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m_7__22987700__5046 [0,0,0,0,0,0|4,0,0]=4 16 B5R0.1 CSC[C@H](C)N m_7__20871336__5046 [0,0,0,0,0,0|3,0,0]=3 17 B4R0.1 CON(C)C m_2230__679026__2463448 [1,0,0,0,0,0|2,0,1]=4 18 B4R0.1 CSC(C)C m_62__2390328__876088 [1,0,0,0,0,0|1,0,1]=3 19 B4R0.2 C=CCSC m_62__875850__8363982 [1,0,0,0,0,0|2,0,0]=3 20 B4R0.2 CCCSC m_62__875778__876088 [1,0,0,0,0,0|2,0,0]=3 21 B4R0.2 CCNCC m_270004__8160850__24715004 [1,0,0,0,0,0|2,0,1]=4 22 B4R0.2 CCSCC m_62__875846__6469026 [1,0,0,0,0,0|2,0,1]=4 23 B4R0.2 CSCCN m_7__20871276__5046 [1,0,0,0,0,0|2,0,1]=4 24 B4R0.2 CSCCO m_62__875850__10178562 [1,0,0,0,0,0|1,0,2]=4 25 B6R0.1 C#CCC(C)NC m_2230__22400136__2463448 [0,1,0,0,0,0|1,0,1]=3 26 B6R0.1 C=CC(C)CSC m_62__23815404__876088 [0,1,0,0,0,0|2,0,1]=4 27 B6R0.1 C=CCC(C)NC m_2230__22399836__2463448 [0,1,0,0,0,0|1,0,0]=2 28 B6R0.1 C=CCN(C)CC m_2230__10209864__2463448 [0,1,0,0,0,0|2,0,0]=3 29 B6R0.1 C=CCN(C)OC m_2230__679026__680312 [0,1,0,0,0,0|2,0,0]=3 30 B6R0.1 C=CCS(=O)CC m_1498__7021596__13192714 [0,1,0,0,0,0|3,0,0]=4 31 B6R0.1 CC#CC(C)SC m_62__875850__22381654 [0,1,0,0,0,0|1,0,2]=4 32 B6R0.1 CC=CC(=CC)C m_271570__16945674__16886636 [0,1,0,0,0,0|1,0,2]=4 33 B6R0.1 CCC(C)C=NO m_4__388124__7831622 [0,1,0,0,0,0|1,0,2]=4 34 B6R0.1 CCC(C)CNC m_207__134027__7687310 [0,1,0,0,0,0|2,0,0]=3 35 B6R0.1 CCC(C)CSC m_62__10709932__876088 [0,1,0,0,0,0|2,0,0]=3 36 B6R0.1 CCC(F)CSC m_62__9787600__876088 [0,1,0,0,0,0|3,0,0]=4 37 B6R0.1 CCC(O)CSC m_7__22988104__5046 [0,1,0,0,0,0|3,0,0]=4 38 B6R0.1 CCCC(C)NC m_269862__7193148__7200560 [0,1,0,0,0,0|1,0,1]=3 39 B6R0.1 CCCC(C)SC m_62__875850__10638528 [0,1,0,0,0,0|1,0,1]=3 40 B6R0.1 CCCN(C)CC m_2230__2261920__22383854 [0,1,0,0,0,0|2,0,1]=4 41 B6R0.1 CCCN(C)OC m_2230__679026__13271112 [0,1,0,0,0,0|2,0,1]=4 42 B6R0.1 CCN(C)CC#N m_2230__2653230__2463448 [0,1,0,0,0,0|2,0,1]=4 43 B6R0.1 CCN(C)CCF m_2230__17607486__2463448 [0,1,0,0,0,0|2,0,1]=4 44 B6R0.1 CCN(C)CCN m_269982__10894792__7393392 [0,1,0,0,0,0|2,0,1]=4 45 B6R0.1 CCN(C)CCO m_2230__3225026__2463448 [0,1,0,0,0,0|1,0,2]=4 46 B6R0.1 CCNC(C)CC m_269862__7865270__7200134 [0,1,0,0,0,0|2,0,1]=4 47 B6R0.1 CCNC(C)CCl m_2230__22399894__22383854 [0,1,0,0,0,0|2,0,1]=4 48 B6R0.1 CCNC(C)CF m_270004__10214060__24715004 [0,1,0,0,0,0|2,0,1]=4 49 B6R0.1 CCNC(C)CO m_269862__7865270__15157990 [0,1,0,0,0,0|2,0,1]=4 50 B6R0.1 CCN[C@H](C)CF m_270004__13811084__24715004 [0,1,0,0,0,0|2,0,1]=4 51 B6R0.1 CCN[C@H](C)CN m_269982__22505378__7393392 [0,1,0,0,0,0|2,0,1]=4 52 B6R0.1 CCN[C@H](C)CO m_2230__22399532__22383854 [0,1,0,0,0,0|2,0,1]=4 53 B6R0.1 CCSC(C)CC m_7__22987770__14247828 [0,1,0,0,0,0|2,0,1]=4 54 B6R0.1 CCSC(C)CO m_7__6338928__5047 [0,1,0,0,0,0|2,0,1]=4 55 B6R0.1 CCS[C@@H](C)CN m_7__20871330__5047 [0,1,0,0,0,0|2,0,1]=4 56 B6R0.1 CC[C@H](N)CSC m_7__20871354__5046 [0,1,0,0,0,0|3,0,0]=4 57 B6R0.1 CNC(C)CC#N m_2230__11757170__2463448 [0,1,0,0,0,0|1,0,1]=3 58 B6R0.1 CNC(C)CCN m_269982__22505446__14064228 [0,1,0,0,0,0|1,0,1]=3 59 B6R0.1 CNC(C)CCO m_2230__22400640__2463448 [0,1,0,0,0,0|0,0,2]=3 60 B6R0.1 CNC(C)CSC m_269862__7193148__16464016 [0,1,0,0,0,0|2,0,0]=3 61 B6R0.1 CNCC(C)NC m_269982__22505308__14064228 [0,1,0,0,0,0|2,0,0]=3 62 B6R0.1 CN[C@H](C)CCF m_2230__22404666__2463448 [0,1,0,0,0,0|1,0,1]=3 63 B6R0.1 CN[C@H](C)COC m_2230__22399844__2463448 [0,1,0,0,0,0|2,0,0]=3 64 B6R0.1 COC(C)CSC m_62__8635200__876088 [0,1,0,0,0,0|2,0,0]=3 65 B6R0.1 COCC(C)SC m_62__6339274__876088 [0,1,0,0,0,0|2,0,0]=3 66 B6R0.1 CON(C)CC#N m_2230__679026__680932 [0,1,0,0,0,0|2,0,1]=4 67 B6R0.1 CON(C)CCF m_2230__679026__22320836 [0,1,0,0,0,0|2,0,1]=4 68 B6R0.1 CON(C)CCO m_2230__9111768__2463448 [0,1,0,0,0,0|1,0,2]=4 69 B6R0.1 CSC(C)CCO m_7__5819074__5046 [0,1,0,0,0,0|0,0,2]=3 70 B6R0.1 CSCC(C)CO m_7__6078536__5046 [0,1,0,0,0,0|2,0,0]=3 71 B6R0.1 CSCC(O)CO m_7__6554250__5046 [0,1,0,0,0,0|3,0,0]=4 72 B6R0.2 C=C(Br)CN(C)C m_2230__20075912__2463448 [0,1,0,0,0,0|2,0,0]=3 73 B6R0.2 C=C(C)CN(C)C m_2230__12158106__2463448 [0,1,0,0,0,0|2,0,0]=3 74 B6R0.2 CC(=CC(=O)N)C m_22__58357__59124 [0,1,0,0,0,0|0,0,2]=3 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m_2230__21676360__2463448 [0,1,0,0,0,0|2,0,1]=4 90 B6R0.2 CN(C)CC(F)F m_2230__3307464__2463448 [0,1,0,0,0,0|2,0,1]=4 91 B6R0.2 CS(=O)CC(=O)N m_265282__10975722__4273530 [0,1,0,0,0,0|2,0,0]=3 92 B6R0.2 C[C@@H](N)CC(=O)N m_270006__8381712__12625006 [0,1,0,0,0,0|1,0,0]=2 93 B6R0.2 C[C@H](N)CN(C)C m_269982__22504918__14064228 [0,1,0,0,0,0|2,0,1]=4 94 B6R0.2 NC(=O)CC(=O)N m_22__58357__16915376 [0,1,0,0,0,0|2,0,1]=4 95 B6R0.2 NC(=O)CC(=O)O m_269946__11243934__14927950 [0,1,0,0,0,0|2,0,1]=4 96 B6R0.2 NC(=O)CC(Cl)Cl m_22__58357__23408826 [0,1,0,0,0,0|2,0,0]=3 97 B6R0.3 C#CC(C)N(C)C m_2230__24546302__2463448 [0,1,0,0,0,0|2,0,1]=4 98 B6R0.3 C=CC(C)N(C)C m_2230__21221554__2463448 [0,1,0,0,0,0|2,0,0]=3 99 B6R0.3 CC(=NO)C(C)C m_4__388124__66897 [0,1,0,0,0,0|1,0,2]=4 100 B6R0.3 CC(C)C(=O)NN m_240690__7868478__7404556 [0,1,0,0,0,0|2,0,1]=4 101 B6R0.3 CC(C)C(=O)NO m_527__388132__156044 [0,1,0,0,0,0|1,0,2]=4 102 B6R0.3 CC(CF)N(C)C m_2230__22408738__2463448 [0,1,0,0,0,0|2,0,1]=4 103 B6R0.3 CCC(C)N(C)C m_2230__7462418__2463448 [0,1,0,0,0,0|2,0,1]=4 104 B6R0.3 CCN(C)C(C)C m_270004__8128012__24715004 [0,1,0,0,0,0|2,0,1]=4 105 B6R0.3 CNC(=O)C(C)C m_270062__7630660__13861800 [0,1,0,0,0,0|2,0,1]=4 106 B6R0.3 CNC(C)C(C)F m_2230__22400592__2463448 [0,1,0,0,0,0|3,0,0]=4 107 B6R0.3 CNC(C)C(C)N m_269982__22505178__14064228 [0,1,0,0,0,0|3,0,0]=4 108 B6R0.3 CNC(C)C(C)O m_269862__7193148__13817824 [0,1,0,0,0,0|3,0,0]=4 109 B6R0.3 CN[C@H](C)[C@H](C)O m_2230__22400278__2463448 [0,1,0,0,0,0|3,0,0]=4 110 B6R0.3 COC(=O)C(C)C m_276436__14076652__14088334 [0,1,0,0,0,0|2,0,1]=4 111 B6R0.3 CON(C)C(C)C m_2230__679026__680832 [0,1,0,0,0,0|3,0,0]=4 112 B6R0.3 CSC(C)C(C)C m_7__6286942__5046 [0,1,0,0,0,0|2,0,0]=3 113 B6R0.3 CSC(C)C(C)O m_7__6286572__5046 [0,1,0,0,0,0|3,0,0]=4 114 B6R0.4 C#CCCN(C)C m_2230__15161984__2463448 [0,1,0,0,0,0|2,0,1]=4 115 B6R0.4 C=CCNC(=O)C m_270062__7594896__15585492 [0,1,0,0,0,0|2,0,1]=4 116 B6R0.4 C=CCOC(=O)C m_1458__473186__489874 [0,1,0,0,0,0|2,0,1]=4 117 B6R0.4 C=CCSC(C)C m_62__2390328__8363982 [0,1,0,0,0,0|1,0,0]=2 118 B6R0.4 CC#CCN(C)C m_2230__10565060__2463448 [0,1,0,0,0,0|2,0,1]=4 119 B6R0.4 CC(=O)NNC=O m_270062__21867000__15585492 [0,1,0,0,0,0|2,0,1]=4 120 B6R0.4 CC(C)CC=NO m_4__388124__286510 [0,1,0,0,0,0|0,0,1]=2 121 B6R0.4 CC(C)NCCF m_269862__9706110__7204804 [0,1,0,0,0,0|1,0,1]=3 122 B6R0.4 CC(C)NCCO m_269862__7193048__7204804 [0,1,0,0,0,0|0,0,2]=3 123 B6R0.4 CC(C)SCCN m_7__20871276__5048 [0,1,0,0,0,0|1,0,1]=3 124 B6R0.4 CC(C)SCCO m_62__2390328__10178562 [0,1,0,0,0,0|0,0,2]=3 125 B6R0.4 CCCCN(C)C m_2230__665312__2463448 [0,1,0,0,0,0|2,0,1]=4 126 B6R0.4 CCCSC(C)C m_62__2390328__875868 [0,1,0,0,0,0|1,0,1]=3 127 B6R0.4 CCNCC(C)C m_207__121480__121216 [0,1,0,0,0,0|1,0,1]=3 128 B6R0.4 CCNCC(C)F m_270004__13461138__24715004 [0,1,0,0,0,0|2,0,1]=4 129 B6R0.4 CCNCC(C)O m_270004__8288774__24715004 [0,1,0,0,0,0|2,0,1]=4 130 B6R0.4 CCSCC(C)C m_62__1010136__6469026 [0,1,0,0,0,0|1,0,1]=3 131 B6R0.4 CCSCC(C)F m_62__875846__16913488 [0,1,0,0,0,0|2,0,1]=4 132 B6R0.4 CCSCC(C)O m_7__10953796__5047 [0,1,0,0,0,0|2,0,1]=4 133 B6R0.4 CCSC[C@H](C)N m_7__20871336__5047 [0,1,0,0,0,0|2,0,1]=4 134 B6R0.4 CN(C)CCC#N m_2230__6737726__2463448 [0,1,0,0,0,0|2,0,1]=4 135 B6R0.4 CN(C)CCCF m_2230__13040470__2463448 [0,1,0,0,0,0|2,0,1]=4 136 B6R0.4 CN(C)CCCN m_269982__11965286__14064228 [0,1,0,0,0,0|2,0,1]=4 137 B6R0.4 CN(C)CCCO m_2230__9787816__2463448 [0,1,0,0,0,0|1,0,2]=4 138 B6R0.4 CNCCC(C)C m_207__134027__134014 [0,1,0,0,0,0|1,0,1]=3 139 B6R0.4 CNCCN(C)C m_269982__10880304__14064228 [0,1,0,0,0,0|2,0,1]=4 140 B6R0.4 COCCN(C)C m_2230__2013888__2463448 [0,1,0,0,0,0|1,0,2]=4 141 B6R0.4 CON=CC(C)C m_4__461206__7831602 [0,1,0,0,0,0|1,0,2]=4 142 B6R0.4 CSCC=C(C)C m_62__12201838__876088 [0,1,0,0,0,0|2,0,1]=4 143 B6R0.4 CSCCC(C)C m_62__7021584__876088 [0,1,0,0,0,0|0,1,1]=3 144 B6R0.4 CSCCC(C)F m_62__13165346__876088 [0,1,0,0,0,0|1,1,1]=4 145 B6R0.4 CSCCC(C)N m_34__20871470__7119628 [0,1,0,0,0,0|1,1,1]=4 146 B6R0.4 CSCCC(C)O m_62__12057938__876088 [0,1,0,0,0,0|1,1,1]=4 147 B6R0.4 CSCCN(C)C m_7__6950568__5046 [0,1,0,0,0,0|1,1,1]=4 148 B6R0.4 NC(=O)CNC=O m_22__58357__21204898 [0,1,0,0,0,0|2,0,1]=4 149 B6R0.5 C=CCS(=O)(=O)C m_1500__766206__13192690 [0,1,0,0,0,0|3,0,0]=4 150 B6R0.5 CC(C)(C)C=NO m_4__388124__7831646 [0,1,0,0,0,0|1,0,2]=4 151 B6R0.5 CCNC(C)(C)C m_2230__3081242__22383854 [0,1,0,0,0,0|2,0,1]=4 152 B6R0.5 CNCC(C)(C)C m_207__134027__2989454 [0,1,0,0,0,0|2,0,0]=3 153 B6R0.5 CNCP(=O)(C)C m_2230__19438450__2463448 [0,1,0,0,0,0|3,0,0]=4 154 B6R0.5 CSCC(C)(C)C m_7__9780138__5046 [0,1,0,0,0,0|2,0,0]=3 155 B6R0.5 CSCC(C)(C)F m_62__23075284__876088 [0,1,0,0,0,0|2,0,0]=3 156 B6R0.5 CSCC(C)(C)N m_7__22849170__5046 [0,1,0,0,0,0|2,0,0]=3 157 B6R0.5 CSCC(C)(C)O m_7__22987452__5046 [0,1,0,0,0,0|2,0,0]=3 158 B6R0.5 CSC[Si](C)(C)C m_7__17541628__5046 [0,1,0,0,0,0|2,1,0]=4 159 B6R1.2 CN1CCCC1 m_2230__678722__2463448 [0,0,0,1,0,0|2,0,1]=4 160 B6R1.3 CCSC1CC1 m_7__22987770__16761930 [0,0,0,1,0,0|2,0,1]=4 161 B6R1.3 CNCC1CC1 m_207__134027__2989440 [0,0,0,1,0,0|2,0,0]=3 162 B6R1.3 CSCC1CC1 m_62__7141820__876088 [0,0,0,1,0,0|2,0,0]=3 163 B6R1.3 ON=CC1CC1 m_4__388124__7831630 [0,0,0,1,0,0|1,0,2]=4 164 B6R1.5 CN1CC(C1)F m_2230__15542798__2463448 [0,0,0,1,0,0|2,0,1]=4 165 B6R1.11 CN(C)C1CC1 m_2230__804662__2463448 [0,0,0,1,0,0|2,0,1]=4 166 B3R0.1 CCSC m_62__875846__876088 [2,0,0,0,0,0|1,0,1]=4 167 B3R0.2 CC(=O)N m_22__58357__58844 [2,0,0,0,0,0|1,0,1]=4 168 B5R0.3 C=CC(=CC)C m_271570__15607576__16886636 [1,1,0,0,0,0|0,0,2]=4 169 B5R0.3 C=CC(C)NC m_2230__22399842__2463448 [1,1,0,0,0,0|0,0,1]=3 170 B5R0.3 CCC(C)NC m_2230__22399526__2463448 [1,1,0,0,0,0|0,0,1]=3 171 B5R0.3 CCN(C)CC m_2230__678602__2463448 [1,1,0,0,0,0|1,0,1]=4 172 B5R0.3 CCN(C)OC m_2230__679026__22383854 [1,1,0,0,0,0|1,0,1]=4 173 B5R0.3 CNC(C)C#N m_2230__22392276__2463448 [1,1,0,0,0,0|1,0,1]=4 174 B5R0.3 CNC(C)CCl m_2230__22399894__2463448 [1,1,0,0,0,0|1,0,0]=3 175 B5R0.3 CNC(C)CO m_269862__7193148__15157990 [1,1,0,0,0,0|0,0,1]=3 176 B5R0.3 CN[C@H](C)CF m_2230__22399906__2463448 [1,1,0,0,0,0|1,0,0]=3 177 B5R0.3 CN[C@H](C)CN m_269982__22505378__14064228 [1,1,0,0,0,0|1,0,0]=3 178 B5R0.3 CN[C@H](C)CO m_2230__22399532__2463448 [1,1,0,0,0,0|0,0,1]=3 179 B5R0.3 CSC(C)CO m_7__6338928__5046 [1,1,0,0,0,0|0,0,1]=3 180 B5R0.3 CS[C@@H](C)CN m_7__20871330__5046 [1,1,0,0,0,0|1,0,0]=3 181 B5R0.4 CNC(C)(C)C m_2230__3081242__2463448 [1,1,0,0,0,0|1,0,1]=4 182 B5R0.5 C=C(C)C(=O)N m_22__58357__16784056 [1,1,0,0,0,0|0,0,2]=4 183 B5R0.5 CC(=O)N(C)C m_270062__7630680__15585492 [1,1,0,0,0,0|1,0,0]=3 184 B5R0.5 CC(=O)N(C)N m_240690__21583792__7404532 [1,1,0,0,0,0|2,0,0]=4 185 B5R0.5 CC(C)C(=O)N m_22__58357__337030 [1,1,0,0,0,0|0,0,0]=2 186 B5R0.5 CC(N)C(=O)N m_270006__8381712__7641714 [1,1,0,0,0,0|1,0,0]=3 187 B5R0.5 CN(C)C(=N)N m_264822__4904404__3499612 [1,1,0,0,0,0|2,0,0]=4 188 B5R0.5 C[C@@H](F)C(=O)N m_22__58357__24597924 [1,1,0,0,0,0|1,0,0]=3 189 B5R0.5 C[C@@H](O)C(=O)N m_22__58357__17541882 [1,1,0,0,0,0|1,0,0]=3 190 B5R0.5 NC(=O)C(Cl)Cl m_22__58357__20853970 [1,1,0,0,0,0|2,0,0]=4 191 B5R0.5 NC(=O)C(F)F m_22__58357__58886 [1,1,0,0,0,0|2,0,0]=4 192 B5R0.2 C#CCCSC m_62__875850__18060662 [1,1,0,0,0,0|1,0,1]=4 193 B5R0.2 C#CCSCC m_7__22987770__6266 [1,1,0,0,0,0|1,0,1]=4 194 B5R0.2 C=CCCSC m_62__875850__9875548 [1,1,0,0,0,0|1,0,0]=3 195 B5R0.2 C=CCNCC m_270004__9143632__24715004 [1,1,0,0,0,0|1,0,0]=3 196 B5R0.2 C=CCSCC m_62__875846__8363982 [1,1,0,0,0,0|1,0,0]=3 197 B5R0.2 CC=CCSC m_62__4275932__876088 [1,1,0,0,0,0|1,0,1]=4 198 B5R0.2 CCCC=NO m_4__388124__7831606 [1,1,0,0,0,0|0,0,1]=3 199 B5R0.2 CCCCSC m_62__875776__876088 [1,1,0,0,0,0|0,1,1]=4 200 B5R0.2 CCCNCC m_270004__8288780__24715004 [1,1,0,0,0,0|1,0,1]=4 201 B5R0.2 CCCSCC m_62__875778__6469026 [1,1,0,0,0,0|1,0,1]=4 202 B5R0.2 CCNCCO m_270004__8349608__24715004 [1,1,0,0,0,0|0,0,2]=4 203 B5R0.2 CCSCC#N m_7__22987770__5055 [1,1,0,0,0,0|1,0,1]=4 204 B5R0.2 CCSCCF m_7__22987770__22320828 [1,1,0,0,0,0|1,0,1]=4 205 B5R0.2 CCSCCN m_7__20871276__5047 [1,1,0,0,0,0|1,0,1]=4 206 B5R0.2 CCSCCO m_7__22987770__102708 [1,1,0,0,0,0|0,0,2]=4 207 B5R0.2 CCSCOC m_7__22987770__6762 [1,1,0,0,0,0|2,0,0]=4 208 B5R0.2 CCSCSC m_7__22987770__10542644 [1,1,0,0,0,0|2,0,0]=4 209 B5R0.2 CNCCSC m_7__22986920__5046 [1,1,0,0,0,0|2,0,0]=4 210 B5R0.2 COCCSC m_62__524272__876088 [1,1,0,0,0,0|2,0,0]=4 211 B5R0.2 CSC/C=C\Br m_7__22544354__5046 [1,1,0,0,0,0|1,0,1]=4 212 B5R0.2 CSCCC#N m_7__10953802__5046 [1,1,0,0,0,0|1,0,1]=4 213 B5R0.2 CSCCCN m_7__20871288__5046 [1,1,0,0,0,0|1,0,1]=4 214 B5R0.2 CSCCCO m_7__10972294__5046 [1,1,0,0,0,0|0,0,2]=4 215 B5R0.2 CSCCSC m_62__875850__8268572 [1,1,0,0,0,0|2,0,0]=4 216 B7R0.2 C#CC(C)NC(=O)C m_270062__16413910__15585492 [0,2,0,0,0,0|1,0,1]=4 217 B7R0.2 C#CC(C)NC(=O)N m_2554__10336288__788524 [0,2,0,0,0,0|1,0,1]=4 218 B7R0.2 C#CC(C)OC(=O)C m_276436__14078328__14088324 [0,2,0,0,0,0|1,0,1]=4 219 B7R0.2 C#CC(O)CC(=O)N m_22__58357__21695556 [0,2,0,0,0,0|1,0,1]=4 220 B7R0.2 C/C(=C\C(=O)N)/CO m_22__58357__24596156 [0,2,0,0,0,0|0,0,2]=4 221 B7R0.2 C=C(Br)CN(C)CC m_2230__20075912__22383854 [0,2,0,0,0,0|2,0,0]=4 222 B7R0.2 C=C(Br)CN(C)OC m_2230__679026__1199106 [0,2,0,0,0,0|2,0,0]=4 223 B7R0.2 C=C(C)CN(C)CC m_2230__678758__2463448 [0,2,0,0,0,0|2,0,0]=4 224 B7R0.2 C=C(C)CN(C)OC m_2230__679026__666852 [0,2,0,0,0,0|2,0,0]=4 225 B7R0.2 C=C(Cl)CN(C)OC m_2230__679026__680958 [0,2,0,0,0,0|2,0,0]=4 226 B7R0.2 C=C(F)CN(C)OC m_2230__679026__22388968 [0,2,0,0,0,0|2,0,0]=4 227 B7R0.2 C=C(I)CN(C)OC m_2230__679026__18682544 [0,2,0,0,0,0|2,0,0]=4 228 B7R0.2 C=C=C(C)CC(=O)N m_22__58357__21288594 [0,2,0,0,0,0|0,0,2]=4 229 B7R0.2 C=CC(C)CC(=O)N m_22__58357__16520644 [0,2,0,0,0,0|0,0,1]=3 230 B7R0.2 C=CC(C)NC(=O)C m_270062__7625826__15585492 [0,2,0,0,0,0|1,0,1]=4 231 B7R0.2 C=CC(C)NC(=O)N m_2554__7346476__788524 [0,2,0,0,0,0|1,0,1]=4 232 B7R0.2 C=CC(C)NC(C)C m_2230__22399842__680832 [0,2,0,0,0,0|1,0,0]=3 233 B7R0.2 C=CC(C)OC(=O)C m_276436__14080680__14088324 [0,2,0,0,0,0|1,0,1]=4 234 B7R0.2 CC(=CC(=O)N)CN m_240690__7368526__18313664 [0,2,0,0,0,0|0,0,2]=4 235 B7R0.2 CC(=CC(=O)NN)C m_240690__7868478__7405060 [0,2,0,0,0,0|0,0,2]=4 236 B7R0.2 CC(=O)NC(C)CO m_270062__7600328__15585492 [0,2,0,0,0,0|1,0,0]=3 237 B7R0.2 CC(=O)N[C@H](C)CF m_270062__13811086__15585492 [0,2,0,0,0,0|1,0,0]=3 238 B7R0.2 CC(=O)N[C@H](C)CN m_270006__11615546__8404996 [0,2,0,0,0,0|1,0,0]=3 239 B7R0.2 CC(=O)OC(C)C#N m_276436__14084876__14088324 [0,2,0,0,0,0|1,0,1]=4 240 B7R0.2 CC(=O)OC(C)CF m_276436__22326972__14088324 [0,2,0,0,0,0|1,0,0]=3 241 B7R0.2 CC(C)CC(=O)NN m_240690__7868478__7404688 [0,2,0,0,0,0|0,0,0]=2 242 B7R0.2 CC(C)CC(=O)NO m_527__388132__156141 [0,2,0,0,0,0|0,0,0]=2 243 B7R0.2 CC(C)NC(=O)CN m_270006__8378586__10128098 [0,2,0,0,0,0|1,0,0]=3 244 B7R0.2 CC(C)NC(=O)CO m_22__4929926__7941800 [0,2,0,0,0,0|1,0,0]=3 245 B7R0.2 CC(C)NC(=O)NN m_273454__11052828__11052398 [0,2,0,0,0,0|1,0,0]=3 246 B7R0.2 CC(C)NC(C)C#N m_2230__22392276__680832 [0,2,0,0,0,0|1,0,1]=4 247 B7R0.2 CC(C)NC(C)CCl m_2230__22399894__680832 [0,2,0,0,0,0|1,0,1]=4 248 B7R0.2 CC(C)N[C@H](C)CF m_2230__22399906__680832 [0,2,0,0,0,0|1,0,1]=4 249 B7R0.2 CC(C)N[C@H](C)CN m_269982__22505378__7393356 [0,2,0,0,0,0|1,0,1]=4 250 B7R0.2 CC(C)N[C@H](C)CO m_269862__7194864__7204804 [0,2,0,0,0,0|0,0,2]=4 251 B7R0.2 CC(C)SC(C)CO m_7__6338928__5048 [0,2,0,0,0,0|0,0,2]=4 252 B7R0.2 CC(C)S[C@@H](C)CN m_7__20871330__5048 [0,2,0,0,0,0|1,0,1]=4 253 B7R0.2 CC(CN)CC(=O)N m_270006__8381712__11615938 [0,2,0,0,0,0|0,0,0]=2 254 B7R0.2 CC(CO)CN(C)C m_2230__5903708__2463448 [0,2,0,0,0,0|2,0,0]=4 255 B7R0.2 CC(F)CC(=O)NN m_240690__7868478__17511496 [0,2,0,0,0,0|1,0,0]=3 256 B7R0.2 CC(F)CC(=O)NO m_527__388132__17511476 [0,2,0,0,0,0|1,0,0]=3 257 B7R0.2 CC(O)CC(=O)NN m_240690__7868478__24784790 [0,2,0,0,0,0|1,0,0]=3 258 B7R0.2 CCC(=O)NC(C)C m_270062__7594654__22005658 [0,2,0,0,0,0|1,0,0]=3 259 B7R0.2 CCC(=O)NN(C)C m_22__134304__58887 [0,2,0,0,0,0|2,0,0]=4 260 B7R0.2 CCC(=O)OC(C)C m_276436__14076930__14101862 [0,2,0,0,0,0|1,0,0]=3 261 B7R0.2 CCC(C)CC(=O)N m_22__58357__9278272 [0,2,0,0,0,0|0,0,0]=2 262 B7R0.2 CCC(C)CN(C)C m_2230__4599284__2463448 [0,2,0,0,0,0|2,0,0]=4 263 B7R0.2 CCC(C)CS(=O)C m_265282__7021600__4273530 [0,2,0,0,0,0|1,0,0]=3 264 B7R0.2 CCC(C)NC(=N)N m_264822__4904404__3499544 [0,2,0,0,0,0|2,0,0]=4 265 B7R0.2 CCC(C)NC(=O)C m_270062__7594688__15585492 [0,2,0,0,0,0|1,0,0]=3 266 B7R0.2 CCC(C)NC(=O)N m_2554__826680__788524 [0,2,0,0,0,0|1,0,0]=3 267 B7R0.2 CCC(C)NC(C)C m_269862__7192700__7204804 [0,2,0,0,0,0|1,0,1]=4 268 B7R0.2 CCC(C)OC(=O)C m_276436__14076902__14088324 [0,2,0,0,0,0|1,0,0]=3 269 B7R0.2 CCC(C)OC(=O)N m_282070__22187654__22151588 [0,2,0,0,0,0|1,0,0]=3 270 B7R0.2 CCN(C)CC(=O)N m_2230__9227808__2463448 [0,2,0,0,0,0|1,0,0]=3 271 B7R0.2 CCN(C)CC(C)C m_2230__702774__2463448 [0,2,0,0,0,0|1,0,1]=4 272 B7R0.2 CCN(C)NC(=O)C m_270062__21883322__15585492 [0,2,0,0,0,0|2,0,0]=4 273 B7R0.2 CCS(=O)CC(=O)N m_265282__10975722__4273536 [0,2,0,0,0,0|2,0,0]=4 274 B7R0.2 CCS(=O)CC(C)C m_1498__7021596__14911760 [0,2,0,0,0,0|1,0,0]=3 275 B7R0.2 CCS(=O)CC(C)F m_1498__7021596__16913490 [0,2,0,0,0,0|2,0,0]=4 276 B7R0.2 CCS(=O)CC(C)O m_265282__10908418__4273536 [0,2,0,0,0,0|2,0,0]=4 277 B7R0.2 CC[C@@H](C)NC(=O)C m_22__23073296__58844 [0,2,0,0,0,0|1,0,0]=3 278 B7R0.2 CC[C@@H](N)CC(=O)N m_240690__7368526__13458218 [0,2,0,0,0,0|1,0,0]=3 279 B7R0.2 CC[C@H](C)NC(=O)C m_1626__22088414__511242 [0,2,0,0,0,0|1,0,0]=3 280 B7R0.2 CC[C@H](O)CC(=O)N m_22__58357__24596596 [0,2,0,0,0,0|1,0,0]=3 281 B7R0.2 CN(C)CC(=O)NN m_240690__7868478__10871162 [0,2,0,0,0,0|1,0,0]=3 282 B7R0.2 CN(C)NC(=O)CN m_240690__21554270__3025698 [0,2,0,0,0,0|2,0,0]=4 283 B7R0.2 CN(C)NC(=O)CO m_22__134304__7941800 [0,2,0,0,0,0|2,0,0]=4 284 B7R0.2 CN=C(N)NC(C)C m_264822__3499812__3499608 [0,2,0,0,0,0|2,0,0]=4 285 B7R0.2 CNC(=O)C=C(C)C m_22__387492__59124 [0,2,0,0,0,0|0,0,2]=4 286 B7R0.2 CNC(=O)CC(=O)N m_22__387492__16915376 [0,2,0,0,0,0|1,0,1]=4 287 B7R0.2 CNC(=O)CC(=O)O m_269946__11243932__14927950 [0,2,0,0,0,0|1,0,1]=4 288 B7R0.2 CNC(=O)CC(C)C m_22__387492__58916 [0,2,0,0,0,0|0,0,0]=2 289 B7R0.2 CNC(=O)CC(C)F m_22__387492__17511474 [0,2,0,0,0,0|1,0,0]=3 290 B7R0.2 CNC(=O)CC(C)O m_487__150425__23862482 [0,2,0,0,0,0|1,0,0]=3 291 B7R0.2 CNC(=O)CC(Cl)Cl m_22__387492__23408826 [0,2,0,0,0,0|2,0,0]=4 292 B7R0.2 CNC(=O)CN(C)C m_527__154302__2989430 [0,2,0,0,0,0|1,0,0]=3 293 B7R0.2 CNC(=O)CS(=O)C m_265282__9788176__4273530 [0,2,0,0,0,0|2,0,0]=4 294 B7R0.2 CNC(=O)C[C@@H](C)N m_270006__8382028__12625006 [0,2,0,0,0,0|1,0,0]=3 295 B7R0.2 CNC(=O)NC(C)C m_2554__826668__788506 [0,2,0,0,0,0|1,0,0]=3 296 B7R0.2 CNC(=S)NC(C)C m_8__387488__83719 [0,2,0,0,0,0|1,1,0]=4 297 B7R0.2 CNC(C)C=C(C)C m_269862__7193148__14924846 [0,2,0,0,0,0|1,0,1]=4 298 B7R0.2 CNC(C)CC(=O)N m_2230__22400102__2463448 [0,2,0,0,0,0|0,0,0]=2 299 B7R0.2 CNC(C)CC(C)C m_2230__22399870__2463448 [0,2,0,0,0,0|1,0,1]=4 300 B7R0.2 CNC(C)CC(C)O m_2230__22399846__2463448 [0,2,0,0,0,0|0,0,2]=4 301 B7R0.2 CNC(C)CC(F)F m_2230__22400820__2463448 [0,2,0,0,0,0|1,0,1]=4 302 B7R0.2 CNC(C)CS(=O)C m_2230__22399648__2463448 [0,2,0,0,0,0|1,0,0]=3 303 B7R0.2 CN[C@@H](C)CN(C)C m_2230__22399874__2463448 [0,2,0,0,0,0|2,0,0]=4 304 B7R0.2 CN[C@H](C)CC(=O)N m_240690__7368526__17648630 [0,2,0,0,0,0|0,0,0]=2 305 B7R0.2 CN[C@H](C)C[C@@H](C)N m_269982__22505384__14064228 [0,2,0,0,0,0|1,0,1]=4 306 B7R0.2 COC(=O)C=C(C)C m_276436__14076652__14086088 [0,2,0,0,0,0|0,0,2]=4 307 B7R0.2 COC(=O)CC(=O)N m_22__58357__590148 [0,2,0,0,0,0|1,0,1]=4 308 B7R0.2 COC(=O)CC(C)C m_276436__14076652__14085888 [0,2,0,0,0,0|0,0,0]=2 309 B7R0.2 COC(=O)CC(C)F m_276436__14076652__17511488 [0,2,0,0,0,0|1,0,0]=3 310 B7R0.2 COC(=O)CC(Cl)Cl m_1458__23408830__483916 [0,2,0,0,0,0|2,0,0]=4 311 B7R0.2 COC(=O)CN(C)C m_2230__678338__2463448 [0,2,0,0,0,0|1,0,0]=3 312 B7R0.2 COC(=O)C[C@@H](C)O m_1458__21596576__483916 [0,2,0,0,0,0|1,0,0]=3 313 B7R0.2 COC(=O)NC(C)C m_282070__22273274__22151046 [0,2,0,0,0,0|1,0,0]=3 314 B7R0.2 COC(C)CC(=O)N m_22__58357__2501980 [0,2,0,0,0,0|0,0,0]=2 315 B7R0.2 COC(C)CN(C)C m_2230__10158424__2463448 [0,2,0,0,0,0|2,0,0]=4 316 B7R0.2 CON(C)CC(=O)C m_2230__679026__12369270 [0,2,0,0,0,0|1,0,0]=3 317 B7R0.2 CON(C)CC(=O)N m_2230__679026__680278 [0,2,0,0,0,0|1,0,0]=3 318 B7R0.2 CON(C)CC(C)C m_2230__679026__681214 [0,2,0,0,0,0|1,0,1]=4 319 B7R0.2 CS(=O)CC(O)CO m_265282__10978846__4273530 [0,2,0,0,0,0|2,0,0]=4 320 B7R0.2 CSC(C)CC(=O)N m_22__58357__7841202 [0,2,0,0,0,0|0,0,0]=2 321 B7R0.2 CSC(C)CC(C)C m_62__875850__10643630 [0,2,0,0,0,0|0,1,1]=4 322 B7R0.2 C[C@@H](CO)NC(=O)N m_2554__13191904__788524 [0,2,0,0,0,0|1,0,0]=3 323 B7R0.2 C[C@@H](N)CC(=O)NN m_240690__7868478__12625004 [0,2,0,0,0,0|1,0,0]=3 324 B7R0.2 C[C@H](CF)NC(=O)N m_2554__13811078__788524 [0,2,0,0,0,0|1,0,0]=3 325 B7R0.2 C[C@H](CN)NC(=O)N m_273454__11052888__11052394 [0,2,0,0,0,0|1,0,0]=3 326 B7R0.2 NC(=O)C[C@@H](N)CO m_240690__7368526__15491892 [0,2,0,0,0,0|1,0,0]=3 327 B7R0.2 NC(=O)C[C@H](N)CO m_240690__7368526__17507420 [0,2,0,0,0,0|1,0,0]=3 328 B7R0.2 NCC(O)CC(=O)N m_240690__7368526__12421074 [0,2,0,0,0,0|1,0,0]=3 329 B7R0.2 NNC(=O)CC(Cl)Cl m_240690__7868478__23408846 [0,2,0,0,0,0|2,0,0]=4 330 B7R0.2 O=C(CC(Cl)Cl)NO m_527__388132__23408828 [0,2,0,0,0,0|2,0,0]=4 331 B7R0.3 C#CCSC(C)CO m_7__6338928__6266 [0,2,0,0,0,0|1,0,1]=4 332 B7R0.3 C#CCS[C@@H](C)CN m_7__20871330__6266 [0,2,0,0,0,0|1,0,1]=4 333 B7R0.3 C=C=CCN(C)OC m_2230__679026__22993872 [0,2,0,0,0,0|2,0,0]=4 334 B7R0.3 C=CCCC(C)NC m_269862__7193148__8751922 [0,2,0,0,0,0|1,0,0]=3 335 B7R0.3 C=CCCC(C)SC m_62__875850__15565430 [0,2,0,0,0,0|1,0,0]=3 336 B7R0.3 C=CCCN(C)CC m_2230__22408114__2463448 [0,2,0,0,0,0|2,0,0]=4 337 B7R0.3 C=CCCN(C)OC m_2230__679026__8929530 [0,2,0,0,0,0|2,0,0]=4 338 B7R0.3 C=CCNC(C)C#N m_2230__22392276__680312 [0,2,0,0,0,0|1,0,1]=4 339 B7R0.3 C=CCNC(C)C=C m_2230__22399842__680312 [0,2,0,0,0,0|1,0,1]=4 340 B7R0.3 C=CCNC(C)CC m_2230__22399526__680312 [0,2,0,0,0,0|1,0,0]=3 341 B7R0.3 C=CCNC(C)CCl m_2230__22399894__680312 [0,2,0,0,0,0|1,0,0]=3 342 B7R0.3 C=CCN[C@H](C)CF m_2230__22399906__680312 [0,2,0,0,0,0|1,0,0]=3 343 B7R0.3 C=CCN[C@H](C)CN m_269982__22505378__7393354 [0,2,0,0,0,0|1,0,0]=3 344 B7R0.3 C=CCN[C@H](C)CO m_2230__22399532__680312 [0,2,0,0,0,0|1,0,0]=3 345 B7R0.3 C=CCSC(C)C#N m_7__22987946__6057 [0,2,0,0,0,0|1,0,1]=4 346 B7R0.3 C=CCSC(C)CC m_7__22987946__14247828 [0,2,0,0,0,0|1,0,0]=3 347 B7R0.3 C=CCSC(C)CO m_7__6338928__3427024 [0,2,0,0,0,0|1,0,0]=3 348 B7R0.3 C=CCS[C@@H](C)CN m_7__20871330__3427024 [0,2,0,0,0,0|1,0,0]=3 349 B7R0.3 CC#CCC(C)NC m_2230__22400672__2463448 [0,2,0,0,0,0|1,0,1]=4 350 B7R0.3 CC(CCl)NCC#N m_2230__22399894__680932 [0,2,0,0,0,0|1,0,1]=4 351 B7R0.3 CC(CCl)NCCF m_2230__22399894__22320836 [0,2,0,0,0,0|1,0,1]=4 352 B7R0.3 CC(CCl)NCCO m_2230__22399894__6165700 [0,2,0,0,0,0|0,0,2]=4 353 B7R0.3 CC(CO)NCCF m_269862__9706110__15157990 [0,2,0,0,0,0|1,0,1]=4 354 B7R0.3 CC(CO)NCCO m_269862__7193048__15157990 [0,2,0,0,0,0|0,0,2]=4 355 B7R0.3 CC(CO)SCC#N m_7__6338928__5055 [0,2,0,0,0,0|1,0,1]=4 356 B7R0.3 CC(CO)SCCF m_7__6338928__22320828 [0,2,0,0,0,0|1,0,1]=4 357 B7R0.3 CC(CO)SCCN m_7__20871276__17610454 [0,2,0,0,0,0|1,0,1]=4 358 B7R0.3 CC(CO)SCCO m_7__6338928__102708 [0,2,0,0,0,0|0,0,2]=4 359 B7R0.3 CC=CCN(C)OC m_2230__679026__681024 [0,2,0,0,0,0|2,0,0]=4 360 B7R0.3 CCC(C)CCSC m_62__20058276__876088 [0,2,0,0,0,0|0,1,1]=4 361 B7R0.3 CCC(C)NCC#N m_2230__22399526__680932 [0,2,0,0,0,0|1,0,1]=4 362 B7R0.3 CCC(C)NCCF m_269862__9706110__7200134 [0,2,0,0,0,0|1,0,1]=4 363 B7R0.3 CCC(C)NCCO m_269862__7193048__7200134 [0,2,0,0,0,0|0,0,2]=4 364 B7R0.3 CCC(C)SCCN m_7__20871276__14247828 [0,2,0,0,0,0|1,0,1]=4 365 B7R0.3 CCC(C)SCCO m_7__128807__14247828 [0,2,0,0,0,0|0,0,2]=4 366 B7R0.3 CCCCC(C)NC m_269862__7193148__7200136 [0,2,0,0,0,0|1,0,1]=4 367 B7R0.3 CCCNC(C)CC m_2230__22399526__13271112 [0,2,0,0,0,0|1,0,1]=4 368 B7R0.3 CCCNC(C)CCl m_2230__22399894__13271112 [0,2,0,0,0,0|1,0,1]=4 369 B7R0.3 CCCNC(C)CO m_269862__7192572__15157990 [0,2,0,0,0,0|1,0,1]=4 370 B7R0.3 CCCN[C@H](C)CF m_2230__22399906__13271112 [0,2,0,0,0,0|1,0,1]=4 371 B7R0.3 CCCN[C@H](C)CN m_269982__22505378__13271120 [0,2,0,0,0,0|1,0,1]=4 372 B7R0.3 CCCN[C@H](C)CO m_2230__22399532__13271112 [0,2,0,0,0,0|1,0,1]=4 373 B7R0.3 CCCSC(C)CC m_7__22986886__14247828 [0,2,0,0,0,0|1,0,1]=4 374 B7R0.3 CCCSC(C)CO m_7__6338928__14390332 [0,2,0,0,0,0|1,0,1]=4 375 B7R0.3 CCCS[C@@H](C)CN m_7__20871330__14390332 [0,2,0,0,0,0|1,0,1]=4 376 B7R0.3 CCNCC(C)CC m_207__121480__7687310 [0,2,0,0,0,0|1,0,1]=4 377 B7R0.3 CCNCC(C)CO m_270004__8291276__24715004 [0,2,0,0,0,0|1,0,1]=4 378 B7R0.3 CCNCC(C)OC m_270004__9164178__24715004 [0,2,0,0,0,0|1,0,1]=4 379 B7R0.3 CCNCC(C)SC m_270004__8299206__24715004 [0,2,0,0,0,0|1,0,1]=4 380 B7R0.3 CCOCC(C)NC m_2230__22397432__2463448 [0,2,0,0,0,0|1,0,1]=4 381 B7R0.3 CCSCC(C)CC m_62__10709932__6469026 [0,2,0,0,0,0|1,0,1]=4 382 B7R0.3 CCSCC(C)CO m_7__6078536__5047 [0,2,0,0,0,0|1,0,1]=4 383 B7R0.3 CCSCC(C)OC m_62__875846__8738872 [0,2,0,0,0,0|1,0,1]=4 384 B7R0.3 CNC(=O)CNC=O m_22__387492__21204898 [0,2,0,0,0,0|1,0,1]=4 385 B7R0.3 CNC(C)CCCN m_269982__22505332__14064228 [0,2,0,0,0,0|1,0,1]=4 386 B7R0.3 CNC(C)CCCO m_2230__22399382__2463448 [0,2,0,0,0,0|0,0,2]=4 387 B7R0.3 CNC(C)CCOC m_2230__22398948__2463448 [0,2,0,0,0,0|0,0,2]=4 388 B7R0.3 CNC(C)CCSC m_2230__22399620__2463448 [0,2,0,0,0,0|0,1,1]=4 389 B7R0.3 CNCCC(C)NC m_269982__22505202__14064228 [0,2,0,0,0,0|1,0,1]=4 390 B7R0.3 CN[C@H](C)CN=[N+]=[N-] m_2230__22400752__2463448 [0,2,0,0,0,0|2,0,0]=4 391 B7R0.3 COC(C)CCSC m_7__22987798__5046 [0,2,0,0,0,0|0,1,1]=4 392 B7R0.3 COCCC(C)SC m_62__6956438__876088 [0,2,0,0,0,0|0,0,2]=4 393 B7R0.3 COCSC(C)CO m_7__6338928__6762 [0,2,0,0,0,0|2,0,0]=4 394 B7R0.3 CON(C)C/C=C\Br m_2230__679026__22384838 [0,2,0,0,0,0|2,0,0]=4 395 B7R0.3 CON(C)CC=CCl m_2230__679026__667198 [0,2,0,0,0,0|2,0,0]=4 396 B7R0.3 CSC(C)CCCO m_7__22988038__5046 [0,2,0,0,0,0|0,0,2]=4 397 B7R0.3 CSCSC(C)CO m_7__6338928__10542644 [0,2,0,0,0,0|2,0,0]=4 398 B7R0.3 C[C@@H](CN)SCC#N m_7__20871330__5055 [0,2,0,0,0,0|1,0,1]=4 399 B7R0.3 C[C@@H](CN)SCCF m_7__20871330__22320828 [0,2,0,0,0,0|1,0,1]=4 400 B7R0.3 C[C@@H](CN)SCCO m_7__20871330__6166114 [0,2,0,0,0,0|0,0,2]=4 401 B7R0.3 C[C@H](CF)NCC#N m_2230__22399906__680932 [0,2,0,0,0,0|1,0,1]=4 402 B7R0.3 C[C@H](CF)NCCF m_2230__22399906__22320836 [0,2,0,0,0,0|1,0,1]=4 403 B7R0.3 C[C@H](CF)NCCO m_2230__22399906__6165700 [0,2,0,0,0,0|0,0,2]=4 404 B7R0.3 C[C@H](CN)NCCF m_269982__22505378__22320816 [0,2,0,0,0,0|1,0,1]=4 405 B7R0.3 C[C@H](CN)NCCN m_269982__22505378__14439794 [0,2,0,0,0,0|1,0,1]=4 406 B7R0.3 C[C@H](CN)NCCO m_269982__22505378__10880280 [0,2,0,0,0,0|0,0,2]=4 407 B7R0.3 C[C@H](CO)NCC#N m_2230__22399532__680932 [0,2,0,0,0,0|1,0,1]=4 408 B7R0.3 C[C@H](CO)NCCF m_2230__22399532__22320836 [0,2,0,0,0,0|1,0,1]=4 409 B7R0.3 C[C@H](CO)NCCO m_2230__22399532__6165700 [0,2,0,0,0,0|0,0,2]=4 410 B7R0.5 C#CCC(C)N(C)C m_2230__16637570__2463448 [0,2,0,0,0,0|1,0,1]=4 411 B7R0.5 C=CCC(=O)N(C)C m_22__387202__16783972 [0,2,0,0,0,0|2,0,0]=4 412 B7R0.5 C=CCC(C)C(=O)N m_22__58357__15243024 [0,2,0,0,0,0|1,0,1]=4 413 B7R0.5 C=CCN(C)C(=O)C m_270062__16411500__15585492 [0,2,0,0,0,0|2,0,0]=4 414 B7R0.5 C=CCN(C)C(C)C m_2230__1041534__2463448 [0,2,0,0,0,0|1,0,0]=3 415 B7R0.5 CC(C)N(C)CC#N m_2230__3014482__680832 [0,2,0,0,0,0|1,0,1]=4 416 B7R0.5 CC(C)N(C)CCN m_269982__10894792__7393356 [0,2,0,0,0,0|1,0,1]=4 417 B7R0.5 CC(C)N(C)CCO m_2230__1169446__2463448 [0,2,0,0,0,0|0,0,2]=4 418 B7R0.5 CC(CC#N)N(C)C m_2230__7080758__2463448 [0,2,0,0,0,0|1,0,1]=4 419 B7R0.5 CC(CCO)N(C)C m_2230__11733728__2463448 [0,2,0,0,0,0|0,0,2]=4 420 B7R0.5 CC(NC=O)C(=O)N m_22__58357__24595862 [0,2,0,0,0,0|1,0,1]=4 421 B7R0.5 CCCC(C)N(C)C m_2230__679538__2463448 [0,2,0,0,0,0|1,0,1]=4 422 B7R0.5 CCCN(C)C(C)C m_2230__2261920__680832 [0,2,0,0,0,0|1,0,1]=4 423 B7R0.5 CCSC(C)C(C)C m_7__6286942__5047 [0,2,0,0,0,0|1,0,1]=4 424 B7R0.5 CNCC(C)N(C)C m_269982__22505106__14064228 [0,2,0,0,0,0|2,0,0]=4 425 B7R0.5 COC[C@H](C)N(C)C m_2230__22408216__2463448 [0,2,0,0,0,0|2,0,0]=4 426 B7R0.5 CSCC(C)C(C)C m_62__16618958__876088 [0,2,0,0,0,0|0,1,1]=4 427 B7R0.5 CSCC(C)N(C)C m_2230__5137432__2463448 [0,2,0,0,0,0|2,0,0]=4 428 B7R0.5 C[C@H](CCO)N(C)C m_2230__22409128__2463448 [0,2,0,0,0,0|0,0,2]=4 429 B7R0.7 C#CCC(C)NCC m_2230__22400136__22383854 [0,2,0,0,0,0|1,0,1]=4 430 B7R0.7 C#CCC(C)SCC m_7__22987770__23842164 [0,2,0,0,0,0|1,0,1]=4 431 B7R0.7 C=CCC(C)NCC m_2230__22399836__22383854 [0,2,0,0,0,0|1,0,0]=3 432 B7R0.7 C=CCC(C)SCC m_7__22987770__12913704 [0,2,0,0,0,0|1,0,0]=3 433 B7R0.7 C=CCN(C)CC#N m_2230__3014482__680312 [0,2,0,0,0,0|2,0,0]=4 434 B7R0.7 C=CCN(C)CC=C m_2230__9044904__680312 [0,2,0,0,0,0|2,0,0]=4 435 B7R0.7 C=CCN(C)CCC m_2230__2261920__680312 [0,2,0,0,0,0|2,0,0]=4 436 B7R0.7 C=CCN(C)CCF m_2230__9044904__22320836 [0,2,0,0,0,0|2,0,0]=4 437 B7R0.7 C=CCN(C)CCN m_269982__9963584__14439794 [0,2,0,0,0,0|2,0,0]=4 438 B7R0.7 C=CCN(C)CCO m_2230__5001112__2463448 [0,2,0,0,0,0|2,0,0]=4 439 B7R0.7 CCCC(C)NCC m_2230__22397382__22383854 [0,2,0,0,0,0|1,0,1]=4 440 B7R0.7 CCCC(C)SCC m_62__875846__10638528 [0,2,0,0,0,0|1,0,1]=4 441 B7R0.7 CCNC(C)CC#N m_2230__11757170__22383854 [0,2,0,0,0,0|1,0,1]=4 442 B7R0.7 CCNC(C)CCN m_269982__22505446__7393392 [0,2,0,0,0,0|1,0,1]=4 443 B7R0.7 CCNC(C)CCO m_2230__22400640__22383854 [0,2,0,0,0,0|0,0,2]=4 444 B7R0.7 CCNC(C)CNC m_269982__22505308__7393392 [0,2,0,0,0,0|2,0,0]=4 445 B7R0.7 CCNC(C)COC m_270004__8160850__8844972 [0,2,0,0,0,0|2,0,0]=4 446 B7R0.7 CCNC(C)CSC m_2230__22400632__22383854 [0,2,0,0,0,0|2,0,0]=4 447 B7R0.7 CCN[C@@H](C)CCO m_270004__13469994__24715004 [0,2,0,0,0,0|0,0,2]=4 448 B7R0.7 CCN[C@@H](C)CSC m_270004__23847226__24715004 [0,2,0,0,0,0|2,0,0]=4 449 B7R0.7 CCN[C@H](C)CCF m_2230__22404666__22383854 [0,2,0,0,0,0|1,0,1]=4 450 B7R0.7 CCN[C@H](C)COC m_2230__22399844__22383854 [0,2,0,0,0,0|2,0,0]=4 451 B7R0.7 CCSC(C)CCO m_7__22987770__14772890 [0,2,0,0,0,0|0,0,2]=4 452 B7R0.7 CCSC(C)COC m_7__22987770__6339266 [0,2,0,0,0,0|2,0,0]=4 453 B7R0.7 COCC(C)CSC m_7__20064958__5046 [0,2,0,0,0,0|2,0,0]=4 454 B7R0.10 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m_2230__23817502__2463448 [0,2,0,0,0,0|1,0,1]=4 468 B7R0.11 CNC(C)(C)CCF m_2230__22404530__2463448 [0,2,0,0,0,0|1,0,1]=4 469 B7R0.11 CNC(C)(C)CCN m_269982__17754758__14064228 [0,2,0,0,0,0|1,0,1]=4 470 B7R0.11 CNC(C)(C)CCO m_2230__22483446__2463448 [0,2,0,0,0,0|0,0,2]=4 471 B7R0.11 CNC(C)(C)COC m_2230__3081250__2463448 [0,2,0,0,0,0|2,0,0]=4 472 B7R0.11 CNC(C)(C)CSC m_2230__13445220__2463448 [0,2,0,0,0,0|2,0,0]=4 473 B7R0.11 CNCC(C)(C)C#N m_207__134027__20056876 [0,2,0,0,0,0|2,0,0]=4 474 B7R0.11 CNCC(C)(C)CF m_207__134027__23854226 [0,2,0,0,0,0|2,0,0]=4 475 B7R0.11 CSC(C)(C)CCO m_7__22988032__5046 [0,2,0,0,0,0|0,0,2]=4 476 B7R0.11 CSCC(C)(C)C#N m_7__23083206__5046 [0,2,0,0,0,0|2,0,0]=4 477 B7R0.11 CSCC(C)(C)CN m_7__20870816__5046 [0,2,0,0,0,0|2,0,0]=4 478 B7R0.11 CSCC(C)(C)CO m_7__15105602__5046 [0,2,0,0,0,0|2,0,0]=4 479 B7R0.12 C#CCC(CO)NC m_2230__22404322__2463448 [0,2,0,0,0,0|1,0,1]=4 480 B7R0.12 C=CCC(CC)NC m_2230__22404640__2463448 [0,2,0,0,0,0|1,0,0]=3 481 B7R0.12 C=CCC(CN)NC m_269982__22505184__14064228 [0,2,0,0,0,0|1,0,0]=3 482 B7R0.12 C=CCN(CC)CC m_2230__678602__680312 [0,2,0,0,0,0|2,0,0]=4 483 B7R0.12 C=CC[C@@H](CO)NC m_2230__22399868__2463448 [0,2,0,0,0,0|1,0,0]=3 484 B7R0.12 CCC(CC#N)NC m_2230__10902774__2463448 [0,2,0,0,0,0|1,0,1]=4 485 B7R0.12 CCC(CC)CNC m_207__134027__121234 [0,2,0,0,0,0|2,0,0]=4 486 B7R0.12 CCC(CC)CSC m_62__11972460__876088 [0,2,0,0,0,0|2,0,0]=4 487 B7R0.12 CCC(CCO)SC m_7__22987708__5046 [0,2,0,0,0,0|0,0,2]=4 488 B7R0.12 CCC(COC)NC m_269862__7193148__7201452 [0,2,0,0,0,0|2,0,0]=4 489 B7R0.12 CCC(COC)SC m_62__13910614__876088 [0,2,0,0,0,0|2,0,0]=4 490 B7R0.12 CCC(CSC)NC m_269862__7193148__15343962 [0,2,0,0,0,0|2,0,0]=4 491 B7R0.12 CCC(CSC)OC m_62__11244544__876088 [0,2,0,0,0,0|2,0,0]=4 492 B7R0.12 CCCC(CC)NC m_269862__7193148__8281932 [0,2,0,0,0,0|1,0,1]=4 493 B7R0.12 CCCC(CC)SC m_7__9582220__5046 [0,2,0,0,0,0|1,0,1]=4 494 B7R0.12 CCCC(CO)NC m_269862__7193148__15158016 [0,2,0,0,0,0|1,0,1]=4 495 B7R0.12 CCCC(CO)SC m_7__22987698__5046 [0,2,0,0,0,0|1,0,1]=4 496 B7R0.12 CC[C@@H](CCO)NC m_2230__22403216__2463448 [0,2,0,0,0,0|0,0,2]=4 497 B7R0.12 CC[C@H](COC)NC m_2230__22399910__2463448 [0,2,0,0,0,0|2,0,0]=4 498 B7R0.12 CNC(CO)CCF m_2230__22400124__2463448 [0,2,0,0,0,0|1,0,1]=4 499 B7R0.12 CNC(CO)CCO m_2230__22404146__2463448 [0,2,0,0,0,0|0,0,2]=4 500 B7R0.12 CN[C@@H](CF)COC m_2230__22402942__2463448 [0,2,0,0,0,0|2,0,0]=4 501 B7R0.12 CN[C@@H](CO)COC m_2230__22399896__2463448 [0,2,0,0,0,0|2,0,0]=4 502 B7R0.12 CN[C@@H](CO)CSC m_2230__22400134__2463448 [0,2,0,0,0,0|2,0,0]=4 503 B7R0.12 COC(CSC)OC m_7__14468178__5046 [0,2,0,0,0,0|2,0,0]=4 504 B7R0.9 CC(=O)N=S(=O)(C)C m_270062__21883458__15585492 [0,2,0,0,0,0|2,0,0]=4 505 B7R0.9 CC(=O)NC(C)(C)C m_270062__7598114__15585492 [0,2,0,0,0,0|1,0,0]=3 506 B7R0.9 CC(C)(C)CC(=O)N m_22__58357__294126 [0,2,0,0,0,0|0,0,0]=2 507 B7R0.9 CC(C)(C)NC(=N)N m_264822__4904404__3499596 [0,2,0,0,0,0|2,0,0]=4 508 B7R0.9 CC(C)(N)CC(=O)N m_270006__8381712__11615898 [0,2,0,0,0,0|0,0,0]=2 509 B7R0.9 CC(C)(O)CC(=O)N m_22__58357__9477924 [0,2,0,0,0,0|0,0,0]=2 510 B7R0.9 CC(C)CS(=O)(=O)C m_2714__4549066__862380 [0,2,0,0,0,0|1,0,0]=3 511 B7R0.9 CC(C)CS(=O)(=O)N m_40__79957__4485136 [0,2,0,0,0,0|1,0,0]=3 512 B7R0.9 CC(C)NS(=O)(=O)C m_40__23054146__124042 [0,2,0,0,0,0|2,0,0]=4 513 B7R0.9 CC(C)NS(=O)(=O)N m_40__79957__12876296 [0,2,0,0,0,0|2,0,0]=4 514 B7R0.9 CC(F)(F)CC(=O)N m_22__58357__9320318 [0,2,0,0,0,0|1,0,0]=3 515 B7R0.9 CC(F)CS(=O)(=O)C m_1500__766206__16913492 [0,2,0,0,0,0|2,0,0]=4 516 B7R0.9 CC(O)CS(=O)(=O)C m_2714__10908416__862380 [0,2,0,0,0,0|2,0,0]=4 517 B7R0.9 CN(C)CC(C)(C)C m_2230__2825146__2463448 [0,2,0,0,0,0|2,0,0]=4 518 B7R0.9 CN(C)CC(C)(C)N m_269982__11965582__14064228 [0,2,0,0,0,0|2,0,0]=4 519 B7R0.9 CN(C)CC(C)(C)O m_2230__4971308__2463448 [0,2,0,0,0,0|2,0,0]=4 520 B7R0.9 CN(C)CP(=O)(C)C m_2230__18687044__2463448 [0,2,0,0,0,0|2,0,0]=4 521 B7R0.9 CP(=O)(C)CC(=O)N m_22__58357__16915972 [0,2,0,0,0,0|1,0,0]=3 522 B7R0.9 CS(=O)(=O)CC(=O)N m_2714__10975720__862380 [0,2,0,0,0,0|2,0,0]=4 523 B7R0.9 NC(=O)CC(F)(F)F m_22__58357__1720042 [0,2,0,0,0,0|2,0,0]=4 524 B7R0.16 C=C(C(=O)N)C(C)C m_22__58357__14174170 [0,2,0,0,0,0|0,0,1]=3 525 B7R0.16 CC(=C(Br)C(=O)N)C m_22__58357__14033756 [0,2,0,0,0,0|0,0,2]=4 526 B7R0.16 CC(=C(C)C(=O)N)C m_22__58357__6724918 [0,2,0,0,0,0|0,0,2]=4 527 B7R0.16 CC(=C(F)C(=O)N)C m_22__58357__7101320 [0,2,0,0,0,0|0,0,2]=4 528 B7R0.16 CC(=O)N(C)C(C)C m_270062__7599344__15585492 [0,2,0,0,0,0|1,0,0]=3 529 B7R0.16 CC(=O)N(N)C(C)C m_240690__21583538__7404532 [0,2,0,0,0,0|1,0,0]=3 530 B7R0.16 CC(C(=O)N)C(F)F m_22__58357__20083468 [0,2,0,0,0,0|2,0,0]=4 531 B7R0.16 CC(C(=O)N)N(C)C m_2230__8254096__2463448 [0,2,0,0,0,0|1,0,0]=3 532 B7R0.16 CC(C)C(=O)C(=O)N m_22__58357__18312740 [0,2,0,0,0,0|0,0,1]=3 533 B7R0.16 CC(C)C(Br)C(=O)N m_22__58357__21466854 [0,2,0,0,0,0|0,0,0]=2 534 B7R0.16 CC(C)C(C)C(=O)N m_22__58357__4840314 [0,2,0,0,0,0|0,0,0]=2 535 B7R0.16 CC(C)C(C)N(C)C m_2230__1932980__2463448 [0,2,0,0,0,0|2,0,0]=4 536 B7R0.16 CC(C)C(C)S(=O)C m_265282__6286948__4273530 [0,2,0,0,0,0|1,0,0]=3 537 B7R0.16 CC(C)C(F)C(=O)N m_22__58357__9156240 [0,2,0,0,0,0|0,0,0]=2 538 B7R0.16 CC(C)C(N)C(=O)N m_270006__8381712__11615834 [0,2,0,0,0,0|0,0,0]=2 539 B7R0.16 CC(C)N(C)C(=O)N m_2554__6914366__788524 [0,2,0,0,0,0|1,0,0]=3 540 B7R0.16 CC(C)[C@@H](O)C(=O)N m_22__58357__10150820 [0,2,0,0,0,0|0,0,0]=2 541 B7R0.16 CC(N)C(C)C(=O)N m_270006__8381712__11616032 [0,2,0,0,0,0|1,0,0]=3 542 B7R0.16 CN(C)C(=O)C(=O)N m_22__58357__14788036 [0,2,0,0,0,0|1,0,1]=4 543 B7R0.16 C[C@@H](C(=O)N)N(C)C m_22__58357__12102916 [0,2,0,0,0,0|1,0,0]=3 544 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N m_240690__7368526__14033600 [0,2,0,0,0,0|1,0,0]=3 545 B7R0.16 C[C@H](C(=O)N)N(C)C m_2230__8251974__2463448 [0,2,0,0,0,0|1,0,0]=3 546 B7R0.16 C[C@H](F)[C@@H](N)C(=O)N m_240690__7368526__19728756 [0,2,0,0,0,0|1,0,0]=3 547 B7R0.13 CNC(C)(C)C(C)C m_2230__22393868__2463448 [0,2,0,0,0,0|2,0,0]=4 548 B7R0.13 CSC(C)(C)C(C)C m_7__9329086__5046 [0,2,0,0,0,0|2,0,0]=4 549 B7R0.14 CNC(C)C(C)(C)C m_269862__7193148__7202262 [0,2,0,0,0,0|2,0,0]=4 550 B7R0.14 CNC(C)C(C)(C)F m_2230__22404498__2463448 [0,2,0,0,0,0|2,0,0]=4 551 B7R0.14 CNC(C)C(C)(C)N m_269982__22505200__14064228 [0,2,0,0,0,0|2,0,0]=4 552 B7R0.14 CNC(C)C(C)(C)O m_269862__7193148__14430198 [0,2,0,0,0,0|2,0,0]=4 553 B7R0.14 CN[C@@H](C)C(C)(C)C m_2230__18365186__2463448 [0,2,0,0,0,0|2,0,0]=4 554 B7R0.14 CN[C@@H](C)C(C)(C)O m_2230__22399856__2463448 [0,2,0,0,0,0|2,0,0]=4 555 B7R0.15 C#CC(NC)C(C)C m_2230__22400952__2463448 [0,2,0,0,0,0|1,0,1]=4 556 B7R0.15 CC[C@@H](NC)C(C)C m_2230__22399878__2463448 [0,2,0,0,0,0|1,0,1]=4 557 B7R0.15 CNC(C#N)C(C)C m_2230__22394484__2463448 [0,2,0,0,0,0|1,0,1]=4 558 B7R0.15 CNC(CO)C(C)C m_269862__7193148__15158000 [0,2,0,0,0,0|0,0,2]=4 559 B7R0.15 CN[C@H](CO)C(C)C m_2230__8627184__2463448 [0,2,0,0,0,0|0,0,2]=4 560 B7R0.15 CSC(CN)C(C)C m_7__20871370__5046 [0,2,0,0,0,0|1,0,1]=4 561 B7R0.15 CSC(CO)C(C)C m_7__13607902__5046 [0,2,0,0,0,0|0,0,2]=4 562 B7R0.4 C#CCCSC(C)C m_62__2390328__18060662 [0,2,0,0,0,0|1,0,1]=4 563 B7R0.4 C#CCSCC(C)C m_7__27301__6266 [0,2,0,0,0,0|1,0,1]=4 564 B7R0.4 C=CCCCN(C)C m_2230__13768422__2463448 [0,2,0,0,0,0|2,0,0]=4 565 B7R0.4 C=CCCNC(C)C m_269862__11969960__7204804 [0,2,0,0,0,0|1,0,0]=3 566 B7R0.4 C=CCCSC(C)C m_62__2390328__9875548 [0,2,0,0,0,0|1,0,0]=3 567 B7R0.4 C=CCNCC(C)C m_207__109489__121216 [0,2,0,0,0,0|1,0,0]=3 568 B7R0.4 C=CCNCC(C)O m_273610__13857020__11516404 [0,2,0,0,0,0|2,0,0]=4 569 B7R0.4 C=CCSCC(C)C m_62__1010136__8363982 [0,2,0,0,0,0|1,0,0]=3 570 B7R0.4 C=CCSCC(C)F m_62__8363994__16913488 [0,2,0,0,0,0|2,0,0]=4 571 B7R0.4 C=CCSCC(C)O m_7__10953796__3427024 [0,2,0,0,0,0|2,0,0]=4 572 B7R0.4 C=CCSC[C@H](C)N m_7__20871336__3427024 [0,2,0,0,0,0|2,0,0]=4 573 B7R0.4 CC#CCSC(C)C m_62__2390328__8844818 [0,2,0,0,0,0|1,0,1]=4 574 B7R0.4 CC(C)CCC=NO m_4__388124__10542476 [0,2,0,0,0,0|0,0,1]=3 575 B7R0.4 CC(C)CNCCF m_207__18491578__121216 [0,2,0,0,0,0|1,0,1]=4 576 B7R0.4 CC(C)CNCCO m_207__121484__121216 [0,2,0,0,0,0|0,0,2]=4 577 B7R0.4 CC(C)CSCC#N m_7__27301__5055 [0,2,0,0,0,0|1,0,1]=4 578 B7R0.4 CC(C)CSCCF m_7__27301__22320828 [0,2,0,0,0,0|1,0,1]=4 579 B7R0.4 CC(C)CSCCN m_7__20871276__1010132 [0,2,0,0,0,0|1,0,1]=4 580 B7R0.4 CC(C)CSCCO m_7__27301__102708 [0,2,0,0,0,0|0,0,2]=4 581 B7R0.4 CC(C)NCC=CBr m_269862__15075178__7204804 [0,2,0,0,0,0|1,0,0]=3 582 B7R0.4 CC(C)NCC=CCl m_269862__13448030__7204804 [0,2,0,0,0,0|1,0,0]=3 583 B7R0.4 CC(C)NCCC#N m_63__8671900__91174 [0,2,0,0,0,0|1,0,1]=4 584 B7R0.4 CC(C)NCCCF m_269862__17065594__7204804 [0,2,0,0,0,0|1,0,1]=4 585 B7R0.4 CC(C)NCCCO m_269862__7192678__7204804 [0,2,0,0,0,0|0,0,2]=4 586 B7R0.4 CC(C)SC/C=C\Br m_7__22544354__5048 [0,2,0,0,0,0|1,0,0]=3 587 B7R0.4 CC(C)SCCC#N m_7__10953802__5048 [0,2,0,0,0,0|1,0,1]=4 588 B7R0.4 CC(C)SCCCN m_7__20871288__5048 [0,2,0,0,0,0|1,0,1]=4 589 B7R0.4 CC(C)SCCCO m_7__10972294__5048 [0,2,0,0,0,0|0,0,2]=4 590 B7R0.4 CC=CCNC(C)C m_269862__14317892__7204804 [0,2,0,0,0,0|1,0,0]=3 591 B7R0.4 CC=CCSC(C)C m_62__2390328__4275958 [0,2,0,0,0,0|1,0,0]=3 592 B7R0.4 CCC=NOC(C)C m_34__17309904__6950544 [0,2,0,0,0,0|2,0,0]=4 593 B7R0.4 CCCCNC(C)C m_269862__7192636__7204804 [0,2,0,0,0,0|1,0,1]=4 594 B7R0.4 CCCCSC(C)C m_62__2390328__7021588 [0,2,0,0,0,0|1,0,1]=4 595 B7R0.4 CCCNCC(C)C m_207__109413__121216 [0,2,0,0,0,0|1,0,1]=4 596 B7R0.4 CCCSCC(C)C m_62__1010136__875868 [0,2,0,0,0,0|1,0,1]=4 597 B7R0.4 CCNCCC(C)C m_207__121480__134014 [0,2,0,0,0,0|1,0,1]=4 598 B7R0.4 CCSCCC(C)C m_62__7021584__6469026 [0,2,0,0,0,0|0,1,1]=4 599 B7R0.4 CCSCSC(C)C m_7__22987770__12306378 [0,2,0,0,0,0|1,0,1]=4 600 B7R0.4 CNCCCC(C)C m_207__134027__7912414 [0,2,0,0,0,0|1,0,1]=4 601 B7R0.4 CNCCSC(C)C m_7__22986920__5048 [0,2,0,0,0,0|1,0,1]=4 602 B7R0.4 COCCNC(C)C m_269862__7192698__7204804 [0,2,0,0,0,0|0,0,2]=4 603 B7R0.4 COCCSC(C)C m_62__2390328__8623480 [0,2,0,0,0,0|0,0,2]=4 604 B7R0.4 COCSCC(C)C m_7__27301__6762 [0,2,0,0,0,0|0,0,2]=4 605 B7R0.4 CON=CCC(C)C m_4__461206__286510 [0,2,0,0,0,0|0,0,1]=3 606 B7R0.4 CSCCCC(C)C m_62__10892842__876088 [0,2,0,0,0,0|0,1,1]=4 607 B7R0.4 CSCCNC(C)C m_269862__11963794__7204804 [0,2,0,0,0,0|0,1,1]=4 608 B7R0.4 CSCCOC(C)C m_62__3569224__876088 [0,2,0,0,0,0|0,1,1]=4 609 B7R0.4 CSCCSC(C)C m_62__2390328__8268572 [0,2,0,0,0,0|0,1,1]=4 610 B7R0.4 CSCSCC(C)C m_7__27301__10542644 [0,2,0,0,0,0|0,1,1]=4 611 B7R0.6 C=C(Br)CSC(C)C m_7__22602174__5048 [0,2,0,0,0,0|1,0,0]=3 612 B7R0.6 C=C(C)CNC(=O)C m_270062__16411822__15585492 [0,2,0,0,0,0|0,0,2]=4 613 B7R0.6 C=C(C)CNC(=O)N m_2554__9045032__788524 [0,2,0,0,0,0|0,0,2]=4 614 B7R0.6 C=C(C)COC(=O)C m_1458__473186__13430124 [0,2,0,0,0,0|0,0,2]=4 615 B7R0.6 C=C(C)CSC(C)C m_62__6464432__2390352 [0,2,0,0,0,0|1,0,0]=3 616 B7R0.6 C=C(Cl)CNC(C)C m_269862__8258700__7204804 [0,2,0,0,0,0|1,0,0]=3 617 B7R0.6 C=C(Cl)CSC(C)C m_62__2390328__11986396 [0,2,0,0,0,0|1,0,0]=3 618 B7R0.6 C=C(F)CNC(C)C m_269862__18716750__7204804 [0,2,0,0,0,0|1,0,0]=3 619 B7R0.6 C=C(F)CSC(C)C m_62__2390328__17849118 [0,2,0,0,0,0|1,0,0]=3 620 B7R0.6 C=C(I)CSC(C)C m_62__2390328__18682540 [0,2,0,0,0,0|1,0,0]=3 621 B7R0.6 CC(=C=CC(=O)N)C m_22__58357__24596584 [0,2,0,0,0,0|0,0,2]=4 622 B7R0.6 CC(=CCC(=O)N)C m_22__58357__21288532 [0,2,0,0,0,0|0,0,1]=3 623 B7R0.6 CC(=O)CCC(=O)N m_22__58357__59017 [0,2,0,0,0,0|1,0,1]=4 624 B7R0.6 CC(=O)COC(=O)C m_1458__473186__481060 [0,2,0,0,0,0|1,0,1]=4 625 B7R0.6 CC(=O)NCC(=O)N m_270062__7598726__15585492 [0,2,0,0,0,0|1,0,1]=4 626 B7R0.6 CC(=O)NCC(=O)O m_274079__23468766__23468644 [0,2,0,0,0,0|1,0,1]=4 627 B7R0.6 CC(=O)NCC(Br)Br m_22__24037060__58844 [0,2,0,0,0,0|2,0,0]=4 628 B7R0.6 CC(=O)NCC(C)C m_270062__7594964__15585492 [0,2,0,0,0,0|0,0,0]=2 629 B7R0.6 CC(=O)NCC(C)F m_270062__13461140__15585492 [0,2,0,0,0,0|1,0,0]=3 630 B7R0.6 CC(=O)NCC(C)N m_270006__11615612__8404996 [0,2,0,0,0,0|1,0,0]=3 631 B7R0.6 CC(=O)NCC(C)O m_270062__7600310__15585492 [0,2,0,0,0,0|1,0,0]=3 632 B7R0.6 CC(=O)NCC(Cl)Cl m_270062__16416430__15585492 [0,2,0,0,0,0|2,0,0]=4 633 B7R0.6 CC(=O)NCC(F)Br m_22__24036590__58844 [0,2,0,0,0,0|2,0,0]=4 634 B7R0.6 CC(=O)NCC(F)Cl m_270062__21631484__15585492 [0,2,0,0,0,0|2,0,0]=4 635 B7R0.6 CC(=O)NCC(F)F m_270062__21586862__15585492 [0,2,0,0,0,0|2,0,0]=4 636 B7R0.6 CC(=O)NNC(C)C m_240690__13807952__7404532 [0,2,0,0,0,0|1,0,0]=3 637 B7R0.6 CC(=O)NOC(C)C m_270062__12127662__15585492 [0,2,0,0,0,0|1,0,0]=3 638 B7R0.6 CC(=O)OCC(=O)N m_276436__14076764__14088324 [0,2,0,0,0,0|1,0,1]=4 639 B7R0.6 CC(=O)OCC(=O)O m_279392__16563212__16560928 [0,2,0,0,0,0|1,0,1]=4 640 B7R0.6 CC(=O)OCC(C)C m_276436__14076548__14088324 [0,2,0,0,0,0|0,0,0]=2 641 B7R0.6 CC(=O)OCC(C)F m_276436__16886366__14088324 [0,2,0,0,0,0|1,0,0]=3 642 B7R0.6 CC(=O)OCC(C)O m_1458__473186__9780094 [0,2,0,0,0,0|1,0,0]=3 643 B7R0.6 CC(=O)OCC(F)F m_276436__14075804__14088324 [0,2,0,0,0,0|2,0,0]=4 644 B7R0.6 CC(=O)OC[C@H](C)F m_276436__21811854__14088324 [0,2,0,0,0,0|1,0,0]=3 645 B7R0.6 CC(C)C#CC(=O)N m_22__58357__10803926 [0,2,0,0,0,0|0,0,1]=3 646 B7R0.6 CC(C)C=CC(=O)N m_22__58357__16485490 [0,2,0,0,0,0|0,0,1]=3 647 B7R0.6 CC(C)CCC(=O)N m_22__58357__60606 [0,2,0,0,0,0|0,0,0]=2 648 B7R0.6 CC(C)CCS(=O)C m_265282__6201344__4273530 [0,2,0,0,0,0|0,0,1]=3 649 B7R0.6 CC(C)CNC(=N)N m_58668__2550732__2227896 [0,2,0,0,0,0|1,0,0]=3 650 B7R0.6 CC(C)CNC(=O)N m_2554__826740__788524 [0,2,0,0,0,0|0,0,0]=2 651 B7R0.6 CC(C)CNC(C)C m_269862__7192632__7204804 [0,2,0,0,0,0|1,0,1]=4 652 B7R0.6 CC(C)COC(=O)N m_282070__22187654__22151494 [0,2,0,0,0,0|0,0,0]=2 653 B7R0.6 CC(C)CSC(C)C m_62__1010136__2390352 [0,2,0,0,0,0|1,0,1]=4 654 B7R0.6 CC(C)NCC(=O)N m_270006__8381712__11954852 [0,2,0,0,0,0|0,0,0]=2 655 B7R0.6 CC(C)NCC(F)Cl m_269862__21631480__7204804 [0,2,0,0,0,0|1,0,1]=4 656 B7R0.6 CC(C)OCC(=O)N m_22__58357__1944466 [0,2,0,0,0,0|0,0,0]=2 657 B7R0.6 CC(C)ONC(=O)N m_2554__10691412__788524 [0,2,0,0,0,0|1,0,0]=3 658 B7R0.6 CC(C)SCC(=O)N m_7__10975714__5048 [0,2,0,0,0,0|0,0,0]=2 659 B7R0.6 CC(C)SCC(=O)O m_7__26823__5048 [0,2,0,0,0,0|0,0,0]=2 660 B7R0.6 CC(C)SCC(F)F m_7__22987700__5048 [0,2,0,0,0,0|1,0,1]=4 661 B7R0.6 CC(C)SC[C@H](C)N m_7__20871336__5048 [0,2,0,0,0,0|1,0,1]=4 662 B7R0.6 CC(F)CNC(=N)N m_58668__13461132__2227896 [0,2,0,0,0,0|2,0,0]=4 663 B7R0.6 CC(F)CNC(=O)N m_2554__13461126__788524 [0,2,0,0,0,0|1,0,0]=3 664 B7R0.6 CC(F)CNC(C)C m_269862__13461136__7204804 [0,2,0,0,0,0|1,0,1]=4 665 B7R0.6 CC(F)CSC(C)C m_62__2390328__16913488 [0,2,0,0,0,0|1,0,1]=4 666 B7R0.6 CC(N)/C=C/C(=O)N m_240690__7368526__16465528 [0,2,0,0,0,0|1,0,1]=4 667 B7R0.6 CC(N)C#CC(=O)N m_240690__7368526__19726652 [0,2,0,0,0,0|1,0,1]=4 668 B7R0.6 CC(N)CCC(=O)N m_270006__8381712__11616034 [0,2,0,0,0,0|1,0,0]=3 669 B7R0.6 CC(N)CNC(=O)N m_273454__11052962__11052394 [0,2,0,0,0,0|1,0,0]=3 670 B7R0.6 CC(O)CNC(=N)N m_58668__2991286__2227896 [0,2,0,0,0,0|2,0,0]=4 671 B7R0.6 CC(O)CNC(C)C m_63__8671900__10903854 [0,2,0,0,0,0|0,0,2]=4 672 B7R0.6 CC(O)CSC(C)C m_7__10953796__5048 [0,2,0,0,0,0|0,0,2]=4 673 B7R0.6 CN(C)CCC(=O)N m_22__58357__7207492 [0,2,0,0,0,0|1,0,0]=3 674 B7R0.6 CN(C)CCC(=O)O m_269956__7329822__22415160 [0,2,0,0,0,0|1,0,0]=3 675 B7R0.6 C[C@@H](O)CNC(=O)N m_2554__13191906__788524 [0,2,0,0,0,0|1,0,0]=3 676 B7R0.6 NC(=O)CCC(Cl)Cl m_22__58357__24596478 [0,2,0,0,0,0|2,0,0]=4 677 B7R0.6 NC(=O)CCC(F)F m_22__58357__9580332 [0,2,0,0,0,0|2,0,0]=4 678 B7R0.6 NC(=O)COC(F)F m_22__58357__10118400 [0,2,0,0,0,0|2,0,0]=4 679 B7R0.6 NC(=O)NCC(F)Cl m_2554__21631470__788524 [0,2,0,0,0,0|2,0,0]=4 680 B7R0.6 NC(=O)NCC(F)F m_2554__21586840__788524 [0,2,0,0,0,0|2,0,0]=4 681 B7R0.6 NC(=O)OCC(F)F m_282070__22187654__22152142 [0,2,0,0,0,0|2,0,0]=4 682 B7R0.8 C=CCNC(C)(C)C m_2230__3081242__680312 [0,2,0,0,0,0|1,0,0]=3 683 B7R0.8 C=CCSC(C)(F)F m_7__22987946__16733592 [0,2,0,0,0,0|2,0,0]=4 684 B7R0.8 CC(C)(C)CC=NO m_4__388124__7831638 [0,2,0,0,0,0|0,0,1]=3 685 B7R0.8 CC(C)(C)NCC#N m_2230__3081242__680932 [0,2,0,0,0,0|1,0,1]=4 686 B7R0.8 CC(C)(C)NCCF m_2230__3081242__22320836 [0,2,0,0,0,0|1,0,1]=4 687 B7R0.8 CC(C)(C)NCCO m_2230__3081242__6165700 [0,2,0,0,0,0|0,0,2]=4 688 B7R0.8 CCCNC(C)(C)C m_2230__3081242__13271112 [0,2,0,0,0,0|1,0,1]=4 689 B7R0.8 CCNCC(C)(C)C m_207__121480__2989454 [0,2,0,0,0,0|1,0,1]=4 690 B7R0.8 CCNCC(C)(C)F m_270004__8160850__17541580 [0,2,0,0,0,0|1,0,1]=4 691 B7R0.8 CCNCC(C)(C)O m_270004__8296166__24715004 [0,2,0,0,0,0|1,0,1]=4 692 B7R0.8 CCSCC(C)(C)C m_7__9780138__5047 [0,2,0,0,0,0|1,0,1]=4 693 B7R0.8 CCSCC(C)(C)F m_62__23075284__6469026 [0,2,0,0,0,0|1,0,1]=4 694 B7R0.8 CCSCC(C)(C)N m_7__22849170__5047 [0,2,0,0,0,0|1,0,1]=4 695 B7R0.8 CCSCC(C)(C)O m_7__22987452__5047 [0,2,0,0,0,0|1,0,1]=4 696 B7R0.8 CNCCC(C)(C)C m_207__134027__2989446 [0,2,0,0,0,0|1,0,1]=4 697 B7R0.8 CSCCC(C)(C)C m_62__9143140__876088 [0,2,0,0,0,0|0,1,1]=4 698 B7R0.8 CSCCC(C)(C)F m_62__16725006__876088 [0,2,0,0,0,0|0,1,1]=4 699 B7R0.8 CSCCC(C)(C)O m_7__11758710__5046 [0,2,0,0,0,0|0,1,1]=4 700 B5R1.3 CSC1CC1 m_7__22987858__5046 [1,0,0,1,0,0|1,0,1]=4 701 B7R1.1 CCN1CC=CC1 m_270004__24150350__24715004 [0,1,0,1,0,0|2,0,0]=4 702 B7R1.1 CNC1CCCC1 m_207__134027__121596 [0,1,0,1,0,0|1,0,1]=4 703 B7R1.1 CSC1CC=CC1 m_62__875850__16736522 [0,1,0,1,0,0|1,0,0]=3 704 B7R1.1 CSC1CCCC1 m_62__875850__10178584 [0,1,0,1,0,0|1,0,1]=4 705 B7R1.1 CSC1CCOC1 m_62__875850__10903820 [0,1,0,1,0,0|0,0,2]=4 706 B7R1.1 CSC1CCSC1 m_7__15266840__5046 [0,1,0,1,0,0|0,1,1]=4 707 B7R1.1 CS[C@H]1CCNC1 m_7__22987620__5046 [0,1,0,1,0,0|1,0,1]=4 708 B7R1.2 C=C1CCN(C1)C m_2230__13656258__2463448 [0,1,0,1,0,0|2,0,0]=4 709 B7R1.2 CC1=NNC(=O)C1 m_49__88900__16105454 [0,1,0,1,0,0|1,0,1]=4 710 B7R1.2 CC1CCN(C1)C m_2230__6813990__2463448 [0,1,0,1,0,0|1,0,1]=4 711 B7R1.2 CC1CNC(=N)N1 m_264822__4904404__10159828 [0,1,0,1,0,0|2,0,0]=4 712 B7R1.2 CN1CC=C(C1)F m_2230__18187030__2463448 [0,1,0,1,0,0|2,0,0]=4 713 B7R1.2 CN1CCC(=O)N1 m_2230__13421152__2463448 [0,1,0,1,0,0|2,0,0]=4 714 B7R1.2 CN1CNC(=O)C1 m_2230__13616464__2463448 [0,1,0,1,0,0|1,0,0]=3 715 B7R1.3 CN1CC=CCC1 m_2230__8375936__2463448 [0,1,0,1,0,0|2,0,0]=4 716 B7R1.4 CC1CCCN1C m_2230__6338494__2463448 [0,1,0,1,0,0|1,0,1]=4 717 B7R1.5 CC1CC1C=NO m_4__388124__7048186 [0,1,0,1,0,0|0,0,1]=3 718 B7R1.5 CCNC1CC1C m_270004__8294846__24715004 [0,1,0,1,0,0|1,0,1]=4 719 B7R1.5 CSCC1CC1C m_62__12216592__876088 [0,1,0,1,0,0|0,1,1]=4 720 B7R1.5 CSC[C@@H]1C[C@H]1C m_62__875850__23861442 [0,1,0,1,0,0|0,1,1]=4 721 B7R1.6 CNCC1COC1 m_207__134027__22332602 [0,1,0,1,0,0|2,0,0]=4 722 B7R1.6 CSCC1CCC1 m_62__6007776__876088 [0,1,0,1,0,0|2,0,0]=4 723 B7R1.6 CSCC1COC1 m_62__875850__16613884 [0,1,0,1,0,0|2,0,0]=4 724 B7R1.10 CC1CC(=NO)C1 m_4__388124__10542474 [0,1,0,1,0,0|0,0,1]=3 725 B7R1.10 CCN1CC(C1)C m_270004__9576442__24715004 [0,1,0,1,0,0|1,0,1]=4 726 B7R1.15 CC1CN(C1C)C m_2230__10547152__2463448 [0,1,0,1,0,0|2,0,0]=4 727 B7R1.21 CNCC1(CC1)C m_207__134027__9439020 [0,1,0,1,0,0|2,0,0]=4 728 B7R1.21 CNCC1(CC1)F m_207__134027__9479524 [0,1,0,1,0,0|2,0,0]=4 729 B7R1.22 CC=C(C)C1CC1 m_271570__11830330__16886636 [0,1,0,1,0,0|1,0,1]=4 730 B7R1.22 CN[C@@H](C)C1CC1 m_2230__22400112__2463448 [0,1,0,1,0,0|1,0,1]=4 731 B7R1.25 CNC1(CCC1)C m_2230__22404308__2463448 [0,1,0,1,0,0|1,0,1]=4 732 B7R1.25 CNC1(CNC1)C m_269982__22505400__14064228 [0,1,0,1,0,0|2,0,0]=4 733 B7R1.25 CNC1(COC1)C m_2230__22396972__2463448 [0,1,0,1,0,0|2,0,0]=4 734 B7R1.25 CNC1(CSC1)C m_2230__22397754__2463448 [0,1,0,1,0,0|2,0,0]=4 735 B7R1.27 CNC1(CC1C)C m_2230__22397712__2463448 [0,1,0,1,0,0|1,0,1]=4 736 B7R1.12 C=C1CC1C(=O)N m_22__58357__12102878 [0,1,0,1,0,0|0,0,2]=4 737 B7R1.12 CC1CC1C(=O)N m_22__58357__59041 [0,1,0,1,0,0|0,0,0]=2 738 B7R1.12 CC1CC1N(C)C m_2230__16770468__2463448 [0,1,0,1,0,0|2,0,0]=4 739 B7R1.12 C[C@H]1C[C@H]1C(=O)N m_22__58357__16716548 [0,1,0,1,0,0|0,0,0]=2 740 B7R1.12 NC(=O)C1CC1Cl m_22__58357__17825128 [0,1,0,1,0,0|1,0,0]=3 741 B7R1.12 NC(=O)C1CC1F m_22__58357__14051810 [0,1,0,1,0,0|1,0,0]=3 742 B7R1.12 NC(=O)[C@H]1C[C@H]1F m_22__58357__16891532 [0,1,0,1,0,0|1,0,0]=3 743 B7R1.16 CN1CC(C1)(C)O m_2230__7555612__2463448 [0,1,0,1,0,0|2,0,0]=4 744 B7R1.20 CC(=O)NC1CC1 m_270062__7594954__15585492 [0,1,0,1,0,0|1,0,0]=3 745 B7R1.20 CC(=O)OC1CC1 m_276436__14080770__14088324 [0,1,0,1,0,0|1,0,0]=3 746 B7R1.20 CC(C)SC1CC1 m_7__22987858__5048 [0,1,0,1,0,0|1,0,1]=4 747 B7R1.20 CN(C)CC1CC1 m_2230__1000274__2463448 [0,1,0,1,0,0|2,0,0]=4 748 B7R1.20 CS(=O)CC1CC1 m_265282__10978854__4273530 [0,1,0,1,0,0|1,0,0]=3 749 B7R1.20 N=C(N)NC1CC1 m_58668__2550730__2227896 [0,1,0,1,0,0|2,0,0]=4 750 B7R1.20 NC(=O)C=C1CC1 m_22__58357__16794910 [0,1,0,1,0,0|0,0,2]=4 751 B7R1.20 NC(=O)CC1CC1 m_22__58357__592954 [0,1,0,1,0,0|0,0,0]=2 752 B7R1.20 NC(=O)NC1CC1 m_2554__826736__788524 [0,1,0,1,0,0|1,0,0]=3 753 B7R1.20 NC(=O)OC1CC1 m_282070__22187654__22151628 [0,1,0,1,0,0|1,0,0]=3 754 B7R1.7 C#CCSC1CC1 m_7__22987858__6266 [0,1,0,1,0,0|1,0,1]=4 755 B7R1.7 C=CCSC1CC1 m_7__22987858__3427024 [0,1,0,1,0,0|1,0,0]=3 756 B7R1.7 CCCSC1CC1 m_7__22986886__16761930 [0,1,0,1,0,0|1,0,1]=4 757 B7R1.7 CCNCC1CC1 m_207__121480__2989440 [0,1,0,1,0,0|1,0,1]=4 758 B7R1.7 CCSCC1CC1 m_62__875846__7141822 [0,1,0,1,0,0|1,0,1]=4 759 B7R1.7 COCSC1CC1 m_7__22987858__6762 [0,1,0,1,0,0|2,0,0]=4 760 B7R1.7 CSCCC1CC1 m_62__875850__9143162 [0,1,0,1,0,0|0,1,1]=4 761 B7R1.7 CSCSC1CC1 m_7__22987858__10542644 [0,1,0,1,0,0|2,0,0]=4 762 B7R1.7 FCCSC1CC1 m_7__22987858__22320828 [0,1,0,1,0,0|1,0,1]=4 763 B7R1.7 N#CCSC1CC1 m_7__22987858__5055 [0,1,0,1,0,0|1,0,1]=4 764 B7R1.7 NCCSC1CC1 m_7__20871276__16761930 [0,1,0,1,0,0|1,0,1]=4 765 B7R1.7 OCCSC1CC1 m_7__22987858__102708 [0,1,0,1,0,0|0,0,2]=4