,0,0,0|2,0,0]=4 102 B3R0.2 CC(N)=S OR28604 [2,0,0,0,0,0|1,0,1]=4 103 B3R0.2 CN(C)C OR5415 [2,0,0,0,0,0|1,0,1]=4 104 B3R0.2 CS(C)=O OR61029 [2,0,0,0,0,0|1,1,0]=4 105 B3R0.2 C[SiH](C)C OR17012 [2,0,0,0,0,0|0,1,1]=4 106 B5R0.3 CCC(C)CN OR28802 [1,1,0,0,0,0|1,0,1]=4 107 B5R0.3 CCC(C)NN OR318093 [1,1,0,0,0,0|1,0,1]=4 108 B5R0.3 CCC(C)OC OR14508 [1,1,0,0,0,0|1,0,1]=4 109 B5R0.3 CN[C@@H](C)CO OR55461 [1,1,0,0,0,0|0,0,2]=4 110 B5R0.3 CN[C@H](C)CO OR55460 [1,1,0,0,0,0|0,0,2]=4 111 B5R0.4 C#CC(C)(C)C OR11141 [1,1,0,0,0,0|1,0,1]=4 112 B5R0.4 C#CC(C)(C)Cl OR13593 [1,1,0,0,0,0|1,0,1]=4 113 B5R0.4 C#CC(C)(C)N OR16455 [1,1,0,0,0,0|1,0,1]=4 114 B5R0.4 C=CC(C)(C)C OR28711 [1,1,0,0,0,0|1,0,1]=4 115 B5R0.4 CC(C)(Br)C=O OR52528 [1,1,0,0,0,0|0,1,1]=4 116 B5R0.4 CC(C)(C)C#N OR6535 [1,1,0,0,0,0|1,0,1]=4 117 B5R0.4 CC(C)(C)C=O OR28610 [1,1,0,0,0,0|0,1,1]=4 118 B5R0.4 CC(C)(C)CCl OR460072 [1,1,0,0,0,0|1,0,1]=4 119 B5R0.4 CC(C)(C)CN OR938214 [1,1,0,0,0,0|1,0,1]=4 120 B5R0.4 CC(C)(C)NN OR28606 [1,1,0,0,0,0|1,0,1]=4 121 B5R0.4 CC(C)(C)NO OR24575 [1,1,0,0,0,0|0,1,1]=4 122 B5R0.4 CC(C)(C)NO OR45111 [1,1,0,0,0,0|0,1,1]=4 123 B5R0.4 CC(C)(C)ON OR24583 [1,1,0,0,0,0|2,0,0]=4 124 B5R0.4 CC(C)(C)[Mg]Cl OR320126 [1,1,0,0,0,0|2,0,0]=4 125 B5R0.4 CC(C)(Cl)CCl OR16427 [1,1,0,0,0,0|1,0,1]=4 126 B5R0.4 CC(C)(N)C#N OR315172 [1,1,0,0,0,0|1,0,1]=4 127 B5R0.4 CC(C)(N)CN OR30693 [1,1,0,0,0,0|1,0,1]=4 128 B5R0.4 CC(C)(N)CO OR1740T [1,1,0,0,0,0|0,1,1]=4 129 B5R0.4 CC(C)(O)CCl OR4348 [1,1,0,0,0,0|1,0,1]=4 130 B5R0.4 CC(C)(O)CN OR301207 [1,1,0,0,0,0|1,0,1]=4 131 B5R0.4 CC(C)(O)CO OR310412 [1,1,0,0,0,0|0,1,1]=4 132 B5R0.4 CNC(C)(C)C OR10027 [1,1,0,0,0,0|0,0,2]=4 133 B5R0.4 COC(C)(C)C OR59936 [1,1,0,0,0,0|1,0,1]=4 134 B5R0.5 C=C(C)C(C)C OR46606 [1,1,0,0,0,0|1,0,1]=4 135 B5R0.5 CC(=O)C(C)C OR5350 [1,1,0,0,0,0|0,1,1]=4 136 B5R0.5 CC(C)B(O)O OR8880 [1,1,0,0,0,0|1,1,0]=4 137 B5R0.5 CC(C)C(=N)N OR27276 [1,1,0,0,0,0|1,0,1]=4 138 B5R0.5 CC(C)C(=O)Cl OR10005 [1,1,0,0,0,0|0,1,1]=4 139 B5R0.5 CC(C)C(C)C OR53144 [1,1,0,0,0,0|1,0,1]=4 140 B5R0.5 CC(C)C(C)O OR10026 [1,1,0,0,0,0|0,1,1]=4 141 B5R0.5 CN(C)C(=S)Cl OR28875 [1,1,0,0,0,0|1,0,1]=4 142 B5R0.5 CN(C)C(=S)[S-] OR9121 [1,1,0,0,0,0|1,0,1]=4 143 B5R0.2 CCCN=C=S OR30307 [1,1,0,0,0,0|0,0,0]=2 144 B5R0.2 O=C=NCCCl OR6436 [1,1,0,0,0,0|0,1,0]=3 145 B5R0.2 S=C=NCCBr OR4186 [1,1,0,0,0,0|0,0,0]=2 146 B5R0.2 S=C=NCCCl OR322152 [1,1,0,0,0,0|0,0,0]=2 147 B7R0.3 CCC(C)CN=C=S OR30206 [0,2,0,0,0,0|0,0,0]=2 148 B7R0.7 CCOC(=O)N=C=S OR59819 [0,2,0,0,0,0|1,0,1]=4 149 B7R0.9 CC(C)(C)NC(N)=S OR30207 [0,2,0,0,0,0|0,0,2]=4 150 B5R1.3 BrCC1CC1 OR28323 [1,0,0,1,0,0|1,0,1]=4 151 B5R1.3 C#CC1CC1 OR11148 [1,0,0,1,0,0|1,0,1]=4 152 B5R1.3 ClCC1CC1 OR460074 [1,0,0,1,0,0|1,0,1]=4 153 B5R1.3 N#CC1CC1 OR0999 [1,0,0,1,0,0|1,0,1]=4 154 B5R1.3 NCC1CC1 OR17033 [1,0,0,1,0,0|1,0,1]=4 155 B5R1.3 NCC1CC1 OR1937 [1,0,0,1,0,0|1,0,1]=4 156 B5R1.3 O=CC1CC1 OR52083 [1,0,0,1,0,0|0,1,1]=4 157 B5R1.3 OCC1CC1 OR6507 [1,0,0,1,0,0|0,1,1]=4 158 B5R1.5 CC1(C)CN1 OR303021 [1,0,0,1,0,0|0,0,2]=4 159 B5R1.1 C1=NCCO1 OR305316 [1,0,0,1,0,0|0,1,1]=4 160 B7R1.7 S=C=NCC1CC1 OR28489 [0,1,0,1,0,0|0,0,0]=2