0 B5R0.3 BrCC(Br)CBr MCULE-7323713039 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.3 C#CC(=O)CC MCULE-1563732373 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.3 C#CC(=O)NC MCULE-8852565705 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.3 C#CC(=O)OC MCULE-5108326717 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.3 C#CC(N)CO MCULE-2442851523 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.3 C#CC(N)CO MCULE-3866086926 [0,0,0,0,0,0|2,0,2]=4 6 B5R0.3 C#C[C@H](N)CO MCULE-2312982984 [0,0,0,0,0,0|2,0,2]=4 7 B5R0.3 C#C[C@H](N)CO MCULE-8124038281 [0,0,0,0,0,0|2,0,2]=4 8 B5R0.3 C#C[C@H](N)CO MCULE-8753140181 [0,0,0,0,0,0|2,0,2]=4 9 B5R0.3 C#C[C@H](N)CO MCULE-9874393436 [0,0,0,0,0,0|2,0,2]=4 10 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [0,0,0,0,0,0|3,0,1]=4 11 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [0,0,0,0,0,0|3,0,1]=4 12 B5R0.3 C=C(C#N)CBr MCULE-5784758688 [0,0,0,0,0,0|3,0,1]=4 13 B5R0.3 C=C(C#N)CCl MCULE-7893676781 [0,0,0,0,0,0|3,0,1]=4 14 B5R0.3 C=C(C#N)CO MCULE-4330549804 [0,0,0,0,0,0|2,0,1]=3 15 B5R0.3 C=C(C=O)CC MCULE-2875154067 [0,0,0,0,0,0|2,0,2]=4 16 B5R0.3 C=C(CBr)CBr MCULE-2855078657 [0,0,0,0,0,0|3,0,0]=3 17 B5R0.3 C=C(CC)CBr MCULE-1652422688 [0,0,0,0,0,0|3,0,0]=3 18 B5R0.3 C=C(CC)CC MCULE-9174509622 [0,0,0,0,0,0|3,0,0]=3 19 B5R0.3 C=C(CC)CN MCULE-2269385026 [0,0,0,0,0,0|3,0,0]=3 20 B5R0.3 C=C(CC)CN MCULE-3033447984 [0,0,0,0,0,0|3,0,0]=3 21 B5R0.3 C=C(CC)CO MCULE-8127766352 [0,0,0,0,0,0|2,0,0]=2 22 B5R0.3 C=C(CCl)CCl MCULE-2574913289 [0,0,0,0,0,0|3,0,0]=3 23 B5R0.3 C=C(CI)CI MCULE-7592017619 [0,0,0,0,0,0|3,0,0]=3 24 B5R0.3 C=C(CN)CN MCULE-5063132725 [0,0,0,0,0,0|3,0,0]=3 25 B5R0.3 C=C(CO)CBr MCULE-9563589949 [0,0,0,0,0,0|2,0,0]=2 26 B5R0.3 C=C(CO)CO MCULE-2682601949 [0,0,0,0,0,0|1,0,0]=1 27 B5R0.3 C=CC(=O)C=C MCULE-8555160354 [0,0,0,0,0,0|2,0,2]=4 28 B5R0.3 C=CC(=O)CC MCULE-7277696617 [0,0,0,0,0,0|2,0,1]=3 29 B5R0.3 C=CC(=O)NC MCULE-5619481947 [0,0,0,0,0,0|3,0,1]=4 30 B5R0.3 C=CC(=O)NN MCULE-4327484127 [0,0,0,0,0,0|3,0,1]=4 31 B5R0.3 C=CC(=O)NN MCULE-4961696321 [0,0,0,0,0,0|3,0,1]=4 32 B5R0.3 C=CC(=O)NO MCULE-9528737042 [0,0,0,0,0,0|2,0,1]=3 33 B5R0.3 C=CC(=O)OC MCULE-6010665978 [0,0,0,0,0,0|3,0,1]=4 34 B5R0.3 C=CC(N)CO MCULE-2457433196 [0,0,0,0,0,0|2,0,2]=4 35 B5R0.3 C=CC(N)CO MCULE-6697949182 [0,0,0,0,0,0|2,0,2]=4 36 B5R0.3 C=CC(N)CO MCULE-7137123222 [0,0,0,0,0,0|2,0,2]=4 37 B5R0.3 C=CC(N)CO MCULE-8388687355 [0,0,0,0,0,0|2,0,2]=4 38 B5R0.3 C=CC(O)CO MCULE-6172654550 [0,0,0,0,0,0|1,0,3]=4 39 B5R0.3 C=C[C@@H](N)CO MCULE-1000343618 [0,0,0,0,0,0|2,0,2]=4 40 B5R0.3 C=C[C@@H](N)CO MCULE-1074988940 [0,0,0,0,0,0|2,0,2]=4 41 B5R0.3 C=C[C@@H](N)CO MCULE-3685491078 [0,0,0,0,0,0|2,0,2]=4 42 B5R0.3 C=C[C@@H](N)CO MCULE-4969611575 [0,0,0,0,0,0|2,0,2]=4 43 B5R0.3 C=C[C@@H](O)CO MCULE-5957455616 [0,0,0,0,0,0|1,0,3]=4 44 B5R0.3 C=C[C@H](N)CO MCULE-2834725512 [0,0,0,0,0,0|2,0,2]=4 45 B5R0.3 C=C[C@H](N)CO MCULE-3281738311 [0,0,0,0,0,0|2,0,2]=4 46 B5R0.3 C=C[C@H](N)CO MCULE-3551585090 [0,0,0,0,0,0|2,0,2]=4 47 B5R0.3 C=C[C@H](N)CO MCULE-9055556349 [0,0,0,0,0,0|2,0,2]=4 48 B5R0.3 C=C[C@H](O)CO MCULE-6068203844 [0,0,0,0,0,0|1,0,3]=4 49 B5R0.3 C=C[C@H](O)CO MCULE-9367072182 [0,0,0,0,0,0|1,0,3]=4 50 B5R0.3 CC(=CCl)CCl MCULE-2732105685 [0,0,0,0,0,0|3,0,1]=4 51 B5R0.3 CC(=CI)CI MCULE-3347686188 [0,0,0,0,0,0|3,0,1]=4 52 B5R0.3 CC(=CI)CO MCULE-8491569199 [0,0,0,0,0,0|2,0,1]=3 53 B5R0.3 CC(=NO)CS MCULE-9694340512 [0,0,0,0,0,0|2,1,0]=3 54 B5R0.3 CC(C#N)CO MCULE-1644391554 [0,0,0,0,0,0|2,0,2]=4 55 B5R0.3 CC(CBr)CBr MCULE-7586113999 [0,0,0,0,0,0|3,0,1]=4 56 B5R0.3 CC(CCl)CBr MCULE-5101754687 [0,0,0,0,0,0|3,0,1]=4 57 B5R0.3 CC(CCl)CCl MCULE-1169456620 [0,0,0,0,0,0|3,0,1]=4 58 B5R0.3 CC(CI)CI MCULE-4568725580 [0,0,0,0,0,0|3,0,1]=4 59 B5R0.3 CC(CN)CCl MCULE-2423692318 [0,0,0,0,0,0|3,0,1]=4 60 B5R0.3 CC(CN)CCl MCULE-8419541212 [0,0,0,0,0,0|3,0,1]=4 61 B5R0.3 CC(CN)CN MCULE-1464804013 [0,0,0,0,0,0|3,0,1]=4 62 B5R0.3 CC(CN)CN MCULE-3273307813 [0,0,0,0,0,0|3,0,1]=4 63 B5R0.3 CC(CN)CO MCULE-5880795484 [0,0,0,0,0,0|2,0,1]=3 64 B5R0.3 CC(CN)CO MCULE-8083007887 [0,0,0,0,0,0|2,0,1]=3 65 B5R0.3 CC(CO)CBr MCULE-3815333295 [0,0,0,0,0,0|2,0,1]=3 66 B5R0.3 CC(CO)CBr MCULE-5695891877 [0,0,0,0,0,0|2,0,1]=3 67 B5R0.3 CC(CO)CO MCULE-2340730326 [0,0,0,0,0,0|1,0,1]=2 68 B5R0.3 CC(CO)CS MCULE-1990992504 [0,0,0,0,0,0|1,1,1]=3 69 B5R0.3 CC(CO)NN MCULE-3362748538 [0,0,0,0,0,0|3,0,1]=4 70 B5R0.3 CC(CO)NN MCULE-4440318216 [0,0,0,0,0,0|3,0,1]=4 71 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [0,0,0,0,0,0|3,0,0]=3 72 B5R0.3 CC/C(=N/O)/N MCULE-2794748611 [0,0,0,0,0,0|3,0,0]=3 73 B5R0.3 CC/C(=N/O)/N MCULE-7162577220 [0,0,0,0,0,0|3,0,0]=3 74 B5R0.3 CC=C(C)CC MCULE-5790494157 [0,0,0,0,0,0|3,0,1]=4 75 B5R0.3 CC=C(C)CCl MCULE-2444762050 [0,0,0,0,0,0|3,0,1]=4 76 B5R0.3 CCC(=N)OC MCULE-4123543795 [0,0,0,0,0,0|4,0,0]=4 77 B5R0.3 CCC(=N)OC MCULE-5346320805 [0,0,0,0,0,0|4,0,0]=4 78 B5R0.3 CCC(=NO)C MCULE-1859652505 [0,0,0,0,0,0|3,0,0]=3 79 B5R0.3 CCC(=O)CBr MCULE-7825573294 [0,0,0,0,0,0|2,0,0]=2 80 B5R0.3 CCC(=O)CC MCULE-8236549739 [0,0,0,0,0,0|2,0,0]=2 81 B5R0.3 CCC(=O)CCl MCULE-9019890380 [0,0,0,0,0,0|2,0,0]=2 82 B5R0.3 CCC(=O)CN MCULE-1863418812 [0,0,0,0,0,0|2,0,0]=2 83 B5R0.3 CCC(=O)CN MCULE-5831164340 [0,0,0,0,0,0|2,0,0]=2 84 B5R0.3 CCC(=O)CO MCULE-8674894820 [0,0,0,0,0,0|1,0,0]=1 85 B5R0.3 CCC(=O)NC MCULE-5612060170 [0,0,0,0,0,0|3,0,0]=3 86 B5R0.3 CCC(=O)NN MCULE-1803705917 [0,0,0,0,0,0|3,0,0]=3 87 B5R0.3 CCC(=O)NO MCULE-1033164448 [0,0,0,0,0,0|2,0,0]=2 88 B5R0.3 CCC(=O)OC MCULE-7384824725 [0,0,0,0,0,0|3,0,0]=3 89 B5R0.3 CCC(=O)SC MCULE-9712192191 [0,0,0,0,0,0|3,0,0]=3 90 B5R0.3 CCC(Br)CBr MCULE-5254958560 [0,0,0,0,0,0|3,0,1]=4 91 B5R0.3 CCC(Br)CC MCULE-7435628721 [0,0,0,0,0,0|3,0,1]=4 92 B5R0.3 CCC(Br)CO MCULE-7211805716 [0,0,0,0,0,0|2,0,1]=3 93 B5R0.3 CCC(C)CBr MCULE-5451416952 [0,0,0,0,0,0|3,0,1]=4 94 B5R0.3 CCC(C)CC MCULE-2542807917 [0,0,0,0,0,0|3,0,1]=4 95 B5R0.3 CCC(C)CCl MCULE-7450386476 [0,0,0,0,0,0|3,0,1]=4 96 B5R0.3 CCC(C)CI MCULE-5444509280 [0,0,0,0,0,0|3,0,1]=4 97 B5R0.3 CCC(C)CN MCULE-2777327284 [0,0,0,0,0,0|3,0,1]=4 98 B5R0.3 CCC(C)CN MCULE-7014901600 [0,0,0,0,0,0|3,0,1]=4 99 B5R0.3 CCC(C)CO MCULE-6521026296 [0,0,0,0,0,0|2,0,1]=3 100 B5R0.3 CCC(C)CS MCULE-7795095685 [0,0,0,0,0,0|2,1,1]=4 101 B5R0.3 CCC(C)NO MCULE-1247092627 [0,0,0,0,0,0|3,0,1]=4 102 B5R0.3 CCC(C)NO MCULE-6169819668 [0,0,0,0,0,0|3,0,1]=4 103 B5R0.3 CCC(Cl)CCl MCULE-5122022797 [0,0,0,0,0,0|3,0,1]=4 104 B5R0.3 CCC(Cl)CO MCULE-1756262629 [0,0,0,0,0,0|2,0,1]=3 105 B5R0.3 CCC(F)CBr MCULE-3226052264 [0,0,0,0,0,0|3,0,1]=4 106 B5R0.3 CCC(F)CN MCULE-1291385596 [0,0,0,0,0,0|3,0,1]=4 107 B5R0.3 CCC(F)CN MCULE-7421331323 [0,0,0,0,0,0|3,0,1]=4 108 B5R0.3 CCC(I)CC MCULE-1119844552 [0,0,0,0,0,0|3,0,1]=4 109 B5R0.3 CCC(N)CBr MCULE-3567691924 [0,0,0,0,0,0|3,0,1]=4 110 B5R0.3 CCC(N)CC MCULE-4261937519 [0,0,0,0,0,0|3,0,1]=4 111 B5R0.3 CCC(N)CC MCULE-5899128891 [0,0,0,0,0,0|3,0,1]=4 112 B5R0.3 CCC(N)CN MCULE-6911484065 [0,0,0,0,0,0|3,0,1]=4 113 B5R0.3 CCC(N)CN MCULE-8376506697 [0,0,0,0,0,0|3,0,1]=4 114 B5R0.3 CCC(N)CO MCULE-1135809021 [0,0,0,0,0,0|2,0,1]=3 115 B5R0.3 CCC(N)CO MCULE-7588854111 [0,0,0,0,0,0|2,0,1]=3 116 B5R0.3 CCC(O)CBr MCULE-4205031860 [0,0,0,0,0,0|2,0,2]=4 117 B5R0.3 CCC(O)CC MCULE-5553645045 [0,0,0,0,0,0|2,0,2]=4 118 B5R0.3 CCC(O)CCl MCULE-8359810208 [0,0,0,0,0,0|2,0,2]=4 119 B5R0.3 CCC(O)CN MCULE-5197026448 [0,0,0,0,0,0|2,0,2]=4 120 B5R0.3 CCC(O)CO MCULE-2488753438 [0,0,0,0,0,0|1,0,2]=3 121 B5R0.3 CCC(O)CO MCULE-7297282094 [0,0,0,0,0,0|1,0,2]=3 122 B5R0.3 CCC(S)CC MCULE-2556259434 [0,0,0,0,0,0|2,1,1]=4 123 B5R0.3 CCC(S)CS MCULE-9332449950 [0,0,0,0,0,0|1,2,1]=4 124 B5R0.3 CCC([NH3+])CBr MCULE-6971158198 [0,0,0,0,0,0|3,0,1]=4 125 B5R0.3 CCN(C)CC MCULE-7207964917 [0,0,0,0,0,0|4,0,0]=4 126 B5R0.3 CCN(N)CC MCULE-9853386945 [0,0,0,0,0,0|4,0,0]=4 127 B5R0.3 CCN(N)CC MCULE-9962617398 [0,0,0,0,0,0|4,0,0]=4 128 B5R0.3 CCN(O)CC MCULE-6022935768 [0,0,0,0,0,0|3,0,1]=4 129 B5R0.3 CCP(=O)CC MCULE-2216184595 [0,0,0,0,0,0|3,0,0]=3 130 B5R0.3 CCP(Cl)CC MCULE-4484529264 [0,0,0,0,0,0|4,0,0]=4 131 B5R0.3 CCS(=O)CC MCULE-5102735179 [0,0,0,0,0,0|3,0,0]=3 132 B5R0.3 CC[C@@H](C)CBr MCULE-5675886072 [0,0,0,0,0,0|3,0,1]=4 133 B5R0.3 CC[C@@H](C)CN MCULE-7612408107 [0,0,0,0,0,0|3,0,1]=4 134 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [0,0,0,0,0,0|2,0,1]=3 135 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [0,0,0,0,0,0|2,0,1]=3 136 B5R0.3 CC[C@@H](N)CO MCULE-3821348404 [0,0,0,0,0,0|2,0,1]=3 137 B5R0.3 CC[C@@H](N)CO MCULE-7190248306 [0,0,0,0,0,0|2,0,1]=3 138 B5R0.3 CC[C@@H](O)CN MCULE-2854535153 [0,0,0,0,0,0|2,0,2]=4 139 B5R0.3 CC[C@@H](O)CN MCULE-8228547956 [0,0,0,0,0,0|2,0,2]=4 140 B5R0.3 CC[C@@H](O)CO MCULE-3948477298 [0,0,0,0,0,0|1,0,2]=3 141 B5R0.3 CC[C@@H](O)CO MCULE-5098109795 [0,0,0,0,0,0|1,0,2]=3 142 B5R0.3 CC[C@H](C)CBr MCULE-3263714447 [0,0,0,0,0,0|3,0,1]=4 143 B5R0.3 CC[C@H](C)CBr MCULE-3384648570 [0,0,0,0,0,0|3,0,1]=4 144 B5R0.3 CC[C@H](C)CCl MCULE-6795758745 [0,0,0,0,0,0|3,0,1]=4 145 B5R0.3 CC[C@H](C)CCl MCULE-8147276830 [0,0,0,0,0,0|3,0,1]=4 146 B5R0.3 CC[C@H](C)CI MCULE-9690776923 [0,0,0,0,0,0|3,0,1]=4 147 B5R0.3 CC[C@H](C)CN MCULE-1380819951 [0,0,0,0,0,0|3,0,1]=4 148 B5R0.3 CC[C@H](C)CN MCULE-1396096112 [0,0,0,0,0,0|3,0,1]=4 149 B5R0.3 CC[C@H](C)CN MCULE-2971933862 [0,0,0,0,0,0|3,0,1]=4 150 B5R0.3 CC[C@H](C)CN MCULE-3698084674 [0,0,0,0,0,0|3,0,1]=4 151 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [0,0,0,0,0,0|2,0,1]=3 152 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [0,0,0,0,0,0|2,0,1]=3 153 B5R0.3 CC[C@H](N)CF MCULE-3646304583 [0,0,0,0,0,0|3,0,1]=4 154 B5R0.3 CC[C@H](N)CF MCULE-4493834638 [0,0,0,0,0,0|3,0,1]=4 155 B5R0.3 CC[C@H](N)CO MCULE-5500083870 [0,0,0,0,0,0|2,0,1]=3 156 B5R0.3 CC[C@H](N)CO MCULE-6312512384 [0,0,0,0,0,0|2,0,1]=3 157 B5R0.3 CC[C@H](O)CN MCULE-4385930741 [0,0,0,0,0,0|2,0,2]=4 158 B5R0.3 CC[C@H](O)CO MCULE-2194264642 [0,0,0,0,0,0|1,0,2]=3 159 B5R0.3 CC[C@H](O)CO MCULE-5503575962 [0,0,0,0,0,0|1,0,2]=3 160 B5R0.3 CNC(=N)CO MCULE-3239749882 [0,0,0,0,0,0|3,0,0]=3 161 B5R0.3 CNC(=O)CBr MCULE-1439209307 [0,0,0,0,0,0|3,0,0]=3 162 B5R0.3 CNC(=O)CCl MCULE-1437904095 [0,0,0,0,0,0|3,0,0]=3 163 B5R0.3 CNC(=O)CI MCULE-1687694185 [0,0,0,0,0,0|3,0,0]=3 164 B5R0.3 CNC(=O)CN MCULE-1901033297 [0,0,0,0,0,0|3,0,0]=3 165 B5R0.3 CNC(=O)CN MCULE-8532774234 [0,0,0,0,0,0|3,0,0]=3 166 B5R0.3 CNC(=O)CO MCULE-5899226107 [0,0,0,0,0,0|2,0,0]=2 167 B5R0.3 CNC(=O)CS MCULE-7032391129 [0,0,0,0,0,0|2,1,0]=3 168 B5R0.3 CNC(=O)NC MCULE-5319497155 [0,0,0,0,0,0|4,0,0]=4 169 B5R0.3 CNC(=O)NN MCULE-2093843774 [0,0,0,0,0,0|4,0,0]=4 170 B5R0.3 CNC(=O)OC MCULE-1162861376 [0,0,0,0,0,0|4,0,0]=4 171 B5R0.3 CNC(C)CO MCULE-3841057780 [0,0,0,0,0,0|3,0,1]=4 172 B5R0.3 CNC(C)CO MCULE-6474892275 [0,0,0,0,0,0|3,0,1]=4 173 B5R0.3 CN[C@@H](C)CO MCULE-1633741835 [0,0,0,0,0,0|3,0,1]=4 174 B5R0.3 CN[C@@H](C)CO MCULE-6736108875 [0,0,0,0,0,0|3,0,1]=4 175 B5R0.3 CN[C@@H](C)CO MCULE-7554801630 [0,0,0,0,0,0|3,0,1]=4 176 B5R0.3 CN[C@@H](C)CO MCULE-9312521497 [0,0,0,0,0,0|3,0,1]=4 177 B5R0.3 CN[C@H](C)CO MCULE-2402322400 [0,0,0,0,0,0|3,0,1]=4 178 B5R0.3 CN[C@H](C)CO MCULE-4362091386 [0,0,0,0,0,0|3,0,1]=4 179 B5R0.3 CN[C@H](C)CO MCULE-5426855707 [0,0,0,0,0,0|3,0,1]=4 180 B5R0.3 CN[C@H](C)CO MCULE-9777995604 [0,0,0,0,0,0|3,0,1]=4 181 B5R0.3 COC(=N)CCl MCULE-2713131753 [0,0,0,0,0,0|4,0,0]=4 182 B5R0.3 COC(=N)CCl MCULE-6471252676 [0,0,0,0,0,0|4,0,0]=4 183 B5R0.3 COC(=O)C#N MCULE-8762838190 [0,0,0,0,0,0|3,0,1]=4 184 B5R0.3 COC(=O)C=O MCULE-2685327079 [0,0,0,0,0,0|2,0,2]=4 185 B5R0.3 COC(=O)CBr MCULE-2684954408 [0,0,0,0,0,0|3,0,0]=3 186 B5R0.3 COC(=O)CCl MCULE-5886832940 [0,0,0,0,0,0|3,0,0]=3 187 B5R0.3 COC(=O)CF MCULE-4367430175 [0,0,0,0,0,0|3,0,0]=3 188 B5R0.3 COC(=O)CI MCULE-9545584156 [0,0,0,0,0,0|3,0,0]=3 189 B5R0.3 COC(=O)CN MCULE-7462799100 [0,0,0,0,0,0|3,0,0]=3 190 B5R0.3 COC(=O)CN MCULE-8887061469 [0,0,0,0,0,0|3,0,0]=3 191 B5R0.3 COC(=O)CO MCULE-8734582763 [0,0,0,0,0,0|2,0,0]=2 192 B5R0.3 COC(=O)CS MCULE-3020830180 [0,0,0,0,0,0|2,1,0]=3 193 B5R0.3 COC(=O)NN MCULE-2637794839 [0,0,0,0,0,0|4,0,0]=4 194 B5R0.3 COC(=O)OC MCULE-7488725621 [0,0,0,0,0,0|4,0,0]=4 195 B5R0.3 COC(=O)SCl MCULE-1018411491 [0,0,0,0,0,0|4,0,0]=4 196 B5R0.3 COC(C)CO MCULE-5269990702 [0,0,0,0,0,0|3,0,1]=4 197 B5R0.3 COC(C)CO MCULE-7173093332 [0,0,0,0,0,0|3,0,1]=4 198 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [0,0,0,0,0,0|3,0,1]=4 199 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [0,0,0,0,0,0|3,0,1]=4 200 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [0,0,0,0,0,0|3,0,1]=4 201 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [0,0,0,0,0,0|3,0,1]=4 202 B5R0.3 CS/C(=N/O)/C MCULE-8496912522 [0,0,0,0,0,0|4,0,0]=4 203 B5R0.3 CSC(=NO)C MCULE-1500524467 [0,0,0,0,0,0|4,0,0]=4 204 B5R0.3 CSC(=O)SC MCULE-7167992573 [0,0,0,0,0,0|4,0,0]=4 205 B5R0.3 CSC(C)CO MCULE-4646435737 [0,0,0,0,0,0|3,0,1]=4 206 B5R0.3 C[C@@H](CN)CO MCULE-4662215148 [0,0,0,0,0,0|2,0,1]=3 207 B5R0.3 C[C@@H](CN)CO MCULE-7870198689 [0,0,0,0,0,0|2,0,1]=3 208 B5R0.3 C[C@@H](CO)CBr MCULE-3691541800 [0,0,0,0,0,0|2,0,1]=3 209 B5R0.3 C[C@@H](CO)CBr MCULE-4447849056 [0,0,0,0,0,0|2,0,1]=3 210 B5R0.3 C[C@H](CO)CBr MCULE-4031825779 [0,0,0,0,0,0|2,0,1]=3 211 B5R0.3 C[C@H](CO)CBr MCULE-6846167456 [0,0,0,0,0,0|2,0,1]=3 212 B5R0.3 Cl/C=C(\Cl)/CCl MCULE-8945457634 [0,0,0,0,0,0|3,0,1]=4 213 B5R0.3 ClC=C(Cl)CCl MCULE-5187224514 [0,0,0,0,0,0|3,0,1]=4 214 B5R0.3 ClCC(Br)CBr MCULE-2454576835 [0,0,0,0,0,0|3,0,1]=4 215 B5R0.3 ClCC(Cl)CCl MCULE-3839333809 [0,0,0,0,0,0|3,0,1]=4 216 B5R0.3 FCC(Br)CBr MCULE-3296621964 [0,0,0,0,0,0|3,0,1]=4 217 B5R0.3 FCC(Cl)CF MCULE-6083002482 [0,0,0,0,0,0|3,0,1]=4 218 B5R0.3 FCC(I)CF MCULE-1837926612 [0,0,0,0,0,0|3,0,1]=4 219 B5R0.3 N#CC(N)CO MCULE-5918855868 [0,0,0,0,0,0|2,0,2]=4 220 B5R0.3 N#CC(N)CO MCULE-8439000158 [0,0,0,0,0,0|2,0,2]=4 221 B5R0.3 N/C(=N/O)/CF MCULE-8149459701 [0,0,0,0,0,0|3,0,0]=3 222 B5R0.3 N/C(=N/O)/CO MCULE-1684161600 [0,0,0,0,0,0|2,0,0]=2 223 B5R0.3 N/C(=N\O)/CCl MCULE-4486676288 [0,0,0,0,0,0|3,0,0]=3 224 B5R0.3 N=C(NN)NO MCULE-6419110297 [0,0,0,0,0,0|4,0,0]=4 225 B5R0.3 NC(CF)CF MCULE-4671221738 [0,0,0,0,0,0|3,0,1]=4 226 B5R0.3 NC(CF)CF MCULE-8916274721 [0,0,0,0,0,0|3,0,1]=4 227 B5R0.3 NC(CO)CF MCULE-3756808200 [0,0,0,0,0,0|2,0,1]=3 228 B5R0.3 NC(CO)CF MCULE-9468719402 [0,0,0,0,0,0|2,0,1]=3 229 B5R0.3 NC(CO)CO MCULE-1559988016 [0,0,0,0,0,0|1,0,1]=2 230 B5R0.3 NC(CO)CO MCULE-4954119952 [0,0,0,0,0,0|1,0,1]=2 231 B5R0.3 NCC(=O)CN MCULE-2420991481 [0,0,0,0,0,0|2,0,0]=2 232 B5R0.3 NCC(=O)CN MCULE-8626789745 [0,0,0,0,0,0|2,0,0]=2 233 B5R0.3 NCC(=O)NN MCULE-2318099199 [0,0,0,0,0,0|3,0,0]=3 234 B5R0.3 NCC(=O)NN MCULE-3392354502 [0,0,0,0,0,0|3,0,0]=3 235 B5R0.3 NCC(=O)NO MCULE-5417617455 [0,0,0,0,0,0|2,0,0]=2 236 B5R0.3 NCC(Br)CBr MCULE-4507622045 [0,0,0,0,0,0|3,0,1]=4 237 B5R0.3 NCC(Br)CBr MCULE-9707598399 [0,0,0,0,0,0|3,0,1]=4 238 B5R0.3 NCC(F)CN MCULE-8855486562 [0,0,0,0,0,0|3,0,1]=4 239 B5R0.3 NCC(F)CO MCULE-6156319956 [0,0,0,0,0,0|2,0,1]=3 240 B5R0.3 NCC(F)CO MCULE-7472307328 [0,0,0,0,0,0|2,0,1]=3 241 B5R0.3 NCC(O)CCl MCULE-1566349721 [0,0,0,0,0,0|2,0,2]=4 242 B5R0.3 NCC(O)CCl MCULE-3532626994 [0,0,0,0,0,0|2,0,2]=4 243 B5R0.3 NCC(O)CCl MCULE-5045913208 [0,0,0,0,0,0|2,0,2]=4 244 B5R0.3 NCC(O)CCl MCULE-7168455596 [0,0,0,0,0,0|2,0,2]=4 245 B5R0.3 NCC(O)CF MCULE-7529777116 [0,0,0,0,0,0|2,0,2]=4 246 B5R0.3 NCC(O)CF MCULE-8092861019 [0,0,0,0,0,0|2,0,2]=4 247 B5R0.3 NCC(O)CN MCULE-4689186078 [0,0,0,0,0,0|2,0,2]=4 248 B5R0.3 NCC(O)CO MCULE-2689763818 [0,0,0,0,0,0|1,0,2]=3 249 B5R0.3 NCC(O)CO MCULE-6096620010 [0,0,0,0,0,0|1,0,2]=3 250 B5R0.3 NCC(O)CO MCULE-7307777212 [0,0,0,0,0,0|1,0,2]=3 251 B5R0.3 NC[C@@H](F)CO MCULE-3273711180 [0,0,0,0,0,0|2,0,1]=3 252 B5R0.3 NC[C@@H](F)CO MCULE-6673969522 [0,0,0,0,0,0|2,0,1]=3 253 B5R0.3 NC[C@@H](N)CO MCULE-7333007012 [0,0,0,0,0,0|2,0,1]=3 254 B5R0.3 NC[C@@H](N)CO MCULE-9200386635 [0,0,0,0,0,0|2,0,1]=3 255 B5R0.3 NC[C@@H](O)CCl MCULE-1905964392 [0,0,0,0,0,0|2,0,2]=4 256 B5R0.3 NC[C@@H](O)CCl MCULE-5592096864 [0,0,0,0,0,0|2,0,2]=4 257 B5R0.3 NC[C@@H](O)CCl MCULE-5723497450 [0,0,0,0,0,0|2,0,2]=4 258 B5R0.3 NC[C@@H](O)CCl MCULE-7112738263 [0,0,0,0,0,0|2,0,2]=4 259 B5R0.3 NC[C@@H](O)CO MCULE-7897503444 [0,0,0,0,0,0|1,0,2]=3 260 B5R0.3 NC[C@@H](O)CO MCULE-8044821624 [0,0,0,0,0,0|1,0,2]=3 261 B5R0.3 NC[C@@H](O)CO MCULE-9443333756 [0,0,0,0,0,0|1,0,2]=3 262 B5R0.3 NC[C@H](F)CO MCULE-2595736378 [0,0,0,0,0,0|2,0,1]=3 263 B5R0.3 NC[C@H](F)CO MCULE-7417074078 [0,0,0,0,0,0|2,0,1]=3 264 B5R0.3 NC[C@H](F)CO MCULE-7938231499 [0,0,0,0,0,0|2,0,1]=3 265 B5R0.3 NC[C@H](N)CO MCULE-1060049548 [0,0,0,0,0,0|2,0,1]=3 266 B5R0.3 NC[C@H](N)CO MCULE-9942356112 [0,0,0,0,0,0|2,0,1]=3 267 B5R0.3 NC[C@H](O)CBr MCULE-4679771824 [0,0,0,0,0,0|2,0,2]=4 268 B5R0.3 NC[C@H](O)CBr MCULE-4785059460 [0,0,0,0,0,0|2,0,2]=4 269 B5R0.3 NC[C@H](O)CCl MCULE-3625478007 [0,0,0,0,0,0|2,0,2]=4 270 B5R0.3 NC[C@H](O)CCl MCULE-6692503791 [0,0,0,0,0,0|2,0,2]=4 271 B5R0.3 NC[C@H](O)CO MCULE-5835551322 [0,0,0,0,0,0|1,0,2]=3 272 B5R0.3 NC[C@H](O)CO MCULE-6021133883 [0,0,0,0,0,0|1,0,2]=3 273 B5R0.3 NC[C@H](O)CO MCULE-7461568841 [0,0,0,0,0,0|1,0,2]=3 274 B5R0.3 NC[C@H](O)CO MCULE-8112454132 [0,0,0,0,0,0|1,0,2]=3 275 B5R0.3 NNC(=O)CCl MCULE-2158347473 [0,0,0,0,0,0|3,0,0]=3 276 B5R0.3 NNC(=O)CCl MCULE-9762553206 [0,0,0,0,0,0|3,0,0]=3 277 B5R0.3 NNC(=O)CO MCULE-8443636349 [0,0,0,0,0,0|2,0,0]=2 278 B5R0.3 NNC(=O)CS MCULE-4913925166 [0,0,0,0,0,0|2,1,0]=3 279 B5R0.3 NNC(=O)NN MCULE-8522412568 [0,0,0,0,0,0|4,0,0]=4 280 B5R0.3 NNC(=O)NO MCULE-7106168898 [0,0,0,0,0,0|3,0,0]=3 281 B5R0.3 N[C@@H](CO)CF MCULE-1103631898 [0,0,0,0,0,0|2,0,1]=3 282 B5R0.3 N[C@@H](CO)CF MCULE-1137418239 [0,0,0,0,0,0|2,0,1]=3 283 B5R0.3 N[C@@H](CO)CF MCULE-7452275160 [0,0,0,0,0,0|2,0,1]=3 284 B5R0.3 N[C@@H](CO)CF MCULE-9154795583 [0,0,0,0,0,0|2,0,1]=3 285 B5R0.3 N[C@H](CO)CF MCULE-1070351343 [0,0,0,0,0,0|2,0,1]=3 286 B5R0.3 N[C@H](CO)CF MCULE-4715788718 [0,0,0,0,0,0|2,0,1]=3 287 B5R0.3 N[C@H](CO)CF MCULE-8220585202 [0,0,0,0,0,0|2,0,1]=3 288 B5R0.3 N[C@H](CO)CF MCULE-8991857376 [0,0,0,0,0,0|2,0,1]=3 289 B5R0.3 O=C(CBr)CBr MCULE-5262523719 [0,0,0,0,0,0|2,0,0]=2 290 B5R0.3 O=C(CCl)CCl MCULE-2048636813 [0,0,0,0,0,0|2,0,0]=2 291 B5R0.3 O=C(CF)CF MCULE-8790300272 [0,0,0,0,0,0|2,0,0]=2 292 B5R0.3 O=C(CO)CO MCULE-7188810449 [0,0,0,0,0,0|0,0,0]=0 293 B5R0.3 O=CC(=CO)Br MCULE-8777401868 [0,0,0,0,0,0|1,0,3]=4 294 B5R0.3 O=CC(=O)CO MCULE-7273475675 [0,0,0,0,0,0|0,0,2]=2 295 B5R0.3 O=CC(O)CO MCULE-9581740191 [0,0,0,0,0,0|0,0,4]=4 296 B5R0.3 O=C[C@@H](O)CO MCULE-3883857491 [0,0,0,0,0,0|0,0,4]=4 297 B5R0.3 O=C[C@@H](O)CO MCULE-7852783182 [0,0,0,0,0,0|0,0,4]=4 298 B5R0.3 O=C[C@H](O)CO MCULE-4574984840 [0,0,0,0,0,0|0,0,4]=4 299 B5R0.3 OC(CBr)CBr MCULE-9071238259 [0,0,0,0,0,0|2,0,2]=4 300 B5R0.3 OC(CCl)CBr MCULE-3844020597 [0,0,0,0,0,0|2,0,2]=4 301 B5R0.3 OC(CCl)CCl MCULE-7873018520 [0,0,0,0,0,0|2,0,2]=4 302 B5R0.3 OC(CCl)CI MCULE-3276637880 [0,0,0,0,0,0|2,0,2]=4 303 B5R0.3 OC(CF)CBr MCULE-3915880352 [0,0,0,0,0,0|2,0,2]=4 304 B5R0.3 OC(CF)CCl MCULE-6441743377 [0,0,0,0,0,0|2,0,2]=4 305 B5R0.3 OC(CF)CF MCULE-3360341794 [0,0,0,0,0,0|2,0,2]=4 306 B5R0.3 OC(CI)CI MCULE-6842895270 [0,0,0,0,0,0|2,0,2]=4 307 B5R0.3 OCC(Br)CBr MCULE-9616107956 [0,0,0,0,0,0|2,0,1]=3 308 B5R0.3 OCC(Br)CO MCULE-9272628834 [0,0,0,0,0,0|1,0,1]=2 309 B5R0.3 OCC(Cl)CCl MCULE-2120585852 [0,0,0,0,0,0|2,0,1]=3 310 B5R0.3 OCC(Cl)CO MCULE-7487945326 [0,0,0,0,0,0|1,0,1]=2 311 B5R0.3 OCC(F)CBr MCULE-2889937576 [0,0,0,0,0,0|2,0,1]=3 312 B5R0.3 OCC(F)CO MCULE-2970537690 [0,0,0,0,0,0|1,0,1]=2 313 B5R0.3 OCC(O)CBr MCULE-9116190245 [0,0,0,0,0,0|1,0,2]=3 314 B5R0.3 OCC(O)CCl MCULE-7895191088 [0,0,0,0,0,0|1,0,2]=3 315 B5R0.3 OCC(O)CCl MCULE-8992242488 [0,0,0,0,0,0|1,0,2]=3 316 B5R0.3 OCC(O)CF MCULE-3575952891 [0,0,0,0,0,0|1,0,2]=3 317 B5R0.3 OCC(O)CF MCULE-8981430411 [0,0,0,0,0,0|1,0,2]=3 318 B5R0.3 OCC(O)CI MCULE-6705992930 [0,0,0,0,0,0|1,0,2]=3 319 B5R0.3 OCC(O)CO MCULE-6349111826 [0,0,0,0,0,0|0,0,2]=2 320 B5R0.3 OCC(O)CS MCULE-6300188207 [0,0,0,0,0,0|0,1,2]=3 321 B5R0.3 OCC(S)CS MCULE-9735516119 [0,0,0,0,0,0|0,2,1]=3 322 B5R0.3 OC[C@@H](O)CCl MCULE-1311776512 [0,0,0,0,0,0|1,0,2]=3 323 B5R0.3 OC[C@@H](O)CCl MCULE-2685107404 [0,0,0,0,0,0|1,0,2]=3 324 B5R0.3 OC[C@@H](O)CF MCULE-3274443966 [0,0,0,0,0,0|1,0,2]=3 325 B5R0.3 OC[C@@H](O)CF MCULE-5908395855 [0,0,0,0,0,0|1,0,2]=3 326 B5R0.3 OC[C@H](O)CBr MCULE-5035020863 [0,0,0,0,0,0|1,0,2]=3 327 B5R0.3 OC[C@H](O)CCl MCULE-2098232262 [0,0,0,0,0,0|1,0,2]=3 328 B5R0.3 OC[C@H](O)CCl MCULE-5801605349 [0,0,0,0,0,0|1,0,2]=3 329 B5R0.3 OC[C@H](O)CF MCULE-3309672397 [0,0,0,0,0,0|1,0,2]=3 330 B5R0.3 OC[C@H](O)CF MCULE-7695783253 [0,0,0,0,0,0|1,0,2]=3 331 B5R0.3 O[C@@H](CCl)CI MCULE-5324720097 [0,0,0,0,0,0|2,0,2]=4 332 B5R0.3 O[C@H](CCl)CI MCULE-2790157830 [0,0,0,0,0,0|2,0,2]=4 333 B5R0.3 [C@H](O)(CN)CCl MCULE-1220791610 [0,0,0,0,0,0|2,0,2]=4 334 B5R0.3 [C@H](O)(CN)CCl MCULE-4106901858 [0,0,0,0,0,0|2,0,2]=4 335 B4R0.1 C#CC(=C)C MCULE-6826835331 [1,0,0,0,0,0|2,0,1]=4 336 B4R0.1 C#CC(=O)C MCULE-1296030711 [1,0,0,0,0,0|1,0,1]=3 337 B4R0.1 C#CC(=O)N MCULE-1832868146 [1,0,0,0,0,0|2,0,1]=4 338 B4R0.1 C#CC(=O)O MCULE-8764256624 [1,0,0,0,0,0|1,0,1]=3 339 B4R0.1 C#CC(=O)[O-] MCULE-3356498679 [1,0,0,0,0,0|1,0,2]=4 340 B4R0.1 C#CC(=O)[O-] MCULE-3490087346 [1,0,0,0,0,0|1,0,2]=4 341 B4R0.1 C(C)(N)CN MCULE-5877041140 [1,0,0,0,0,0|2,0,1]=4 342 B4R0.1 C(C)(N)CO MCULE-5844242932 [1,0,0,0,0,0|1,0,1]=3 343 B4R0.1 C/C(=N/O)/N MCULE-5595239824 [1,0,0,0,0,0|2,0,0]=3 344 B4R0.1 C/C(=N\O)/N MCULE-8004142092 [1,0,0,0,0,0|2,0,0]=3 345 B4R0.1 C/C=C(/C)\Cl MCULE-6841426098 [1,0,0,0,0,0|2,0,1]=4 346 B4R0.1 C/C=C(\C)/Br MCULE-3045523462 [1,0,0,0,0,0|2,0,1]=4 347 B4R0.1 C/C=C(\C)/Cl MCULE-4683862502 [1,0,0,0,0,0|2,0,1]=4 348 B4R0.1 C=C(Br)CBr MCULE-1222617820 [1,0,0,0,0,0|2,0,1]=4 349 B4R0.1 C=C(Br)CC MCULE-6271946451 [1,0,0,0,0,0|2,0,1]=4 350 B4R0.1 C=C(Br)CN MCULE-1170417597 [1,0,0,0,0,0|2,0,1]=4 351 B4R0.1 C=C(Br)CN MCULE-9190049156 [1,0,0,0,0,0|2,0,1]=4 352 B4R0.1 C=C(Br)CO MCULE-7763893047 [1,0,0,0,0,0|1,0,1]=3 353 B4R0.1 C=C(C)C#N MCULE-9177849910 [1,0,0,0,0,0|2,0,1]=4 354 B4R0.1 C=C(C)C=O MCULE-3758355501 [1,0,0,0,0,0|1,0,2]=4 355 B4R0.1 C=C(C)CBr MCULE-1361893863 [1,0,0,0,0,0|2,0,0]=3 356 B4R0.1 C=C(C)CCl MCULE-5586406339 [1,0,0,0,0,0|2,0,0]=3 357 B4R0.1 C=C(C)CI MCULE-3678124406 [1,0,0,0,0,0|2,0,0]=3 358 B4R0.1 C=C(C)CN MCULE-1033495975 [1,0,0,0,0,0|2,0,0]=3 359 B4R0.1 C=C(C)CN MCULE-8730181300 [1,0,0,0,0,0|2,0,0]=3 360 B4R0.1 C=C(C)CO MCULE-8641288398 [1,0,0,0,0,0|1,0,0]=2 361 B4R0.1 C=C(C)CS MCULE-5174170431 [1,0,0,0,0,0|1,1,0]=3 362 B4R0.1 C=C(C)OC MCULE-7344104255 [1,0,0,0,0,0|3,0,0]=4 363 B4R0.1 C=C(Cl)CBr MCULE-9398157024 [1,0,0,0,0,0|2,0,1]=4 364 B4R0.1 C=C(Cl)CCl MCULE-4210429118 [1,0,0,0,0,0|2,0,1]=4 365 B4R0.1 C=C(Cl)CI MCULE-1908004565 [1,0,0,0,0,0|2,0,1]=4 366 B4R0.1 C=C(Cl)CN MCULE-2159410121 [1,0,0,0,0,0|2,0,1]=4 367 B4R0.1 C=C(Cl)CN MCULE-3454023553 [1,0,0,0,0,0|2,0,1]=4 368 B4R0.1 C=C(Cl)CO MCULE-8813337564 [1,0,0,0,0,0|1,0,1]=3 369 B4R0.1 C=C(F)CBr MCULE-6528430141 [1,0,0,0,0,0|2,0,1]=4 370 B4R0.1 C=C(F)CCl MCULE-4499400030 [1,0,0,0,0,0|2,0,1]=4 371 B4R0.1 C=C(F)CN MCULE-1603171858 [1,0,0,0,0,0|2,0,1]=4 372 B4R0.1 C=C(F)CN MCULE-3878727292 [1,0,0,0,0,0|2,0,1]=4 373 B4R0.1 C=C(F)CO MCULE-2779963696 [1,0,0,0,0,0|1,0,1]=3 374 B4R0.1 C=C(I)CO MCULE-2533897125 [1,0,0,0,0,0|1,0,1]=3 375 B4R0.1 C=C=C(C)C MCULE-8705186354 [1,0,0,0,0,0|2,0,1]=4 376 B4R0.1 C=CC(=C)C MCULE-1668999564 [1,0,0,0,0,0|2,0,1]=4 377 B4R0.1 C=CC(=O)C MCULE-4924646293 [1,0,0,0,0,0|1,0,1]=3 378 B4R0.1 C=CC(=O)Cl MCULE-3579233798 [1,0,0,0,0,0|2,0,1]=4 379 B4R0.1 C=CC(=O)N MCULE-4309430654 [1,0,0,0,0,0|2,0,1]=4 380 B4R0.1 C=CC(=O)O MCULE-9352227082 [1,0,0,0,0,0|1,0,1]=3 381 B4R0.1 C=CC(=O)[O-] MCULE-3928960314 [1,0,0,0,0,0|1,0,2]=4 382 B4R0.1 C=CC(=O)[O-] MCULE-4331301308 [1,0,0,0,0,0|1,0,2]=4 383 B4R0.1 C=CC(=O)[O-] MCULE-5516854555 [1,0,0,0,0,0|1,0,2]=4 384 B4R0.1 CC(=CBr)C MCULE-9508381610 [1,0,0,0,0,0|2,0,1]=4 385 B4R0.1 CC(=CCl)C MCULE-4321554138 [1,0,0,0,0,0|2,0,1]=4 386 B4R0.1 CC(=CCl)Cl MCULE-3528888685 [1,0,0,0,0,0|2,0,1]=4 387 B4R0.1 CC(=N)NN MCULE-2302306720 [1,0,0,0,0,0|3,0,0]=4 388 B4R0.1 CC(=N)NN MCULE-5362481009 [1,0,0,0,0,0|3,0,0]=4 389 B4R0.1 CC(=NN)C MCULE-8828852790 [1,0,0,0,0,0|3,0,0]=4 390 B4R0.1 CC(=NO)C MCULE-3243100216 [1,0,0,0,0,0|2,0,0]=3 391 B4R0.1 CC(=O)C#N MCULE-6317771757 [1,0,0,0,0,0|1,0,1]=3 392 B4R0.1 CC(=O)C=O MCULE-2718961814 [1,0,0,0,0,0|0,0,2]=3 393 B4R0.1 CC(=O)CBr MCULE-7812920675 [1,0,0,0,0,0|1,0,0]=2 394 B4R0.1 CC(=O)CCl MCULE-2501365933 [1,0,0,0,0,0|1,0,0]=2 395 B4R0.1 CC(=O)CF MCULE-7417279999 [1,0,0,0,0,0|1,0,0]=2 396 B4R0.1 CC(=O)CN MCULE-2715277783 [1,0,0,0,0,0|1,0,0]=2 397 B4R0.1 CC(=O)CN MCULE-6004541862 [1,0,0,0,0,0|1,0,0]=2 398 B4R0.1 CC(=O)CO MCULE-2989526028 [1,0,0,0,0,0|0,0,0]=1 399 B4R0.1 CC(=O)CS MCULE-9736174016 [1,0,0,0,0,0|0,1,0]=2 400 B4R0.1 CC(=O)NBr MCULE-6502070876 [1,0,0,0,0,0|2,0,0]=3 401 B4R0.1 CC(=O)NN MCULE-9183467120 [1,0,0,0,0,0|2,0,0]=3 402 B4R0.1 CC(=O)NO MCULE-2682231025 [1,0,0,0,0,0|1,0,0]=2 403 B4R0.1 CC(=O)OO MCULE-6028338742 [1,0,0,0,0,0|1,0,0]=2 404 B4R0.1 CC(Br)CBr MCULE-6304574748 [1,0,0,0,0,0|2,0,1]=4 405 B4R0.1 CC(Br)CCl MCULE-8021380791 [1,0,0,0,0,0|2,0,1]=4 406 B4R0.1 CC(Br)CN MCULE-5214613046 [1,0,0,0,0,0|2,0,1]=4 407 B4R0.1 CC(Br)CN MCULE-6326218362 [1,0,0,0,0,0|2,0,1]=4 408 B4R0.1 CC(Br)CO MCULE-8344365003 [1,0,0,0,0,0|1,0,1]=3 409 B4R0.1 CC(C)CBr MCULE-6039420480 [1,0,0,0,0,0|2,0,1]=4 410 B4R0.1 CC(C)CCl MCULE-6524976746 [1,0,0,0,0,0|2,0,1]=4 411 B4R0.1 CC(C)CI MCULE-5280589461 [1,0,0,0,0,0|2,0,1]=4 412 B4R0.1 CC(C)CN MCULE-2158650588 [1,0,0,0,0,0|2,0,1]=4 413 B4R0.1 CC(C)CN MCULE-6751437658 [1,0,0,0,0,0|2,0,1]=4 414 B4R0.1 CC(C)CN MCULE-8319193456 [1,0,0,0,0,0|2,0,1]=4 415 B4R0.1 CC(C)CN MCULE-8705657065 [1,0,0,0,0,0|2,0,1]=4 416 B4R0.1 CC(C)CO MCULE-6294327194 [1,0,0,0,0,0|1,0,1]=3 417 B4R0.1 CC(C)CP MCULE-3724358658 [1,0,0,0,0,0|2,0,1]=4 418 B4R0.1 CC(C)CS MCULE-7978911055 [1,0,0,0,0,0|1,1,1]=4 419 B4R0.1 CC(C)NO MCULE-6516566403 [1,0,0,0,0,0|2,0,1]=4 420 B4R0.1 CC(C)NO MCULE-8545146035 [1,0,0,0,0,0|2,0,1]=4 421 B4R0.1 CC(Cl)CBr MCULE-8474943880 [1,0,0,0,0,0|2,0,1]=4 422 B4R0.1 CC(Cl)CCl MCULE-1548912109 [1,0,0,0,0,0|2,0,1]=4 423 B4R0.1 CC(Cl)CN MCULE-2637316379 [1,0,0,0,0,0|2,0,1]=4 424 B4R0.1 CC(Cl)CN MCULE-5591419030 [1,0,0,0,0,0|2,0,1]=4 425 B4R0.1 CC(Cl)CO MCULE-3857255988 [1,0,0,0,0,0|1,0,1]=3 426 B4R0.1 CC(Cl)CO MCULE-7538548427 [1,0,0,0,0,0|1,0,1]=3 427 B4R0.1 CC(F)CN MCULE-6584490651 [1,0,0,0,0,0|2,0,1]=4 428 B4R0.1 CC(F)CN MCULE-9499916116 [1,0,0,0,0,0|2,0,1]=4 429 B4R0.1 CC(F)CO MCULE-6006763378 [1,0,0,0,0,0|1,0,1]=3 430 B4R0.1 CC(N)CBr MCULE-1783493149 [1,0,0,0,0,0|2,0,1]=4 431 B4R0.1 CC(N)CBr MCULE-2775398297 [1,0,0,0,0,0|2,0,1]=4 432 B4R0.1 CC(N)CCl MCULE-8652434595 [1,0,0,0,0,0|2,0,1]=4 433 B4R0.1 CC(N)CCl MCULE-9580466630 [1,0,0,0,0,0|2,0,1]=4 434 B4R0.1 CC(N)CF MCULE-1603143200 [1,0,0,0,0,0|2,0,1]=4 435 B4R0.1 CC(N)CF MCULE-3787216870 [1,0,0,0,0,0|2,0,1]=4 436 B4R0.1 CC(N)CF MCULE-4138869746 [1,0,0,0,0,0|2,0,1]=4 437 B4R0.1 CC(N)CF MCULE-8611760275 [1,0,0,0,0,0|2,0,1]=4 438 B4R0.1 CC(N)CN MCULE-2119036110 [1,0,0,0,0,0|2,0,1]=4 439 B4R0.1 CC(N)CN MCULE-6286216576 [1,0,0,0,0,0|2,0,1]=4 440 B4R0.1 CC(N)CN MCULE-9919433465 [1,0,0,0,0,0|2,0,1]=4 441 B4R0.1 CC(N)CO MCULE-1361379423 [1,0,0,0,0,0|1,0,1]=3 442 B4R0.1 CC(N)CO MCULE-2098440985 [1,0,0,0,0,0|1,0,1]=3 443 B4R0.1 CC(N)CS MCULE-1396853557 [1,0,0,0,0,0|1,1,1]=4 444 B4R0.1 CC(N)CS MCULE-4094732666 [1,0,0,0,0,0|1,1,1]=4 445 B4R0.1 CC(O)CBr MCULE-7835094737 [1,0,0,0,0,0|1,0,2]=4 446 B4R0.1 CC(O)CCl MCULE-9140807958 [1,0,0,0,0,0|1,0,2]=4 447 B4R0.1 CC(O)CF MCULE-1023052065 [1,0,0,0,0,0|1,0,2]=4 448 B4R0.1 CC(O)CN MCULE-4370440652 [1,0,0,0,0,0|1,0,2]=4 449 B4R0.1 CC(O)CN MCULE-5694317743 [1,0,0,0,0,0|1,0,2]=4 450 B4R0.1 CC(O)CN MCULE-6406041538 [1,0,0,0,0,0|1,0,2]=4 451 B4R0.1 CC(O)CN MCULE-6636652305 [1,0,0,0,0,0|1,0,2]=4 452 B4R0.1 CC(O)CO MCULE-5574440784 [1,0,0,0,0,0|0,0,2]=3 453 B4R0.1 CC(O)CO MCULE-8743139013 [1,0,0,0,0,0|0,0,2]=3 454 B4R0.1 CC(O)CS MCULE-7881083356 [1,0,0,0,0,0|0,1,2]=4 455 B4R0.1 CC(O)C[NH3+] MCULE-6871369474 [1,0,0,0,0,0|1,0,2]=4 456 B4R0.1 CC(S)CN MCULE-1957568322 [1,0,0,0,0,0|1,1,1]=4 457 B4R0.1 CC(S)CN MCULE-7469442412 [1,0,0,0,0,0|1,1,1]=4 458 B4R0.1 CC(S)CO MCULE-5090908062 [1,0,0,0,0,0|0,1,1]=3 459 B4R0.1 CC(S)CS MCULE-9264694858 [1,0,0,0,0,0|0,2,1]=4 460 B4R0.1 CC=C(C)Br MCULE-1371905211 [1,0,0,0,0,0|2,0,1]=4 461 B4R0.1 CC=C(C)C MCULE-4230157245 [1,0,0,0,0,0|2,0,1]=4 462 B4R0.1 CC=C(C)Cl MCULE-3844314543 [1,0,0,0,0,0|2,0,1]=4 463 B4R0.1 CCB(O)O MCULE-1650960999 [1,0,0,0,0,0|2,0,1]=4 464 B4R0.1 CCC(=N)N MCULE-1856575742 [1,0,0,0,0,0|3,0,0]=4 465 B4R0.1 CCC(=N)N MCULE-2534386807 [1,0,0,0,0,0|3,0,0]=4 466 B4R0.1 CCC(=O)Br MCULE-7870678619 [1,0,0,0,0,0|2,0,0]=3 467 B4R0.1 CCC(=O)C MCULE-8276670748 [1,0,0,0,0,0|1,0,0]=2 468 B4R0.1 CCC(=O)Cl MCULE-3081874391 [1,0,0,0,0,0|2,0,0]=3 469 B4R0.1 CCC(=O)F MCULE-8783887670 [1,0,0,0,0,0|2,0,0]=3 470 B4R0.1 CCC(=O)N MCULE-3730796130 [1,0,0,0,0,0|2,0,0]=3 471 B4R0.1 CCC(=O)O MCULE-2199051150 [1,0,0,0,0,0|1,0,0]=2 472 B4R0.1 CCC(=O)O MCULE-9800054040 [1,0,0,0,0,0|1,0,0]=2 473 B4R0.1 CCC(=O)S MCULE-3392119766 [1,0,0,0,0,0|1,1,0]=3 474 B4R0.1 CCC(=O)[O-] MCULE-6321502767 [1,0,0,0,0,0|1,0,1]=3 475 B4R0.1 CCC(=S)N MCULE-3921479699 [1,0,0,0,0,0|2,1,0]=4 476 B4R0.1 CCC(C)Br MCULE-9661620259 [1,0,0,0,0,0|2,0,1]=4 477 B4R0.1 CCC(C)C MCULE-5376105936 [1,0,0,0,0,0|2,0,1]=4 478 B4R0.1 CCC(C)Cl MCULE-2954418486 [1,0,0,0,0,0|2,0,1]=4 479 B4R0.1 CCC(C)I MCULE-5239699587 [1,0,0,0,0,0|2,0,1]=4 480 B4R0.1 CCC(C)N MCULE-5041676035 [1,0,0,0,0,0|2,0,1]=4 481 B4R0.1 CCC(C)N MCULE-5835091553 [1,0,0,0,0,0|2,0,1]=4 482 B4R0.1 CCC(C)N MCULE-6631606230 [1,0,0,0,0,0|2,0,1]=4 483 B4R0.1 CCC(C)N MCULE-8165681721 [1,0,0,0,0,0|2,0,1]=4 484 B4R0.1 CCC(C)O MCULE-4099350806 [1,0,0,0,0,0|1,0,2]=4 485 B4R0.1 CCC(C)O MCULE-5005120003 [1,0,0,0,0,0|1,0,2]=4 486 B4R0.1 CCC(C)S MCULE-4988033753 [1,0,0,0,0,0|1,1,1]=4 487 B4R0.1 CCN(=O)=O MCULE-6603591614 [1,0,0,0,0,0|2,0,1]=4 488 B4R0.1 CCN(C)C MCULE-5825033552 [1,0,0,0,0,0|3,0,0]=4 489 B4R0.1 CCN(C)N MCULE-2279492356 [1,0,0,0,0,0|3,0,0]=4 490 B4R0.1 CCN(C)N MCULE-5660338703 [1,0,0,0,0,0|3,0,0]=4 491 B4R0.1 CCN(C)N MCULE-9839987578 [1,0,0,0,0,0|3,0,0]=4 492 B4R0.1 CCS(=O)C MCULE-4400935745 [1,0,0,0,0,0|2,0,0]=3 493 B4R0.1 CCS(=O)O MCULE-9872932319 [1,0,0,0,0,0|2,0,0]=3 494 B4R0.1 CCS(=O)[O-] MCULE-4386198822 [1,0,0,0,0,0|2,0,1]=4 495 B4R0.1 CC[C@@H](C)N MCULE-2017255826 [1,0,0,0,0,0|2,0,1]=4 496 B4R0.1 CC[C@@H](C)N MCULE-3555707512 [1,0,0,0,0,0|2,0,1]=4 497 B4R0.1 CC[C@@H](C)N MCULE-6783735598 [1,0,0,0,0,0|2,0,1]=4 498 B4R0.1 CC[C@@H](C)N MCULE-7004219201 [1,0,0,0,0,0|2,0,1]=4 499 B4R0.1 CC[C@@H](C)O MCULE-2661481448 [1,0,0,0,0,0|1,0,2]=4 500 B4R0.1 CC[C@@H](C)O MCULE-6785232833 [1,0,0,0,0,0|1,0,2]=4 501 B4R0.1 CC[C@H](C)N MCULE-2450201533 [1,0,0,0,0,0|2,0,1]=4 502 B4R0.1 CC[C@H](C)N MCULE-2998961427 [1,0,0,0,0,0|2,0,1]=4 503 B4R0.1 CC[C@H](C)N MCULE-6692190471 [1,0,0,0,0,0|2,0,1]=4 504 B4R0.1 CC[C@H](C)N MCULE-6904795465 [1,0,0,0,0,0|2,0,1]=4 505 B4R0.1 CC[C@H](C)O MCULE-3700911573 [1,0,0,0,0,0|1,0,2]=4 506 B4R0.1 CC[C@H](C)O MCULE-6063716138 [1,0,0,0,0,0|1,0,2]=4 507 B4R0.1 CN(C)CCl MCULE-4906480184 [1,0,0,0,0,0|3,0,0]=4 508 B4R0.1 CN(C)CCl MCULE-5465672480 [1,0,0,0,0,0|3,0,0]=4 509 B4R0.1 CNC(=O)C MCULE-2612997941 [1,0,0,0,0,0|2,0,0]=3 510 B4R0.1 CNC(=O)Cl MCULE-7743744606 [1,0,0,0,0,0|3,0,0]=4 511 B4R0.1 CNC(=O)N MCULE-6422331704 [1,0,0,0,0,0|3,0,0]=4 512 B4R0.1 CNC(=S)C MCULE-8699171591 [1,0,0,0,0,0|2,1,0]=4 513 B4R0.1 COC(=N)C MCULE-2752794913 [1,0,0,0,0,0|3,0,0]=4 514 B4R0.1 COC(=N)C MCULE-2904991083 [1,0,0,0,0,0|3,0,0]=4 515 B4R0.1 COC(=O)C MCULE-7368066093 [1,0,0,0,0,0|2,0,0]=3 516 B4R0.1 COC(=O)Cl MCULE-8022274771 [1,0,0,0,0,0|3,0,0]=4 517 B4R0.1 COC(=O)N MCULE-4070607369 [1,0,0,0,0,0|3,0,0]=4 518 B4R0.1 CSC(=O)C MCULE-7061634598 [1,0,0,0,0,0|2,0,0]=3 519 B4R0.1 CSC(=S)C MCULE-4836153374 [1,0,0,0,0,0|2,1,0]=4 520 B4R0.1 CSS(=O)C MCULE-6515592458 [1,0,0,0,0,0|3,0,0]=4 521 B4R0.1 C[C@@H](Cl)CO MCULE-4834664531 [1,0,0,0,0,0|1,0,1]=3 522 B4R0.1 C[C@@H](Cl)CO MCULE-8797955903 [1,0,0,0,0,0|1,0,1]=3 523 B4R0.1 C[C@@H](F)CO MCULE-3312305972 [1,0,0,0,0,0|1,0,1]=3 524 B4R0.1 C[C@@H](F)CO MCULE-4754825872 [1,0,0,0,0,0|1,0,1]=3 525 B4R0.1 C[C@@H](N)CF MCULE-2227343602 [1,0,0,0,0,0|2,0,1]=4 526 B4R0.1 C[C@@H](N)CF MCULE-2283243747 [1,0,0,0,0,0|2,0,1]=4 527 B4R0.1 C[C@@H](N)CF MCULE-6326763354 [1,0,0,0,0,0|2,0,1]=4 528 B4R0.1 C[C@@H](N)CF MCULE-6630824972 [1,0,0,0,0,0|2,0,1]=4 529 B4R0.1 C[C@@H](N)CN MCULE-5207840256 [1,0,0,0,0,0|2,0,1]=4 530 B4R0.1 C[C@@H](N)CN MCULE-5332214014 [1,0,0,0,0,0|2,0,1]=4 531 B4R0.1 C[C@@H](N)CN MCULE-7816211809 [1,0,0,0,0,0|2,0,1]=4 532 B4R0.1 C[C@@H](N)CN MCULE-7982492466 [1,0,0,0,0,0|2,0,1]=4 533 B4R0.1 C[C@@H](N)CO MCULE-5655560645 [1,0,0,0,0,0|1,0,1]=3 534 B4R0.1 C[C@@H](N)CO MCULE-8066658004 [1,0,0,0,0,0|1,0,1]=3 535 B4R0.1 C[C@@H](O)CCl MCULE-4669677883 [1,0,0,0,0,0|1,0,2]=4 536 B4R0.1 C[C@@H](O)CCl MCULE-7670590902 [1,0,0,0,0,0|1,0,2]=4 537 B4R0.1 C[C@@H](O)CN MCULE-9301041927 [1,0,0,0,0,0|1,0,2]=4 538 B4R0.1 C[C@@H](O)CO MCULE-4464598400 [1,0,0,0,0,0|0,0,2]=3 539 B4R0.1 C[C@@H](O)CO MCULE-9914833832 [1,0,0,0,0,0|0,0,2]=3 540 B4R0.1 C[C@@H](O)CS MCULE-8817452889 [1,0,0,0,0,0|0,1,2]=4 541 B4R0.1 C[C@H](Cl)CO MCULE-6747279587 [1,0,0,0,0,0|1,0,1]=3 542 B4R0.1 C[C@H](Cl)CO MCULE-8509218918 [1,0,0,0,0,0|1,0,1]=3 543 B4R0.1 C[C@H](F)CO MCULE-1024261541 [1,0,0,0,0,0|1,0,1]=3 544 B4R0.1 C[C@H](F)CO MCULE-7028098137 [1,0,0,0,0,0|1,0,1]=3 545 B4R0.1 C[C@H](N)CF MCULE-1053227516 [1,0,0,0,0,0|2,0,1]=4 546 B4R0.1 C[C@H](N)CF MCULE-4024916343 [1,0,0,0,0,0|2,0,1]=4 547 B4R0.1 C[C@H](N)CF MCULE-6312285034 [1,0,0,0,0,0|2,0,1]=4 548 B4R0.1 C[C@H](N)CF MCULE-7630744199 [1,0,0,0,0,0|2,0,1]=4 549 B4R0.1 C[C@H](N)CN MCULE-2048837128 [1,0,0,0,0,0|2,0,1]=4 550 B4R0.1 C[C@H](N)CN MCULE-4105152552 [1,0,0,0,0,0|2,0,1]=4 551 B4R0.1 C[C@H](N)CN MCULE-7106390536 [1,0,0,0,0,0|2,0,1]=4 552 B4R0.1 C[C@H](N)CN MCULE-9863306005 [1,0,0,0,0,0|2,0,1]=4 553 B4R0.1 C[C@H](N)CO MCULE-2471107013 [1,0,0,0,0,0|1,0,1]=3 554 B4R0.1 C[C@H](N)CO MCULE-5424195678 [1,0,0,0,0,0|1,0,1]=3 555 B4R0.1 C[C@H](O)CCl MCULE-3018109825 [1,0,0,0,0,0|1,0,2]=4 556 B4R0.1 C[C@H](O)CCl MCULE-5836677540 [1,0,0,0,0,0|1,0,2]=4 557 B4R0.1 C[C@H](O)CN MCULE-3227371869 [1,0,0,0,0,0|1,0,2]=4 558 B4R0.1 C[C@H](O)CN MCULE-5480489257 [1,0,0,0,0,0|1,0,2]=4 559 B4R0.1 C[C@H](O)CO MCULE-6582852191 [1,0,0,0,0,0|0,0,2]=3 560 B4R0.1 C[C@H](O)CO MCULE-8074793296 [1,0,0,0,0,0|0,0,2]=3 561 B4R0.1 C[C@H](O)CS MCULE-9061842733 [1,0,0,0,0,0|0,1,2]=4 562 B4R0.1 N=C(N)CCl MCULE-1495198330 [1,0,0,0,0,0|3,0,0]=4 563 B4R0.1 N=C(N)CCl MCULE-2087468158 [1,0,0,0,0,0|3,0,0]=4 564 B4R0.1 N=C(N)CF MCULE-4489534021 [1,0,0,0,0,0|3,0,0]=4 565 B4R0.1 N=C(N)CF MCULE-8858704396 [1,0,0,0,0,0|3,0,0]=4 566 B4R0.1 N=C(N)CN MCULE-2761790792 [1,0,0,0,0,0|3,0,0]=4 567 B4R0.1 N=C(N)CN MCULE-5131841850 [1,0,0,0,0,0|3,0,0]=4 568 B4R0.1 N=C(N)CN MCULE-6618111844 [1,0,0,0,0,0|3,0,0]=4 569 B4R0.1 N=C(N)CO MCULE-5146395919 [1,0,0,0,0,0|2,0,0]=3 570 B4R0.1 N=C(N)CO MCULE-8814507460 [1,0,0,0,0,0|2,0,0]=3 571 B4R0.1 N=C(N)NO MCULE-2554837832 [1,0,0,0,0,0|3,0,0]=4 572 B4R0.1 N=C(N)NO MCULE-5458374815 [1,0,0,0,0,0|3,0,0]=4 573 B4R0.1 N=C(N)NO MCULE-5913043834 [1,0,0,0,0,0|3,0,0]=4 574 B4R0.1 NC(=NO)N MCULE-7650923271 [1,0,0,0,0,0|3,0,0]=4 575 B4R0.1 NC(=O)CBr MCULE-9306090536 [1,0,0,0,0,0|2,0,0]=3 576 B4R0.1 NC(=O)CCl MCULE-3241549842 [1,0,0,0,0,0|2,0,0]=3 577 B4R0.1 NC(=O)CF MCULE-3344212657 [1,0,0,0,0,0|2,0,0]=3 578 B4R0.1 NC(=O)CI MCULE-4217973413 [1,0,0,0,0,0|2,0,0]=3 579 B4R0.1 NC(=O)CO MCULE-2739878376 [1,0,0,0,0,0|1,0,0]=2 580 B4R0.1 NC(=O)CS MCULE-2639305532 [1,0,0,0,0,0|1,1,0]=3 581 B4R0.1 NC(=O)NO MCULE-9465284053 [1,0,0,0,0,0|2,0,0]=3 582 B4R0.1 NC(=S)CF MCULE-7873791134 [1,0,0,0,0,0|2,1,0]=4 583 B4R0.1 NC(=S)CO MCULE-9301705313 [1,0,0,0,0,0|1,1,0]=3 584 B4R0.1 NCC(=O)N MCULE-1048848056 [1,0,0,0,0,0|2,0,0]=3 585 B4R0.1 NCC(=O)N MCULE-2174395809 [1,0,0,0,0,0|2,0,0]=3 586 B4R0.1 NCC(=O)N MCULE-6113166250 [1,0,0,0,0,0|2,0,0]=3 587 B4R0.1 NCC(=O)O MCULE-2415764032 [1,0,0,0,0,0|1,0,0]=2 588 B4R0.1 NCC(=O)O MCULE-3643110755 [1,0,0,0,0,0|1,0,0]=2 589 B4R0.1 NCC(=O)O MCULE-4349255299 [1,0,0,0,0,0|1,0,0]=2 590 B4R0.1 NCC(=O)O MCULE-9146223615 [1,0,0,0,0,0|1,0,0]=2 591 B4R0.1 NCC(=O)O MCULE-9701991737 [1,0,0,0,0,0|1,0,0]=2 592 B4R0.1 NCC(=O)S MCULE-9837799864 [1,0,0,0,0,0|1,1,0]=3 593 B4R0.1 NCC(=O)[O-] MCULE-5975202378 [1,0,0,0,0,0|1,0,1]=3 594 B4R0.1 NCS(=O)[O-] MCULE-6627922989 [1,0,0,0,0,0|2,0,1]=4 595 B4R0.1 NCS(=O)[O-] MCULE-9434739250 [1,0,0,0,0,0|2,0,1]=4 596 B4R0.1 NNC(=O)N MCULE-3392559370 [1,0,0,0,0,0|3,0,0]=4 597 B4R0.1 NNC(=O)N MCULE-8490374775 [1,0,0,0,0,0|3,0,0]=4 598 B4R0.1 O=C(Br)CBr MCULE-6031858200 [1,0,0,0,0,0|2,0,0]=3 599 B4R0.1 O=C(Cl)CBr MCULE-7684029984 [1,0,0,0,0,0|2,0,0]=3 600 B4R0.1 O=C(Cl)CCl MCULE-7076914635 [1,0,0,0,0,0|2,0,0]=3 601 B4R0.1 O=C(Cl)CF MCULE-7182087882 [1,0,0,0,0,0|2,0,0]=3 602 B4R0.1 O=C(Cl)CI MCULE-5719121455 [1,0,0,0,0,0|2,0,0]=3 603 B4R0.1 O=C(Cl)SCl MCULE-5008011265 [1,0,0,0,0,0|3,0,0]=4 604 B4R0.1 O=C(O)CBr MCULE-1503716137 [1,0,0,0,0,0|1,0,0]=2 605 B4R0.1 O=C(O)CCl MCULE-9228754880 [1,0,0,0,0,0|1,0,0]=2 606 B4R0.1 O=C(O)CF MCULE-6584094437 [1,0,0,0,0,0|1,0,0]=2 607 B4R0.1 O=C(O)CI MCULE-3146792857 [1,0,0,0,0,0|1,0,0]=2 608 B4R0.1 O=C(O)CO MCULE-9792551388 [1,0,0,0,0,0|0,0,0]=1 609 B4R0.1 O=C(O)CS MCULE-8097997001 [1,0,0,0,0,0|0,1,0]=2 610 B4R0.1 O=C([O-])CF MCULE-8428965857 [1,0,0,0,0,0|1,0,1]=3 611 B4R0.1 O=C([O-])CO MCULE-2780567509 [1,0,0,0,0,0|0,0,1]=2 612 B4R0.1 O=C([O-])CS MCULE-3314809220 [1,0,0,0,0,0|0,1,1]=3 613 B4R0.1 O=C([O-])CS MCULE-5989133747 [1,0,0,0,0,0|0,1,1]=3 614 B4R0.1 O=CC(=O)O MCULE-5307898766 [1,0,0,0,0,0|0,0,2]=3 615 B4R0.1 O=N(=O)CBr MCULE-5030744397 [1,0,0,0,0,0|2,0,1]=4 616 B4R0.1 O=N(=O)CF MCULE-9920695539 [1,0,0,0,0,0|2,0,1]=4 617 B4R0.1 O=S(O)CO MCULE-4195832185 [1,0,0,0,0,0|1,0,0]=2 618 B4R0.1 O=S([O-])CF MCULE-5711587598 [1,0,0,0,0,0|2,0,1]=4 619 B4R0.1 O=S([O-])CF MCULE-9276464291 [1,0,0,0,0,0|2,0,1]=4 620 B4R0.1 O=S([O-])CO MCULE-5211722344 [1,0,0,0,0,0|1,0,1]=3 621 B4R0.1 OB(O)CCl MCULE-1740750359 [1,0,0,0,0,0|2,0,1]=4 622 B4R0.1 OCC(Cl)Cl MCULE-3279441180 [1,0,0,0,0,0|2,0,1]=4 623 B4R0.1 OCC(F)Br MCULE-5466660542 [1,0,0,0,0,0|2,0,1]=4 624 B4R0.1 OCC(F)F MCULE-3252378943 [1,0,0,0,0,0|2,0,1]=4 625 B4R0.1 ON=C(Br)Br MCULE-4053513648 [1,0,0,0,0,0|3,0,0]=4 626 B4R0.1 P(=O)(O)CN MCULE-5441171864 [1,0,0,0,0,0|2,0,0]=3 627 B4R0.1 [C@H](C)(O)CN MCULE-8212000072 [1,0,0,0,0,0|1,0,2]=4 628 B4R0.1 [NH3+]C(C)CC MCULE-3066898055 [1,0,0,0,0,0|2,0,1]=4 629 B4R0.2 BrC=CCBr MCULE-1480697982 [1,0,0,0,0,0|2,0,1]=4 630 B4R0.2 BrCCCBr MCULE-6500110480 [1,0,0,0,0,0|2,0,1]=4 631 B4R0.2 BrCCCI MCULE-6470610840 [1,0,0,0,0,0|2,0,1]=4 632 B4R0.2 BrCOCBr MCULE-2371209322 [1,0,0,0,0,0|3,0,0]=4 633 B4R0.2 C#CCCO MCULE-1797559276 [1,0,0,0,0,0|1,0,2]=4 634 B4R0.2 C#CCCO MCULE-8743964065 [1,0,0,0,0,0|1,0,2]=4 635 B4R0.2 C/C=C/CCl MCULE-9977493525 [1,0,0,0,0,0|2,0,1]=4 636 B4R0.2 C/C=C/CO MCULE-2383161163 [1,0,0,0,0,0|1,0,1]=3 637 B4R0.2 C/C=C\CO MCULE-5924662327 [1,0,0,0,0,0|1,0,1]=3 638 B4R0.2 C=C=CCC MCULE-6123315571 [1,0,0,0,0,0|2,0,1]=4 639 B4R0.2 C=C=CCN MCULE-5700871644 [1,0,0,0,0,0|2,0,1]=4 640 B4R0.2 C=C=CCN MCULE-9120483529 [1,0,0,0,0,0|2,0,1]=4 641 B4R0.2 C=C=CCO MCULE-5424851896 [1,0,0,0,0,0|1,0,1]=3 642 B4R0.2 C=CCCO MCULE-4582400839 [1,0,0,0,0,0|1,0,2]=4 643 B4R0.2 CC#CCO MCULE-5096552076 [1,0,0,0,0,0|1,0,2]=4 644 B4R0.2 CC=CCBr MCULE-7855581866 [1,0,0,0,0,0|2,0,1]=4 645 B4R0.2 CC=CCC MCULE-5931905453 [1,0,0,0,0,0|2,0,1]=4 646 B4R0.2 CC=CCCl MCULE-3941962217 [1,0,0,0,0,0|2,0,1]=4 647 B4R0.2 CC=CCO MCULE-7490725844 [1,0,0,0,0,0|1,0,1]=3 648 B4R0.2 CCC=CBr MCULE-4471551501 [1,0,0,0,0,0|2,0,1]=4 649 B4R0.2 CCC=NO MCULE-9457280654 [1,0,0,0,0,0|2,0,0]=3 650 B4R0.2 CCCCBr MCULE-3390217131 [1,0,0,0,0,0|2,0,1]=4 651 B4R0.2 CCCCC MCULE-4643148765 [1,0,0,0,0,0|2,0,1]=4 652 B4R0.2 CCCCCl MCULE-5329900290 [1,0,0,0,0,0|2,0,1]=4 653 B4R0.2 CCCCF MCULE-7225760858 [1,0,0,0,0,0|2,0,1]=4 654 B4R0.2 CCCCI MCULE-1160974720 [1,0,0,0,0,0|2,0,1]=4 655 B4R0.2 CCCCN MCULE-1731874934 [1,0,0,0,0,0|2,0,1]=4 656 B4R0.2 CCCCN MCULE-4233278050 [1,0,0,0,0,0|2,0,1]=4 657 B4R0.2 CCCCN MCULE-5242069370 [1,0,0,0,0,0|2,0,1]=4 658 B4R0.2 CCCCN MCULE-7343835253 [1,0,0,0,0,0|2,0,1]=4 659 B4R0.2 CCCCO MCULE-1571156443 [1,0,0,0,0,0|1,0,1]=3 660 B4R0.2 CCCCS MCULE-9441213933 [1,0,0,0,0,0|1,1,1]=4 661 B4R0.2 CCNCC MCULE-3395060353 [1,0,0,0,0,0|3,0,0]=4 662 B4R0.2 CCNCC MCULE-4374609736 [1,0,0,0,0,0|3,0,0]=4 663 B4R0.2 CCNCC MCULE-4555901025 [1,0,0,0,0,0|3,0,0]=4 664 B4R0.2 CCNCC MCULE-6895602113 [1,0,0,0,0,0|3,0,0]=4 665 B4R0.2 CCOCBr MCULE-6644755987 [1,0,0,0,0,0|3,0,0]=4 666 B4R0.2 CCOCC MCULE-5665709021 [1,0,0,0,0,0|3,0,0]=4 667 B4R0.2 CCOCCl MCULE-5087992840 [1,0,0,0,0,0|3,0,0]=4 668 B4R0.2 CCSCC MCULE-6480710239 [1,0,0,0,0,0|3,0,0]=4 669 B4R0.2 CCSCCl MCULE-3890542152 [1,0,0,0,0,0|3,0,0]=4 670 B4R0.2 CC[NH2+]CC MCULE-9899430356 [1,0,0,0,0,0|3,0,0]=4 671 B4R0.2 CNCCO MCULE-7051900771 [1,0,0,0,0,0|2,0,1]=4 672 B4R0.2 CNCCO MCULE-7934732981 [1,0,0,0,0,0|2,0,1]=4 673 B4R0.2 COCCO MCULE-4751927883 [1,0,0,0,0,0|2,0,1]=4 674 B4R0.2 CSCCO MCULE-9706874325 [1,0,0,0,0,0|2,0,1]=4 675 B4R0.2 Cl/C=C/CCl MCULE-4516188972 [1,0,0,0,0,0|2,0,1]=4 676 B4R0.2 ClC/C=C/Br MCULE-1061414929 [1,0,0,0,0,0|2,0,1]=4 677 B4R0.2 ClC=CCCl MCULE-4655672652 [1,0,0,0,0,0|2,0,1]=4 678 B4R0.2 ClCCCBr MCULE-7937580875 [1,0,0,0,0,0|2,0,1]=4 679 B4R0.2 ClCCCCl MCULE-6693270397 [1,0,0,0,0,0|2,0,1]=4 680 B4R0.2 ClCCCI MCULE-1521526833 [1,0,0,0,0,0|2,0,1]=4 681 B4R0.2 ClCSCCl MCULE-5228778525 [1,0,0,0,0,0|3,0,0]=4 682 B4R0.2 FCCCBr MCULE-5674735753 [1,0,0,0,0,0|2,0,1]=4 683 B4R0.2 FCCCF MCULE-1803511350 [1,0,0,0,0,0|2,0,1]=4 684 B4R0.2 FCCCI MCULE-9287814857 [1,0,0,0,0,0|2,0,1]=4 685 B4R0.2 ICCCI MCULE-9849754168 [1,0,0,0,0,0|2,0,1]=4 686 B4R0.2 ICOCI MCULE-4901830231 [1,0,0,0,0,0|3,0,0]=4 687 B4R0.2 N#CCCO MCULE-5098987368 [1,0,0,0,0,0|1,0,2]=4 688 B4R0.2 NCCCBr MCULE-5485748003 [1,0,0,0,0,0|2,0,1]=4 689 B4R0.2 NCCCBr MCULE-7072709972 [1,0,0,0,0,0|2,0,1]=4 690 B4R0.2 NCCCCl MCULE-1324157004 [1,0,0,0,0,0|2,0,1]=4 691 B4R0.2 NCCCCl MCULE-3667248190 [1,0,0,0,0,0|2,0,1]=4 692 B4R0.2 NCCCF MCULE-5215746973 [1,0,0,0,0,0|2,0,1]=4 693 B4R0.2 NCCCF MCULE-8077133369 [1,0,0,0,0,0|2,0,1]=4 694 B4R0.2 NCCCI MCULE-3534892097 [1,0,0,0,0,0|2,0,1]=4 695 B4R0.2 NCCCI MCULE-8010453546 [1,0,0,0,0,0|2,0,1]=4 696 B4R0.2 NCCCN MCULE-4293255820 [1,0,0,0,0,0|2,0,1]=4 697 B4R0.2 NCCCN MCULE-5041378433 [1,0,0,0,0,0|2,0,1]=4 698 B4R0.2 NCCCN MCULE-6944452060 [1,0,0,0,0,0|2,0,1]=4 699 B4R0.2 NCCCN MCULE-7375662153 [1,0,0,0,0,0|2,0,1]=4 700 B4R0.2 NCCCN MCULE-8277465929 [1,0,0,0,0,0|2,0,1]=4 701 B4R0.2 NCCCN MCULE-9929373126 [1,0,0,0,0,0|2,0,1]=4 702 B4R0.2 NCCCO MCULE-2851278356 [1,0,0,0,0,0|1,0,1]=3 703 B4R0.2 NCCCO MCULE-9698089092 [1,0,0,0,0,0|1,0,1]=3 704 B4R0.2 NCCCS MCULE-3994478020 [1,0,0,0,0,0|1,1,1]=4 705 B4R0.2 NCCCS MCULE-7730973866 [1,0,0,0,0,0|1,1,1]=4 706 B4R0.2 NNCCO MCULE-1290652744 [1,0,0,0,0,0|2,0,1]=4 707 B4R0.2 NOCCO MCULE-2545004367 [1,0,0,0,0,0|2,0,1]=4 708 B4R0.2 O=CCCO MCULE-1685289763 [1,0,0,0,0,0|0,0,3]=4 709 B4R0.2 OC=CCCl MCULE-4750991393 [1,0,0,0,0,0|1,0,1]=3 710 B4R0.2 OCC#CBr MCULE-2495653455 [1,0,0,0,0,0|1,0,2]=4 711 B4R0.2 OCC#CI MCULE-1101149708 [1,0,0,0,0,0|1,0,2]=4 712 B4R0.2 OCC=CBr MCULE-4636104289 [1,0,0,0,0,0|1,0,1]=3 713 B4R0.2 OCC=CCl MCULE-2110127594 [1,0,0,0,0,0|1,0,1]=3 714 B4R0.2 OCCCBr MCULE-3450011527 [1,0,0,0,0,0|1,0,1]=3 715 B4R0.2 OCCCCl MCULE-2319230957 [1,0,0,0,0,0|1,0,1]=3 716 B4R0.2 OCCCF MCULE-2347934403 [1,0,0,0,0,0|1,0,1]=3 717 B4R0.2 OCCCI MCULE-5200713967 [1,0,0,0,0,0|1,0,1]=3 718 B4R0.2 OCCCO MCULE-5166824786 [1,0,0,0,0,0|0,0,1]=2 719 B4R0.2 OCCCS MCULE-7930164048 [1,0,0,0,0,0|0,1,1]=3 720 B4R0.2 ON=CCCl MCULE-5736695742 [1,0,0,0,0,0|2,0,0]=3 721 B4R0.2 PCCCP MCULE-6048146071 [1,0,0,0,0,0|2,0,1]=4 722 B4R0.2 SCCCBr MCULE-4627341228 [1,0,0,0,0,0|1,1,1]=4 723 B4R0.2 SCCCCl MCULE-6410389127 [1,0,0,0,0,0|1,1,1]=4 724 B4R0.2 SCCCS MCULE-8220630729 [1,0,0,0,0,0|0,2,1]=4 725 B4R0.2 [NH2+](CC)CC MCULE-1192179232 [1,0,0,0,0,0|3,0,0]=4 726 B6R0.1 C#C/C(=C\CO)/C MCULE-5643545939 [0,1,0,0,0,0|2,0,1]=4 727 B6R0.1 C#CC(=CCO)C MCULE-7063837718 [0,1,0,0,0,0|2,0,1]=4 728 B6R0.1 C#CC(=O)CCC MCULE-8990254228 [0,1,0,0,0,0|2,0,1]=4 729 B6R0.1 C#CC(=O)NCC MCULE-3703208943 [0,1,0,0,0,0|2,0,1]=4 730 B6R0.1 C#CC(=O)OCC MCULE-3783424133 [0,1,0,0,0,0|2,0,1]=4 731 B6R0.1 C#CCC(=O)OC MCULE-8097491486 [0,1,0,0,0,0|3,0,0]=4 732 B6R0.1 C#CCC(C)CO MCULE-6139260605 [0,1,0,0,0,0|2,0,1]=4 733 B6R0.1 C#CCC(N)CO MCULE-5669035635 [0,1,0,0,0,0|2,0,1]=4 734 B6R0.1 C#CC[C@@H](N)CO MCULE-2638776426 [0,1,0,0,0,0|2,0,1]=4 735 B6R0.1 C#CC[C@@H](N)CO MCULE-7710952185 [0,1,0,0,0,0|2,0,1]=4 736 B6R0.1 C#CC[C@H](N)CO MCULE-8069295628 [0,1,0,0,0,0|2,0,1]=4 737 B6R0.1 C#CC[C@H](N)CO MCULE-9440234580 [0,1,0,0,0,0|2,0,1]=4 738 B6R0.1 C(=C/C(=O)CC)\C MCULE-9250312874 [0,1,0,0,0,0|2,0,1]=4 739 B6R0.1 C/C(=N\O)/C=N/O MCULE-3049929204 [0,1,0,0,0,0|2,0,1]=4 740 B6R0.1 C=C(CC)CCO MCULE-5317656776 [0,1,0,0,0,0|2,0,0]=3 741 B6R0.1 C=CC(=O)CCC MCULE-9373104880 [0,1,0,0,0,0|2,0,1]=4 742 B6R0.1 C=CC(=O)COC MCULE-1933195578 [0,1,0,0,0,0|1,0,1]=3 743 B6R0.1 C=CC(=O)NCC MCULE-3515057147 [0,1,0,0,0,0|2,0,1]=4 744 B6R0.1 C=CC(=O)NCO MCULE-3627112877 [0,1,0,0,0,0|1,0,1]=3 745 B6R0.1 C=CC(=O)OCC MCULE-9281713240 [0,1,0,0,0,0|2,0,1]=4 746 B6R0.1 C=CC/C(=N/O)/N MCULE-6681864760 [0,1,0,0,0,0|3,0,0]=4 747 B6R0.1 C=CCC(=O)CN MCULE-3960819679 [0,1,0,0,0,0|2,0,0]=3 748 B6R0.1 C=CCC(=O)CN MCULE-8089375331 [0,1,0,0,0,0|2,0,0]=3 749 B6R0.1 C=CCC(=O)NC MCULE-4823208577 [0,1,0,0,0,0|3,0,0]=4 750 B6R0.1 C=CCC(=O)OC MCULE-5546680906 [0,1,0,0,0,0|3,0,0]=4 751 B6R0.1 C=CCC(C)CO MCULE-9174943108 [0,1,0,0,0,0|2,0,1]=4 752 B6R0.1 C=CCC(N)CO MCULE-3854217705 [0,1,0,0,0,0|2,0,1]=4 753 B6R0.1 C=CCC(N)CO MCULE-6104194102 [0,1,0,0,0,0|2,0,1]=4 754 B6R0.1 C=CCC(N)CO MCULE-6473126335 [0,1,0,0,0,0|2,0,1]=4 755 B6R0.1 C=CCC(N)CO MCULE-8430673873 [0,1,0,0,0,0|2,0,1]=4 756 B6R0.1 C=CC[C@@H](N)CO MCULE-1869015815 [0,1,0,0,0,0|2,0,1]=4 757 B6R0.1 C=CC[C@@H](N)CO MCULE-2792980070 [0,1,0,0,0,0|2,0,1]=4 758 B6R0.1 C=CC[C@@H](N)CO MCULE-3168704187 [0,1,0,0,0,0|2,0,1]=4 759 B6R0.1 C=CC[C@@H](N)CO MCULE-4796522209 [0,1,0,0,0,0|2,0,1]=4 760 B6R0.1 C=CC[C@H](N)CO MCULE-2427943513 [0,1,0,0,0,0|2,0,1]=4 761 B6R0.1 C=CC[C@H](N)CO MCULE-4244461120 [0,1,0,0,0,0|2,0,1]=4 762 B6R0.1 C=CC[C@H](N)CO MCULE-6760610212 [0,1,0,0,0,0|2,0,1]=4 763 B6R0.1 C=CC[C@H](N)CO MCULE-7914934929 [0,1,0,0,0,0|2,0,1]=4 764 B6R0.1 C=COC(=O)CC MCULE-7662621547 [0,1,0,0,0,0|2,0,1]=4 765 B6R0.1 C=COC(=O)CCl MCULE-7675766105 [0,1,0,0,0,0|2,0,1]=4 766 B6R0.1 CC(=CCBr)CBr MCULE-6875050264 [0,1,0,0,0,0|3,0,0]=4 767 B6R0.1 CC(=CCBr)CCl MCULE-3390489656 [0,1,0,0,0,0|3,0,0]=4 768 B6R0.1 CC(=NO)C=NO MCULE-9711224051 [0,1,0,0,0,0|2,0,1]=4 769 B6R0.1 CC(CN)CCO MCULE-5515163518 [0,1,0,0,0,0|2,0,1]=4 770 B6R0.1 CC(CO)CCN MCULE-9900244005 [0,1,0,0,0,0|2,0,1]=4 771 B6R0.1 CC(CO)CCO MCULE-5240961149 [0,1,0,0,0,0|1,0,1]=3 772 B6R0.1 CC(CO)CCO MCULE-8678967805 [0,1,0,0,0,0|1,0,1]=3 773 B6R0.1 CC=CC(=O)CC MCULE-5948495959 [0,1,0,0,0,0|2,0,1]=4 774 B6R0.1 CCC(=CCO)C MCULE-5264054153 [0,1,0,0,0,0|2,0,0]=3 775 B6R0.1 CCC(=O)CC#N MCULE-6150629588 [0,1,0,0,0,0|2,0,0]=3 776 B6R0.1 CCC(=O)CNC MCULE-3030105640 [0,1,0,0,0,0|2,0,0]=3 777 B6R0.1 CCC(=O)CNC MCULE-6945295017 [0,1,0,0,0,0|2,0,0]=3 778 B6R0.1 CCC(=O)COC MCULE-1087802011 [0,1,0,0,0,0|1,0,0]=2 779 B6R0.1 CCC(=O)CSC MCULE-3230433182 [0,1,0,0,0,0|1,1,0]=3 780 B6R0.1 CCC(=O)NOC MCULE-4440074406 [0,1,0,0,0,0|2,0,0]=3 781 B6R0.1 CCC(=O)OCCl MCULE-6975707373 [0,1,0,0,0,0|2,0,0]=3 782 B6R0.1 CCC(Br)COC MCULE-7942540965 [0,1,0,0,0,0|2,0,1]=4 783 B6R0.1 CCC(C)CCO MCULE-6482427735 [0,1,0,0,0,0|2,0,1]=4 784 B6R0.1 CCC(C)CON MCULE-7033012303 [0,1,0,0,0,0|2,0,1]=4 785 B6R0.1 CCC(N)CCO MCULE-1511155206 [0,1,0,0,0,0|2,0,1]=4 786 B6R0.1 CCC(N)CCO MCULE-5525302643 [0,1,0,0,0,0|2,0,1]=4 787 B6R0.1 CCC(N)COC MCULE-2103613859 [0,1,0,0,0,0|2,0,1]=4 788 B6R0.1 CCC(N)COC MCULE-5835446359 [0,1,0,0,0,0|2,0,1]=4 789 B6R0.1 CCC(O)CCO MCULE-5156075792 [0,1,0,0,0,0|1,0,2]=4 790 B6R0.1 CCC(O)COC MCULE-6751000060 [0,1,0,0,0,0|1,0,2]=4 791 B6R0.1 CCC(S)CCO MCULE-4193788852 [0,1,0,0,0,0|1,1,1]=4 792 B6R0.1 CCC/C(=N/O)/N MCULE-1101103373 [0,1,0,0,0,0|3,0,0]=4 793 B6R0.1 CCC/C(=N/O)/N MCULE-2970638438 [0,1,0,0,0,0|3,0,0]=4 794 B6R0.1 CCCC(=NO)C MCULE-6437787263 [0,1,0,0,0,0|3,0,0]=4 795 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [0,1,0,0,0,0|2,0,0]=3 796 B6R0.1 CCCC(=O)CC MCULE-7121523805 [0,1,0,0,0,0|2,0,0]=3 797 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [0,1,0,0,0,0|2,0,0]=3 798 B6R0.1 CCCC(=O)CN MCULE-4663263123 [0,1,0,0,0,0|2,0,0]=3 799 B6R0.1 CCCC(=O)CN MCULE-6326368932 [0,1,0,0,0,0|2,0,0]=3 800 B6R0.1 CCCC(=O)CO MCULE-6518249412 [0,1,0,0,0,0|1,0,0]=2 801 B6R0.1 CCCC(=O)NC MCULE-5770149071 [0,1,0,0,0,0|3,0,0]=4 802 B6R0.1 CCCC(=O)NN MCULE-3660167295 [0,1,0,0,0,0|3,0,0]=4 803 B6R0.1 CCCC(=O)NO MCULE-8710375368 [0,1,0,0,0,0|2,0,0]=3 804 B6R0.1 CCCC(=O)OC MCULE-1092030267 [0,1,0,0,0,0|3,0,0]=4 805 B6R0.1 CCCC(=O)SC MCULE-1490654381 [0,1,0,0,0,0|3,0,0]=4 806 B6R0.1 CCCC(C)CO MCULE-9777250826 [0,1,0,0,0,0|2,0,1]=4 807 B6R0.1 CCCC(N)CO MCULE-3404967504 [0,1,0,0,0,0|2,0,1]=4 808 B6R0.1 CCCC(N)CO MCULE-3802448518 [0,1,0,0,0,0|2,0,1]=4 809 B6R0.1 CCCC(N)CO MCULE-4259078445 [0,1,0,0,0,0|2,0,1]=4 810 B6R0.1 CCCC(N)CO MCULE-6425025734 [0,1,0,0,0,0|2,0,1]=4 811 B6R0.1 CCCC(O)CO MCULE-5124107719 [0,1,0,0,0,0|1,0,2]=4 812 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [0,1,0,0,0,0|2,0,1]=4 813 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [0,1,0,0,0,0|2,0,1]=4 814 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [0,1,0,0,0,0|2,0,1]=4 815 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [0,1,0,0,0,0|2,0,1]=4 816 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [0,1,0,0,0,0|2,0,1]=4 817 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [0,1,0,0,0,0|2,0,1]=4 818 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [0,1,0,0,0,0|2,0,1]=4 819 B6R0.1 CCN(C)CCO MCULE-5519271145 [0,1,0,0,0,0|3,0,0]=4 820 B6R0.1 CCN(N)CCO MCULE-7988723724 [0,1,0,0,0,0|3,0,0]=4 821 B6R0.1 CCNC(=O)CBr MCULE-5393521747 [0,1,0,0,0,0|2,0,0]=3 822 B6R0.1 CCNC(=O)CC MCULE-8820594723 [0,1,0,0,0,0|2,0,0]=3 823 B6R0.1 CCNC(=O)CCl MCULE-7288703153 [0,1,0,0,0,0|2,0,0]=3 824 B6R0.1 CCNC(=O)CN MCULE-1913543460 [0,1,0,0,0,0|2,0,0]=3 825 B6R0.1 CCNC(=O)CN MCULE-5473845751 [0,1,0,0,0,0|2,0,0]=3 826 B6R0.1 CCNC(=O)CO MCULE-1386307800 [0,1,0,0,0,0|1,0,0]=2 827 B6R0.1 CCNC(=O)NC MCULE-7197803115 [0,1,0,0,0,0|3,0,0]=4 828 B6R0.1 CCNC(=O)NN MCULE-9055200574 [0,1,0,0,0,0|3,0,0]=4 829 B6R0.1 CCNC(=O)NO MCULE-3264850022 [0,1,0,0,0,0|2,0,0]=3 830 B6R0.1 CCNC(=O)OC MCULE-7110705188 [0,1,0,0,0,0|3,0,0]=4 831 B6R0.1 CCNC(C)CO MCULE-4344397973 [0,1,0,0,0,0|2,0,1]=4 832 B6R0.1 CCN[C@@H](C)CO MCULE-5648721449 [0,1,0,0,0,0|2,0,1]=4 833 B6R0.1 CCN[C@H](C)CO MCULE-8047465405 [0,1,0,0,0,0|2,0,1]=4 834 B6R0.1 CCO/C(=N/O)/C MCULE-2336241507 [0,1,0,0,0,0|3,0,0]=4 835 B6R0.1 CCO/C(=N\O)/C MCULE-7101376522 [0,1,0,0,0,0|3,0,0]=4 836 B6R0.1 CCOC(=N)CC MCULE-4645506860 [0,1,0,0,0,0|3,0,0]=4 837 B6R0.1 CCOC(=N)CC MCULE-9526837631 [0,1,0,0,0,0|3,0,0]=4 838 B6R0.1 CCOC(=N)CCl MCULE-6291047852 [0,1,0,0,0,0|3,0,0]=4 839 B6R0.1 CCOC(=N)CCl MCULE-9207251975 [0,1,0,0,0,0|3,0,0]=4 840 B6R0.1 CCOC(=NO)C MCULE-6964305821 [0,1,0,0,0,0|3,0,0]=4 841 B6R0.1 CCOC(=O)C#N MCULE-4506452376 [0,1,0,0,0,0|2,0,1]=4 842 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [0,1,0,0,0,0|1,0,2]=4 843 B6R0.1 CCOC(=O)CBr MCULE-1369687761 [0,1,0,0,0,0|2,0,0]=3 844 B6R0.1 CCOC(=O)CC MCULE-1639864693 [0,1,0,0,0,0|2,0,0]=3 845 B6R0.1 CCOC(=O)CCl MCULE-2200524105 [0,1,0,0,0,0|2,0,0]=3 846 B6R0.1 CCOC(=O)CF MCULE-1926097423 [0,1,0,0,0,0|2,0,0]=3 847 B6R0.1 CCOC(=O)CI MCULE-9898762324 [0,1,0,0,0,0|2,0,0]=3 848 B6R0.1 CCOC(=O)CN MCULE-2185173056 [0,1,0,0,0,0|2,0,0]=3 849 B6R0.1 CCOC(=O)CN MCULE-2628607025 [0,1,0,0,0,0|2,0,0]=3 850 B6R0.1 CCOC(=O)CO MCULE-8121340151 [0,1,0,0,0,0|1,0,0]=2 851 B6R0.1 CCOC(=O)CS MCULE-3354026239 [0,1,0,0,0,0|1,1,0]=3 852 B6R0.1 CCOC(=O)NC MCULE-5506841198 [0,1,0,0,0,0|3,0,0]=4 853 B6R0.1 CCOC(=O)NN MCULE-9872948119 [0,1,0,0,0,0|3,0,0]=4 854 B6R0.1 CCOC(=O)NO MCULE-4701193610 [0,1,0,0,0,0|2,0,0]=3 855 B6R0.1 CCOC(=O)OC MCULE-1185162684 [0,1,0,0,0,0|3,0,0]=4 856 B6R0.1 CCOC(C)CO MCULE-1592146913 [0,1,0,0,0,0|2,0,1]=4 857 B6R0.1 CCOS(=O)CC MCULE-4858180441 [0,1,0,0,0,0|3,0,0]=4 858 B6R0.1 CCS(=O)CCCl MCULE-1910591721 [0,1,0,0,0,0|3,0,0]=4 859 B6R0.1 CCS(=O)CCN MCULE-7201812983 [0,1,0,0,0,0|3,0,0]=4 860 B6R0.1 CCS(=O)CCN MCULE-7831905163 [0,1,0,0,0,0|3,0,0]=4 861 B6R0.1 CCS(=O)CCO MCULE-8290368918 [0,1,0,0,0,0|2,0,0]=3 862 B6R0.1 CCSC(=O)CC MCULE-6361738004 [0,1,0,0,0,0|2,0,0]=3 863 B6R0.1 CC[C@@H](N)COC MCULE-2231338404 [0,1,0,0,0,0|2,0,1]=4 864 B6R0.1 CC[C@@H](N)COC MCULE-2931188781 [0,1,0,0,0,0|2,0,1]=4 865 B6R0.1 CC[C@@H](N)COC MCULE-5773677141 [0,1,0,0,0,0|2,0,1]=4 866 B6R0.1 CC[C@@H](N)COC MCULE-5939905142 [0,1,0,0,0,0|2,0,1]=4 867 B6R0.1 CC[C@H](C)CCO MCULE-1190203828 [0,1,0,0,0,0|2,0,1]=4 868 B6R0.1 CC[C@H](C)CCO MCULE-8460710173 [0,1,0,0,0,0|2,0,1]=4 869 B6R0.1 CC[C@H](N)COC MCULE-1115072226 [0,1,0,0,0,0|2,0,1]=4 870 B6R0.1 CC[C@H](N)COC MCULE-3917835289 [0,1,0,0,0,0|2,0,1]=4 871 B6R0.1 CC[C@H](N)COC MCULE-8706423122 [0,1,0,0,0,0|2,0,1]=4 872 B6R0.1 CC[C@H](N)COC MCULE-9406311547 [0,1,0,0,0,0|2,0,1]=4 873 B6R0.1 CNC(=O)CC#N MCULE-2970000161 [0,1,0,0,0,0|3,0,0]=4 874 B6R0.1 CNC(=O)CCBr MCULE-9239224841 [0,1,0,0,0,0|3,0,0]=4 875 B6R0.1 CNC(=O)CCCl MCULE-7130866366 [0,1,0,0,0,0|3,0,0]=4 876 B6R0.1 CNC(=O)CCN MCULE-1374127264 [0,1,0,0,0,0|3,0,0]=4 877 B6R0.1 CNC(=O)CCN MCULE-3948893656 [0,1,0,0,0,0|3,0,0]=4 878 B6R0.1 CNC(=O)CCO MCULE-3222339741 [0,1,0,0,0,0|2,0,0]=3 879 B6R0.1 CNC(=O)CCS MCULE-2385806944 [0,1,0,0,0,0|2,1,0]=4 880 B6R0.1 CNC(=O)CON MCULE-6451598359 [0,1,0,0,0,0|2,0,0]=3 881 B6R0.1 CNC(=O)CON MCULE-8743298594 [0,1,0,0,0,0|2,0,0]=3 882 B6R0.1 CNC(=S)NCO MCULE-2829573844 [0,1,0,0,0,0|2,1,0]=4 883 B6R0.1 CNCC(=O)NC MCULE-4579550577 [0,1,0,0,0,0|3,0,0]=4 884 B6R0.1 CNCC(=O)NC MCULE-7833395637 [0,1,0,0,0,0|3,0,0]=4 885 B6R0.1 CNCC(=O)NN MCULE-8639164023 [0,1,0,0,0,0|3,0,0]=4 886 B6R0.1 CNCC(=O)OC MCULE-1667683926 [0,1,0,0,0,0|3,0,0]=4 887 B6R0.1 CNCC(=O)OC MCULE-5530863658 [0,1,0,0,0,0|3,0,0]=4 888 B6R0.1 CNCC(C)CO MCULE-6329429747 [0,1,0,0,0,0|2,0,1]=4 889 B6R0.1 CNCC(O)CO MCULE-4566952448 [0,1,0,0,0,0|1,0,2]=4 890 B6R0.1 CNC[C@H](O)CO MCULE-3410453252 [0,1,0,0,0,0|1,0,2]=4 891 B6R0.1 COC(=N)CCO MCULE-1904978557 [0,1,0,0,0,0|3,0,0]=4 892 B6R0.1 COC(=N)CCO MCULE-8146089973 [0,1,0,0,0,0|3,0,0]=4 893 B6R0.1 COC(=O)CC#N MCULE-2699345092 [0,1,0,0,0,0|3,0,0]=4 894 B6R0.1 COC(=O)CC=O MCULE-6624474559 [0,1,0,0,0,0|2,0,1]=4 895 B6R0.1 COC(=O)CCBr MCULE-3565567444 [0,1,0,0,0,0|3,0,0]=4 896 B6R0.1 COC(=O)CCCl MCULE-5034007224 [0,1,0,0,0,0|3,0,0]=4 897 B6R0.1 COC(=O)CCI MCULE-5984806612 [0,1,0,0,0,0|3,0,0]=4 898 B6R0.1 COC(=O)CCN MCULE-2306060188 [0,1,0,0,0,0|3,0,0]=4 899 B6R0.1 COC(=O)CCN MCULE-8245275833 [0,1,0,0,0,0|3,0,0]=4 900 B6R0.1 COC(=O)CCO MCULE-8538834260 [0,1,0,0,0,0|2,0,0]=3 901 B6R0.1 COC(=O)CCS MCULE-1695345183 [0,1,0,0,0,0|2,1,0]=4 902 B6R0.1 COC(=O)CNN MCULE-3287579794 [0,1,0,0,0,0|3,0,0]=4 903 B6R0.1 COC(=O)CNN MCULE-3838874166 [0,1,0,0,0,0|3,0,0]=4 904 B6R0.1 COC(=O)CON MCULE-4799038238 [0,1,0,0,0,0|2,0,0]=3 905 B6R0.1 COC(=O)CSC MCULE-6735536033 [0,1,0,0,0,0|2,1,0]=4 906 B6R0.1 COC(=O)OCCl MCULE-7856529986 [0,1,0,0,0,0|3,0,0]=4 907 B6R0.1 COC(=O)OCF MCULE-4705008675 [0,1,0,0,0,0|3,0,0]=4 908 B6R0.1 COC(=O)OCI MCULE-8692720175 [0,1,0,0,0,0|3,0,0]=4 909 B6R0.1 COC/C(=N/O)/N MCULE-8214035702 [0,1,0,0,0,0|2,0,0]=3 910 B6R0.1 COCC(=N)OC MCULE-2350779439 [0,1,0,0,0,0|3,0,0]=4 911 B6R0.1 COCC(=N)OC MCULE-7810421458 [0,1,0,0,0,0|3,0,0]=4 912 B6R0.1 COCC(=O)CCl MCULE-7542636020 [0,1,0,0,0,0|1,0,0]=2 913 B6R0.1 COCC(=O)NN MCULE-4127487886 [0,1,0,0,0,0|2,0,0]=3 914 B6R0.1 COCC(=O)OC MCULE-8337685268 [0,1,0,0,0,0|2,0,0]=3 915 B6R0.1 COCC(C)CN MCULE-3223901774 [0,1,0,0,0,0|2,0,1]=4 916 B6R0.1 COCC(C)CO MCULE-7663064542 [0,1,0,0,0,0|1,0,1]=3 917 B6R0.1 COCC(F)CN MCULE-2821685967 [0,1,0,0,0,0|2,0,1]=4 918 B6R0.1 COCC(F)CN MCULE-9691951401 [0,1,0,0,0,0|2,0,1]=4 919 B6R0.1 COCC(N)CN MCULE-1244199319 [0,1,0,0,0,0|2,0,1]=4 920 B6R0.1 COCC(N)CO MCULE-2141613120 [0,1,0,0,0,0|1,0,1]=3 921 B6R0.1 COCC(N)CO MCULE-3194232042 [0,1,0,0,0,0|1,0,1]=3 922 B6R0.1 COCC(N)CO MCULE-6545937769 [0,1,0,0,0,0|1,0,1]=3 923 B6R0.1 COCC(N)CO MCULE-7989665777 [0,1,0,0,0,0|1,0,1]=3 924 B6R0.1 COCC(O)CBr MCULE-6900294714 [0,1,0,0,0,0|1,0,2]=4 925 B6R0.1 COCC(O)CCl MCULE-9314630227 [0,1,0,0,0,0|1,0,2]=4 926 B6R0.1 COCC(O)CF MCULE-1938415887 [0,1,0,0,0,0|1,0,2]=4 927 B6R0.1 COCC(O)CN MCULE-2044547388 [0,1,0,0,0,0|1,0,2]=4 928 B6R0.1 COCC(O)CN MCULE-2145726384 [0,1,0,0,0,0|1,0,2]=4 929 B6R0.1 COCC(O)CN MCULE-3637597204 [0,1,0,0,0,0|1,0,2]=4 930 B6R0.1 COCC(O)CO MCULE-1154104224 [0,1,0,0,0,0|0,0,2]=3 931 B6R0.1 COC[C@@H](N)CO MCULE-2792470078 [0,1,0,0,0,0|1,0,1]=3 932 B6R0.1 COC[C@@H](N)CO MCULE-3805343572 [0,1,0,0,0,0|1,0,1]=3 933 B6R0.1 COC[C@@H](N)CO MCULE-7953239910 [0,1,0,0,0,0|1,0,1]=3 934 B6R0.1 COC[C@@H](N)CO MCULE-9178553914 [0,1,0,0,0,0|1,0,1]=3 935 B6R0.1 COC[C@@H](O)CN MCULE-2116679841 [0,1,0,0,0,0|1,0,2]=4 936 B6R0.1 COC[C@@H](O)CN MCULE-4198842123 [0,1,0,0,0,0|1,0,2]=4 937 B6R0.1 COC[C@@H](O)CN MCULE-6330998296 [0,1,0,0,0,0|1,0,2]=4 938 B6R0.1 COC[C@H](C)CO MCULE-3120475252 [0,1,0,0,0,0|1,0,1]=3 939 B6R0.1 COC[C@H](F)CN MCULE-2663238018 [0,1,0,0,0,0|2,0,1]=4 940 B6R0.1 COC[C@H](N)CO MCULE-1678153673 [0,1,0,0,0,0|1,0,1]=3 941 B6R0.1 COC[C@H](N)CO MCULE-2304967280 [0,1,0,0,0,0|1,0,1]=3 942 B6R0.1 COC[C@H](N)CO MCULE-6509090198 [0,1,0,0,0,0|1,0,1]=3 943 B6R0.1 COC[C@H](N)CO MCULE-9806530206 [0,1,0,0,0,0|1,0,1]=3 944 B6R0.1 COC[C@H](O)CN MCULE-1962346446 [0,1,0,0,0,0|1,0,2]=4 945 B6R0.1 COC[C@H](O)CN MCULE-6290984425 [0,1,0,0,0,0|1,0,2]=4 946 B6R0.1 CONC(=O)OC MCULE-9304532248 [0,1,0,0,0,0|3,0,0]=4 947 B6R0.1 CSC/C(=N/O)/N MCULE-9599823795 [0,1,0,0,0,0|2,1,0]=4 948 B6R0.1 CSCC(=O)NN MCULE-8151954663 [0,1,0,0,0,0|2,1,0]=4 949 B6R0.1 CSCC(C)CO MCULE-3842820579 [0,1,0,0,0,0|1,1,1]=4 950 B6R0.1 CSCC(O)CO MCULE-6573013078 [0,1,0,0,0,0|0,1,2]=4 951 B6R0.1 C[C@@H](CO)CCN MCULE-4422620011 [0,1,0,0,0,0|2,0,1]=4 952 B6R0.1 C[C@@H](CO)CCN MCULE-7560169391 [0,1,0,0,0,0|2,0,1]=4 953 B6R0.1 C[C@@H](CO)CCO MCULE-6545491289 [0,1,0,0,0,0|1,0,1]=3 954 B6R0.1 C[C@H](CO)CCO MCULE-2543010074 [0,1,0,0,0,0|1,0,1]=3 955 B6R0.1 C[C@H](CO)CCO MCULE-6036462418 [0,1,0,0,0,0|1,0,1]=3 956 B6R0.1 N#CC/C(=N\O)/N MCULE-7517473784 [0,1,0,0,0,0|3,0,0]=4 957 B6R0.1 N#CCC(=O)NN MCULE-9203133961 [0,1,0,0,0,0|3,0,0]=4 958 B6R0.1 N/C(=N\O)/CCO MCULE-1794050637 [0,1,0,0,0,0|2,0,0]=3 959 B6R0.1 N=C(CCCl)NO MCULE-1713601074 [0,1,0,0,0,0|3,0,0]=4 960 B6R0.1 NC(CO)CCF MCULE-3691993352 [0,1,0,0,0,0|2,0,1]=4 961 B6R0.1 NC(CO)CCO MCULE-3703088648 [0,1,0,0,0,0|1,0,1]=3 962 B6R0.1 NC(CO)CCO MCULE-7609576462 [0,1,0,0,0,0|1,0,1]=3 963 B6R0.1 NCC(N)CCO MCULE-2965554481 [0,1,0,0,0,0|2,0,1]=4 964 B6R0.1 NCC/C(=N/O)/N MCULE-6349866821 [0,1,0,0,0,0|3,0,0]=4 965 B6R0.1 NCCC(=O)CN MCULE-3906468943 [0,1,0,0,0,0|2,0,0]=3 966 B6R0.1 NCCC(=O)CN MCULE-9593243702 [0,1,0,0,0,0|2,0,0]=3 967 B6R0.1 NCCC(O)CO MCULE-2556586168 [0,1,0,0,0,0|1,0,2]=4 968 B6R0.1 NNC(=O)CCO MCULE-6184351353 [0,1,0,0,0,0|2,0,0]=3 969 B6R0.1 NNC(=O)CCS MCULE-9322963076 [0,1,0,0,0,0|2,1,0]=4 970 B6R0.1 N[C@@H](CO)CCO MCULE-4583236919 [0,1,0,0,0,0|1,0,1]=3 971 B6R0.1 N[C@@H](CO)CCO MCULE-5489716742 [0,1,0,0,0,0|1,0,1]=3 972 B6R0.1 N[C@H](CO)CCO MCULE-5338659573 [0,1,0,0,0,0|1,0,1]=3 973 B6R0.1 N[C@H](CO)CCO MCULE-8998003003 [0,1,0,0,0,0|1,0,1]=3 974 B6R0.1 O=C(C=CCl)CCl MCULE-6121304267 [0,1,0,0,0,0|2,0,1]=4 975 B6R0.1 O=C(CCCl)NO MCULE-5569658108 [0,1,0,0,0,0|2,0,0]=3 976 B6R0.1 O=C(CCl)CCCl MCULE-6460902474 [0,1,0,0,0,0|2,0,0]=3 977 B6R0.1 O=C(CCl)NCO MCULE-9960585064 [0,1,0,0,0,0|1,0,0]=2 978 B6R0.1 O=C=NC(=O)CCl MCULE-8927897165 [0,1,0,0,0,0|1,0,2]=4 979 B6R0.1 OCCC(O)CCl MCULE-4752952606 [0,1,0,0,0,0|1,0,2]=4 980 B6R0.1 OCCC(O)CO MCULE-6470178852 [0,1,0,0,0,0|0,0,2]=3 981 B6R0.1 OCC[C@@H](Br)CO MCULE-4859199629 [0,1,0,0,0,0|1,0,1]=3 982 B6R0.1 OCC[C@@H](O)CO MCULE-2312093276 [0,1,0,0,0,0|0,0,2]=3 983 B6R0.1 OCC[C@@H](O)CO MCULE-4636748782 [0,1,0,0,0,0|0,0,2]=3 984 B6R0.1 OCC[C@H](O)CBr MCULE-1990035925 [0,1,0,0,0,0|1,0,2]=4 985 B6R0.1 OCC[C@H](O)CCl MCULE-4561806159 [0,1,0,0,0,0|1,0,2]=4 986 B6R0.1 OCC[C@H](O)CCl MCULE-8582759529 [0,1,0,0,0,0|1,0,2]=4 987 B6R0.1 OCC[C@H](O)CO MCULE-2265914374 [0,1,0,0,0,0|0,0,2]=3 988 B6R0.1 OCC[C@H](O)CO MCULE-5459838421 [0,1,0,0,0,0|0,0,2]=3 989 B6R0.1 ON=CC(=NO)Cl MCULE-8939091308 [0,1,0,0,0,0|2,0,1]=4 990 B6R0.3 C#CC(=O)C(C)C MCULE-9471281560 [0,1,0,0,0,0|2,0,1]=4 991 B6R0.3 C/C(=N/O)/C(F)F MCULE-3949329349 [0,1,0,0,0,0|3,0,0]=4 992 B6R0.3 C=C(CBr)C(=O)O MCULE-7257367588 [0,1,0,0,0,0|2,0,1]=4 993 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [0,1,0,0,0,0|2,0,1]=4 994 B6R0.3 C=C(CO)C(=O)O MCULE-9731648602 [0,1,0,0,0,0|1,0,1]=3 995 B6R0.3 C=CC(=O)C(=O)O MCULE-9816982424 [0,1,0,0,0,0|1,0,2]=4 996 B6R0.3 C=CC(=O)C(C)C MCULE-8577593172 [0,1,0,0,0,0|2,0,1]=4 997 B6R0.3 CC(=C(C)CO)C MCULE-2852322197 [0,1,0,0,0,0|2,0,1]=4 998 B6R0.3 CC(=C(F)CO)C MCULE-3552996593 [0,1,0,0,0,0|2,0,1]=4 999 B6R0.3 CC(=NO)C(=O)O MCULE-8264934008 [0,1,0,0,0,0|2,0,1]=4 1000 B6R0.3 CC(=NO)C(F)F MCULE-8246122811 [0,1,0,0,0,0|3,0,0]=4 1001 B6R0.3 CC(=O)C(=O)CBr MCULE-8560925164 [0,1,0,0,0,0|1,0,2]=4 1002 B6R0.3 CC(=O)C(=O)CCl MCULE-2778551811 [0,1,0,0,0,0|1,0,2]=4 1003 B6R0.3 CC(C)/C(=N/O)/Cl MCULE-8655360746 [0,1,0,0,0,0|3,0,0]=4 1004 B6R0.3 CC(C)/C(=N/O)/N MCULE-4474697690 [0,1,0,0,0,0|3,0,0]=4 1005 B6R0.3 CC(C)C(=N)NO MCULE-9934498877 [0,1,0,0,0,0|3,0,0]=4 1006 B6R0.3 CC(C)C(=O)CBr MCULE-5913227185 [0,1,0,0,0,0|2,0,0]=3 1007 B6R0.3 CC(C)C(=O)CCl MCULE-4093256141 [0,1,0,0,0,0|2,0,0]=3 1008 B6R0.3 CC(C)C(=O)CN MCULE-6091425997 [0,1,0,0,0,0|2,0,0]=3 1009 B6R0.3 CC(C)C(=O)CN MCULE-7368122425 [0,1,0,0,0,0|2,0,0]=3 1010 B6R0.3 CC(C)C(=O)CO MCULE-8746789873 [0,1,0,0,0,0|1,0,0]=2 1011 B6R0.3 CC(C)C(=O)NN MCULE-1262854337 [0,1,0,0,0,0|3,0,0]=4 1012 B6R0.3 CC(C)C(C)CO MCULE-7008552664 [0,1,0,0,0,0|2,0,1]=4 1013 B6R0.3 CC(C)C(N)CO MCULE-2361921763 [0,1,0,0,0,0|2,0,1]=4 1014 B6R0.3 CC(C)C(N)CO MCULE-2989454077 [0,1,0,0,0,0|2,0,1]=4 1015 B6R0.3 CC(C)C(N)CO MCULE-9793548365 [0,1,0,0,0,0|2,0,1]=4 1016 B6R0.3 CC(C)C(O)CO MCULE-6069815474 [0,1,0,0,0,0|1,0,2]=4 1017 B6R0.3 CC(C)C(S)CO MCULE-1903780493 [0,1,0,0,0,0|1,1,1]=4 1018 B6R0.3 CC(C)[C@@H](C)CO MCULE-4943691177 [0,1,0,0,0,0|2,0,1]=4 1019 B6R0.3 CC(C)[C@@H](C)CO MCULE-6583781047 [0,1,0,0,0,0|2,0,1]=4 1020 B6R0.3 CC(C)[C@@H](N)CO MCULE-1135743088 [0,1,0,0,0,0|2,0,1]=4 1021 B6R0.3 CC(C)[C@@H](N)CO MCULE-3994511291 [0,1,0,0,0,0|2,0,1]=4 1022 B6R0.3 CC(C)[C@H](C)CO MCULE-9527582465 [0,1,0,0,0,0|2,0,1]=4 1023 B6R0.3 CC(C)[C@H](N)CO MCULE-2625936994 [0,1,0,0,0,0|2,0,1]=4 1024 B6R0.3 CC(C)[C@H](N)CO MCULE-3229973889 [0,1,0,0,0,0|2,0,1]=4 1025 B6R0.3 CC(C)[C@H](N)CO MCULE-6090001117 [0,1,0,0,0,0|2,0,1]=4 1026 B6R0.3 CC(C)[C@H](N)CO MCULE-8284816696 [0,1,0,0,0,0|2,0,1]=4 1027 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [0,1,0,0,0,0|1,0,2]=4 1028 B6R0.3 CC(N)C(C)CO MCULE-8179225289 [0,1,0,0,0,0|2,0,1]=4 1029 B6R0.3 CC(N)C(O)CO MCULE-8191126136 [0,1,0,0,0,0|1,0,2]=4 1030 B6R0.3 CC(O)/C(=N/O)/N MCULE-6135321689 [0,1,0,0,0,0|2,0,0]=3 1031 B6R0.3 CC(O)C(=O)NN MCULE-4510079670 [0,1,0,0,0,0|2,0,0]=3 1032 B6R0.3 CC(O)C(C)CN MCULE-5251700993 [0,1,0,0,0,0|2,0,1]=4 1033 B6R0.3 CC(O)C(C)CO MCULE-4061946423 [0,1,0,0,0,0|1,0,1]=3 1034 B6R0.3 CC(O)C(N)CN MCULE-2787573482 [0,1,0,0,0,0|2,0,1]=4 1035 B6R0.3 CC(O)C(N)CN MCULE-5330950433 [0,1,0,0,0,0|2,0,1]=4 1036 B6R0.3 CC(O)C(N)CO MCULE-7733336449 [0,1,0,0,0,0|1,0,1]=3 1037 B6R0.3 CC(O)C(O)CN MCULE-6591390331 [0,1,0,0,0,0|1,0,2]=4 1038 B6R0.3 CC(O)C(O)CO MCULE-1795053551 [0,1,0,0,0,0|0,0,2]=3 1039 B6R0.3 CC(S)C(C)CO MCULE-5435813701 [0,1,0,0,0,0|1,1,1]=4 1040 B6R0.3 CCC(=O)C(=O)C MCULE-3065014067 [0,1,0,0,0,0|1,0,2]=4 1041 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [0,1,0,0,0,0|1,0,1]=3 1042 B6R0.3 CCC(=O)C(=O)[O-] MCULE-7571698792 [0,1,0,0,0,0|1,0,2]=4 1043 B6R0.3 CCC(=O)C(C)Br MCULE-2803556971 [0,1,0,0,0,0|2,0,0]=3 1044 B6R0.3 CCC(=O)C(C)C MCULE-9576230007 [0,1,0,0,0,0|2,0,0]=3 1045 B6R0.3 CCC(=O)C(C)Cl MCULE-8346980404 [0,1,0,0,0,0|2,0,0]=3 1046 B6R0.3 CCC(=O)C(C)N MCULE-5434634349 [0,1,0,0,0,0|2,0,0]=3 1047 B6R0.3 CCC(=O)C(C)N MCULE-8408562669 [0,1,0,0,0,0|2,0,0]=3 1048 B6R0.3 CCC(=O)C(C)O MCULE-4144791660 [0,1,0,0,0,0|1,0,0]=2 1049 B6R0.3 CCC(=O)C(C)S MCULE-3934356624 [0,1,0,0,0,0|1,1,0]=3 1050 B6R0.3 CCC(=O)C(F)F MCULE-3621750629 [0,1,0,0,0,0|2,0,0]=3 1051 B6R0.3 CCC(=O)N(C)C MCULE-1734001200 [0,1,0,0,0,0|3,0,0]=4 1052 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [0,1,0,0,0,0|2,0,1]=4 1053 B6R0.3 CCC(N)C(C)O MCULE-2752432664 [0,1,0,0,0,0|2,0,1]=4 1054 B6R0.3 CCC(N)C(C)O MCULE-6087590428 [0,1,0,0,0,0|2,0,1]=4 1055 B6R0.3 CCC(O)C(C)O MCULE-1468922095 [0,1,0,0,0,0|1,0,2]=4 1056 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-8294520512 [0,1,0,0,0,0|2,0,1]=4 1057 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-9521001934 [0,1,0,0,0,0|2,0,1]=4 1058 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-1930738992 [0,1,0,0,0,0|2,0,1]=4 1059 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-4226147180 [0,1,0,0,0,0|2,0,1]=4 1060 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-7445496718 [0,1,0,0,0,0|2,0,1]=4 1061 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-9770959398 [0,1,0,0,0,0|2,0,1]=4 1062 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-3878355824 [0,1,0,0,0,0|2,0,1]=4 1063 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-4791160457 [0,1,0,0,0,0|2,0,1]=4 1064 B6R0.3 CN(C)C(=O)CBr MCULE-8318415267 [0,1,0,0,0,0|3,0,0]=4 1065 B6R0.3 CN(C)C(=O)CCl MCULE-7153641042 [0,1,0,0,0,0|3,0,0]=4 1066 B6R0.3 CN(C)C(=O)CI MCULE-4437173749 [0,1,0,0,0,0|3,0,0]=4 1067 B6R0.3 CN(C)C(=O)CN MCULE-2195526798 [0,1,0,0,0,0|3,0,0]=4 1068 B6R0.3 CN(C)C(=O)CN MCULE-4999236521 [0,1,0,0,0,0|3,0,0]=4 1069 B6R0.3 CN(C)C(=O)CN MCULE-7091962350 [0,1,0,0,0,0|3,0,0]=4 1070 B6R0.3 CN(C)C(=O)CO MCULE-8470749078 [0,1,0,0,0,0|2,0,0]=3 1071 B6R0.3 CN(C)C(=O)CS MCULE-2815493030 [0,1,0,0,0,0|2,1,0]=4 1072 B6R0.3 CN(C)C(=O)NO MCULE-7406409363 [0,1,0,0,0,0|3,0,0]=4 1073 B6R0.3 CN(N)C(=O)NO MCULE-9258932516 [0,1,0,0,0,0|3,0,0]=4 1074 B6R0.3 CN(O)C(=O)CN MCULE-6904940710 [0,1,0,0,0,0|2,0,0]=3 1075 B6R0.3 CN(O)C(=O)CN MCULE-7352809793 [0,1,0,0,0,0|2,0,0]=3 1076 B6R0.3 CNC(=O)C(=O)O MCULE-5436132271 [0,1,0,0,0,0|2,0,1]=4 1077 B6R0.3 CNC(=O)C(C)Br MCULE-8111267694 [0,1,0,0,0,0|3,0,0]=4 1078 B6R0.3 CNC(=O)C(C)C MCULE-9646758802 [0,1,0,0,0,0|3,0,0]=4 1079 B6R0.3 CNC(=O)C(C)Cl MCULE-6524637023 [0,1,0,0,0,0|3,0,0]=4 1080 B6R0.3 CNC(=O)C(C)N MCULE-2283707986 [0,1,0,0,0,0|3,0,0]=4 1081 B6R0.3 CNC(=O)C(C)N MCULE-2976078375 [0,1,0,0,0,0|3,0,0]=4 1082 B6R0.3 CNC(=O)C(C)N MCULE-5544490576 [0,1,0,0,0,0|3,0,0]=4 1083 B6R0.3 CNC(=O)C(C)N MCULE-8815196909 [0,1,0,0,0,0|3,0,0]=4 1084 B6R0.3 CNC(=O)C(C)O MCULE-4714977257 [0,1,0,0,0,0|2,0,0]=3 1085 B6R0.3 CNC(=O)C(F)Br MCULE-5286609999 [0,1,0,0,0,0|3,0,0]=4 1086 B6R0.3 CNC(=O)C(F)Cl MCULE-4826706725 [0,1,0,0,0,0|3,0,0]=4 1087 B6R0.3 CNC(=O)C(F)I MCULE-3976975586 [0,1,0,0,0,0|3,0,0]=4 1088 B6R0.3 CNC(=O)[C@@H](C)N MCULE-4498032248 [0,1,0,0,0,0|3,0,0]=4 1089 B6R0.3 CNC(=O)[C@@H](C)N MCULE-6909082129 [0,1,0,0,0,0|3,0,0]=4 1090 B6R0.3 CNC(=O)[C@@H](C)N MCULE-7642558844 [0,1,0,0,0,0|3,0,0]=4 1091 B6R0.3 CNC(=O)[C@@H](C)N MCULE-8543898121 [0,1,0,0,0,0|3,0,0]=4 1092 B6R0.3 CNC(=O)[C@@H](C)O MCULE-8955033466 [0,1,0,0,0,0|2,0,0]=3 1093 B6R0.3 CNC(=O)[C@H](C)N MCULE-5297375743 [0,1,0,0,0,0|3,0,0]=4 1094 B6R0.3 CNC(=O)[C@H](C)N MCULE-6807150828 [0,1,0,0,0,0|3,0,0]=4 1095 B6R0.3 CNC(=O)[C@H](C)N MCULE-8365508630 [0,1,0,0,0,0|3,0,0]=4 1096 B6R0.3 CNC(=O)[C@H](C)N MCULE-9773818316 [0,1,0,0,0,0|3,0,0]=4 1097 B6R0.3 CNC(=O)[C@H](C)O MCULE-8015727044 [0,1,0,0,0,0|2,0,0]=3 1098 B6R0.3 COC(=O)C(=O)O MCULE-8527842270 [0,1,0,0,0,0|2,0,1]=4 1099 B6R0.3 COC(=O)C(Br)Br MCULE-7917032365 [0,1,0,0,0,0|3,0,0]=4 1100 B6R0.3 COC(=O)C(C)Br MCULE-8218697195 [0,1,0,0,0,0|3,0,0]=4 1101 B6R0.3 COC(=O)C(C)C MCULE-8740211817 [0,1,0,0,0,0|3,0,0]=4 1102 B6R0.3 COC(=O)C(C)Cl MCULE-5874523100 [0,1,0,0,0,0|3,0,0]=4 1103 B6R0.3 COC(=O)C(C)Cl MCULE-7725109837 [0,1,0,0,0,0|3,0,0]=4 1104 B6R0.3 COC(=O)C(C)F MCULE-2381396302 [0,1,0,0,0,0|3,0,0]=4 1105 B6R0.3 COC(=O)C(C)N MCULE-6823731158 [0,1,0,0,0,0|3,0,0]=4 1106 B6R0.3 COC(=O)C(C)N MCULE-7003387212 [0,1,0,0,0,0|3,0,0]=4 1107 B6R0.3 COC(=O)C(C)N MCULE-8331503444 [0,1,0,0,0,0|3,0,0]=4 1108 B6R0.3 COC(=O)C(C)N MCULE-8860467123 [0,1,0,0,0,0|3,0,0]=4 1109 B6R0.3 COC(=O)C(C)O MCULE-7040827393 [0,1,0,0,0,0|2,0,0]=3 1110 B6R0.3 COC(=O)C(C)O MCULE-7872489483 [0,1,0,0,0,0|2,0,0]=3 1111 B6R0.3 COC(=O)C(C)S MCULE-8499044680 [0,1,0,0,0,0|2,1,0]=4 1112 B6R0.3 COC(=O)C(Cl)Cl MCULE-4062853805 [0,1,0,0,0,0|3,0,0]=4 1113 B6R0.3 COC(=O)C(F)F MCULE-9701476276 [0,1,0,0,0,0|3,0,0]=4 1114 B6R0.3 COC(=O)[C@@H](C)Br MCULE-8118895575 [0,1,0,0,0,0|3,0,0]=4 1115 B6R0.3 COC(=O)[C@@H](C)Cl MCULE-1037727130 [0,1,0,0,0,0|3,0,0]=4 1116 B6R0.3 COC(=O)[C@@H](C)F MCULE-4776326501 [0,1,0,0,0,0|3,0,0]=4 1117 B6R0.3 COC(=O)[C@@H](C)F MCULE-8049982812 [0,1,0,0,0,0|3,0,0]=4 1118 B6R0.3 COC(=O)[C@@H](C)N MCULE-6142127864 [0,1,0,0,0,0|3,0,0]=4 1119 B6R0.3 COC(=O)[C@@H](C)N MCULE-6606835410 [0,1,0,0,0,0|3,0,0]=4 1120 B6R0.3 COC(=O)[C@@H](C)N MCULE-7979979694 [0,1,0,0,0,0|3,0,0]=4 1121 B6R0.3 COC(=O)[C@@H](C)N MCULE-9290287586 [0,1,0,0,0,0|3,0,0]=4 1122 B6R0.3 COC(=O)[C@@H](C)O MCULE-5441095431 [0,1,0,0,0,0|2,0,0]=3 1123 B6R0.3 COC(=O)[C@@H](C)O MCULE-6924152779 [0,1,0,0,0,0|2,0,0]=3 1124 B6R0.3 COC(=O)[C@H](C)Cl MCULE-1009662992 [0,1,0,0,0,0|3,0,0]=4 1125 B6R0.3 COC(=O)[C@H](C)Cl MCULE-7624485295 [0,1,0,0,0,0|3,0,0]=4 1126 B6R0.3 COC(=O)[C@H](C)N MCULE-1665306037 [0,1,0,0,0,0|3,0,0]=4 1127 B6R0.3 COC(=O)[C@H](C)N MCULE-2941352505 [0,1,0,0,0,0|3,0,0]=4 1128 B6R0.3 COC(=O)[C@H](C)N MCULE-5314047552 [0,1,0,0,0,0|3,0,0]=4 1129 B6R0.3 COC(=O)[C@H](C)N MCULE-7930428859 [0,1,0,0,0,0|3,0,0]=4 1130 B6R0.3 COC(=O)[C@H](C)O MCULE-2590929895 [0,1,0,0,0,0|2,0,0]=3 1131 B6R0.3 COC(=O)[C@H](C)O MCULE-3292709954 [0,1,0,0,0,0|2,0,0]=3 1132 B6R0.3 CSC(=O)C(C)C MCULE-3533547228 [0,1,0,0,0,0|3,0,0]=4 1133 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [0,1,0,0,0,0|1,0,2]=4 1134 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [0,1,0,0,0,0|1,0,2]=4 1135 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-1499224916 [0,1,0,0,0,0|1,0,1]=3 1136 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-3539522955 [0,1,0,0,0,0|1,0,1]=3 1137 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-1381786707 [0,1,0,0,0,0|1,0,1]=3 1138 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-3627537672 [0,1,0,0,0,0|1,0,1]=3 1139 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-5429038645 [0,1,0,0,0,0|1,0,1]=3 1140 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-6146168744 [0,1,0,0,0,0|1,0,1]=3 1141 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [0,1,0,0,0,0|1,0,2]=4 1142 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [0,1,0,0,0,0|1,0,2]=4 1143 B6R0.3 C[C@H](N)C(=O)CCl MCULE-1387458909 [0,1,0,0,0,0|2,0,0]=3 1144 B6R0.3 C[C@H](N)C(=O)CCl MCULE-3307546885 [0,1,0,0,0,0|2,0,0]=3 1145 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-5329315346 [0,1,0,0,0,0|1,0,1]=3 1146 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7239426628 [0,1,0,0,0,0|1,0,1]=3 1147 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7437797788 [0,1,0,0,0,0|1,0,1]=3 1148 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-2378004602 [0,1,0,0,0,0|1,0,1]=3 1149 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-9436764758 [0,1,0,0,0,0|1,0,1]=3 1150 B6R0.3 N/C(=N\O)/C(Cl)Cl MCULE-7826685582 [0,1,0,0,0,0|3,0,0]=4 1151 B6R0.3 N/C(=N\O)/C(F)F MCULE-3144106869 [0,1,0,0,0,0|3,0,0]=4 1152 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [0,1,0,0,0,0|1,0,2]=4 1153 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [0,1,0,0,0,0|1,0,2]=4 1154 B6R0.3 NNC(=O)C(F)F MCULE-4217828449 [0,1,0,0,0,0|3,0,0]=4 1155 B6R0.3 NNC(=O)C(F)F MCULE-5359326999 [0,1,0,0,0,0|3,0,0]=4 1156 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [0,1,0,0,0,0|1,0,2]=4 1157 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [0,1,0,0,0,0|1,0,2]=4 1158 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [0,1,0,0,0,0|1,0,2]=4 1159 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [0,1,0,0,0,0|1,0,2]=4 1160 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [0,1,0,0,0,0|1,0,2]=4 1161 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [0,1,0,0,0,0|1,0,2]=4 1162 B6R0.3 O=C(CBr)C(Br)Br MCULE-6224408372 [0,1,0,0,0,0|2,0,0]=3 1163 B6R0.3 O=C(CBr)C(F)F MCULE-3084968547 [0,1,0,0,0,0|2,0,0]=3 1164 B6R0.3 O=C(CCl)C(Cl)Cl MCULE-7821845366 [0,1,0,0,0,0|2,0,0]=3 1165 B6R0.3 O=C(Cl)C(=O)CBr MCULE-1637788630 [0,1,0,0,0,0|1,0,2]=4 1166 B6R0.3 O=C(O)C(=O)CBr MCULE-4768170572 [0,1,0,0,0,0|1,0,1]=3 1167 B6R0.3 O=C(O)C(=O)CCl MCULE-7853426045 [0,1,0,0,0,0|1,0,1]=3 1168 B6R0.3 O=C(O)C(=O)CF MCULE-5884987827 [0,1,0,0,0,0|1,0,1]=3 1169 B6R0.3 O=C(O)C(=O)CO MCULE-2263002631 [0,1,0,0,0,0|0,0,1]=2 1170 B6R0.3 O=C(O)C(=O)CS MCULE-7466669113 [0,1,0,0,0,0|0,1,1]=3 1171 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [0,1,0,0,0,0|1,0,2]=4 1172 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [0,1,0,0,0,0|1,0,2]=4 1173 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [0,1,0,0,0,0|0,0,3]=4 1174 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [0,1,0,0,0,0|1,0,2]=4 1175 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [0,1,0,0,0,0|1,0,2]=4 1176 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [0,1,0,0,0,0|0,0,3]=4 1177 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [0,1,0,0,0,0|0,0,3]=4 1178 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [0,1,0,0,0,0|1,0,2]=4 1179 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [0,1,0,0,0,0|1,0,2]=4 1180 B6R0.3 O=C([O-])C(=O)CF MCULE-9109967389 [0,1,0,0,0,0|1,0,2]=4 1181 B6R0.3 O=C([O-])C(=O)CS MCULE-4375165973 [0,1,0,0,0,0|0,1,2]=4 1182 B6R0.3 OCC(=C(F)F)F MCULE-9266336086 [0,1,0,0,0,0|2,0,1]=4 1183 B6R0.3 OC[C@@H](O)C(F)F MCULE-5042610356 [0,1,0,0,0,0|1,0,2]=4 1184 B6R0.3 OC[C@@H](O)C(F)F MCULE-8643910063 [0,1,0,0,0,0|1,0,2]=4 1185 B6R0.3 [C@H](C)(Cl)C(=O)OC MCULE-7212330759 [0,1,0,0,0,0|3,0,0]=4 1186 B6R0.8 CC(C)(CN)CO MCULE-5342400231 [0,1,0,0,0,0|2,0,1]=4 1187 B6R0.8 CC(C)(CO)CBr MCULE-5392401561 [0,1,0,0,0,0|2,0,1]=4 1188 B6R0.8 CC(C)(CO)CCl MCULE-4674403441 [0,1,0,0,0,0|2,0,1]=4 1189 B6R0.8 CC(C)(CO)CF MCULE-4462488929 [0,1,0,0,0,0|2,0,1]=4 1190 B6R0.8 CC(C)(CO)CO MCULE-3663555151 [0,1,0,0,0,0|1,0,1]=3 1191 B6R0.8 CC(C)(CO)CS MCULE-2478254611 [0,1,0,0,0,0|1,1,1]=4 1192 B6R0.8 CC(F)(CO)CO MCULE-6086305692 [0,1,0,0,0,0|1,0,1]=3 1193 B6R0.8 CC(N)(CO)CO MCULE-6546409175 [0,1,0,0,0,0|1,0,1]=3 1194 B6R0.8 CC(O)(CN)CO MCULE-2184919268 [0,1,0,0,0,0|1,0,2]=4 1195 B6R0.8 CC(O)(CO)CO MCULE-5281000424 [0,1,0,0,0,0|0,0,2]=3 1196 B6R0.8 CCC(C)(C)CO MCULE-9731698451 [0,1,0,0,0,0|2,0,1]=4 1197 B6R0.8 CCC(C)(N)CO MCULE-3364837123 [0,1,0,0,0,0|2,0,1]=4 1198 B6R0.8 CCC(C)(N)CO MCULE-6671299764 [0,1,0,0,0,0|2,0,1]=4 1199 B6R0.8 CCC(C)(O)CO MCULE-7272709587 [0,1,0,0,0,0|1,0,2]=4 1200 B6R0.8 CCC(F)(F)CO MCULE-9442155245 [0,1,0,0,0,0|2,0,1]=4 1201 B6R0.8 CCP(=O)(O)CC MCULE-3198153356 [0,1,0,0,0,0|3,0,0]=4 1202 B6R0.8 CCS(=N)(=O)CC MCULE-1377380719 [0,1,0,0,0,0|3,0,0]=4 1203 B6R0.8 CCS(=O)(=O)CBr MCULE-9846834894 [0,1,0,0,0,0|3,0,0]=4 1204 B6R0.8 CCS(=O)(=O)CC MCULE-5339813362 [0,1,0,0,0,0|3,0,0]=4 1205 B6R0.8 CCS(=O)(=O)CCl MCULE-8191946420 [0,1,0,0,0,0|3,0,0]=4 1206 B6R0.8 CP(=O)(CI)CI MCULE-3359227380 [0,1,0,0,0,0|3,0,0]=4 1207 B6R0.8 C[C@](O)(CO)CBr MCULE-3211170790 [0,1,0,0,0,0|1,0,2]=4 1208 B6R0.8 NCC(F)(F)CO MCULE-1734067533 [0,1,0,0,0,0|2,0,1]=4 1209 B6R0.8 NCC(F)(F)CO MCULE-6456961834 [0,1,0,0,0,0|2,0,1]=4 1210 B6R0.8 O=P(O)(CBr)CBr MCULE-3993361339 [0,1,0,0,0,0|3,0,0]=4 1211 B6R0.8 O=P(O)(CCl)CCl MCULE-6792915019 [0,1,0,0,0,0|3,0,0]=4 1212 B6R0.8 O=P(O)(CI)CI MCULE-1563566081 [0,1,0,0,0,0|3,0,0]=4 1213 B6R0.8 O=S(=O)(CCl)CCl MCULE-7527200581 [0,1,0,0,0,0|3,0,0]=4 1214 B6R0.8 OCC(F)(F)CO MCULE-8504062479 [0,1,0,0,0,0|1,0,1]=3 1215 B6R0.9 C/C=C(/C=O)\CC MCULE-4811305564 [0,1,0,0,0,0|2,0,1]=4 1216 B6R0.9 C/N=C(/CO)\NC MCULE-6025664069 [0,1,0,0,0,0|3,0,0]=4 1217 B6R0.9 CC=C(C=O)CC MCULE-3354209980 [0,1,0,0,0,0|2,0,1]=4 1218 B6R0.9 CC=C(CC)CC MCULE-5609717261 [0,1,0,0,0,0|3,0,0]=4 1219 B6R0.9 CCC(=CO)CC MCULE-4973169590 [0,1,0,0,0,0|2,0,1]=4 1220 B6R0.9 CCC(=CO)CC MCULE-8459100577 [0,1,0,0,0,0|2,0,1]=4 1221 B6R0.9 CCC(C=O)CC MCULE-3529464122 [0,1,0,0,0,0|2,0,1]=4 1222 B6R0.9 CCC(CC)CO MCULE-8799293985 [0,1,0,0,0,0|2,0,1]=4 1223 B6R0.9 CCC(CN)CO MCULE-5933181303 [0,1,0,0,0,0|2,0,1]=4 1224 B6R0.9 CCC(CO)CO MCULE-5204077076 [0,1,0,0,0,0|1,0,1]=3 1225 B6R0.9 CCC(CO)NC MCULE-4151180539 [0,1,0,0,0,0|2,0,1]=4 1226 B6R0.9 CCC(CO)OC MCULE-3822452142 [0,1,0,0,0,0|1,0,2]=4 1227 B6R0.9 CCN(C=O)CC MCULE-9053231156 [0,1,0,0,0,0|3,0,0]=4 1228 B6R0.9 CCN(CC)CO MCULE-9782453115 [0,1,0,0,0,0|3,0,0]=4 1229 B6R0.9 CCN(CC)N=O MCULE-8931177297 [0,1,0,0,0,0|3,0,0]=4 1230 B6R0.9 CC[C@@H](CO)NC MCULE-6281808613 [0,1,0,0,0,0|2,0,1]=4 1231 B6R0.9 CNC(CN)CO MCULE-7006149115 [0,1,0,0,0,0|2,0,1]=4 1232 B6R0.9 CNC(CO)CO MCULE-9323859576 [0,1,0,0,0,0|1,0,1]=3 1233 B6R0.9 COC(CN)CO MCULE-2486586573 [0,1,0,0,0,0|1,0,2]=4 1234 B6R0.9 COC(CN)CO MCULE-3908535917 [0,1,0,0,0,0|1,0,2]=4 1235 B6R0.9 COC(CO)CBr MCULE-4957036064 [0,1,0,0,0,0|1,0,2]=4 1236 B6R0.9 COC(CO)CO MCULE-4778743592 [0,1,0,0,0,0|0,0,2]=3 1237 B6R0.9 CO[C@H](CN)CO MCULE-6065862053 [0,1,0,0,0,0|1,0,2]=4 1238 B6R0.9 OCC(=NO)CO MCULE-1131100831 [0,1,0,0,0,0|0,0,1]=2 1239 B6R0.9 OCC(CBr)CBr MCULE-4153091765 [0,1,0,0,0,0|2,0,1]=4 1240 B6R0.9 OCC(CO)CO MCULE-7640074192 [0,1,0,0,0,0|0,0,2]=3 1241 B6R0.9 OCP(CO)CO MCULE-9792692156 [0,1,0,0,0,0|1,0,1]=3 1242 B6R1.2 BrC1=COCC1 MCULE-8057569313 [0,0,0,1,0,0|2,0,1]=4 1243 B6R1.2 BrC1CCOC1 MCULE-7037144528 [0,0,0,1,0,0|2,0,1]=4 1244 B6R1.2 Br[C@H]1CCOC1 MCULE-7554969036 [0,0,0,1,0,0|2,0,1]=4 1245 B6R1.2 C1(CCOC1)I MCULE-4877322062 [0,0,0,1,0,0|2,0,1]=4 1246 B6R1.2 C1(CCOC1)N MCULE-2221007915 [0,0,0,1,0,0|2,0,1]=4 1247 B6R1.2 C1(CCOC1)N MCULE-3972931474 [0,0,0,1,0,0|2,0,1]=4 1248 B6R1.2 C1(CCOC1)O MCULE-3631749536 [0,0,0,1,0,0|1,0,2]=4 1249 B6R1.2 C=C1CCCC1 MCULE-4115373196 [0,0,0,1,0,0|3,0,0]=4 1250 B6R1.2 C=C1CCNC1 MCULE-7982953073 [0,0,0,1,0,0|3,0,0]=4 1251 B6R1.2 C=C1CCNC1 MCULE-8428731599 [0,0,0,1,0,0|3,0,0]=4 1252 B6R1.2 C=C1CCSC1 MCULE-7042571473 [0,0,0,1,0,0|2,1,0]=4 1253 B6R1.2 CC1CCOC1 MCULE-6424683416 [0,0,0,1,0,0|2,0,1]=4 1254 B6R1.2 CC1CNOC1 MCULE-1071803164 [0,0,0,1,0,0|2,0,1]=4 1255 B6R1.2 CC1CNOC1 MCULE-9455391174 [0,0,0,1,0,0|2,0,1]=4 1256 B6R1.2 CN1CCOC1 MCULE-5504672404 [0,0,0,1,0,0|3,0,0]=4 1257 B6R1.2 ClC1CCOC1 MCULE-6903762147 [0,0,0,1,0,0|2,0,1]=4 1258 B6R1.2 FC1CNOC1 MCULE-4837734523 [0,0,0,1,0,0|2,0,1]=4 1259 B6R1.2 FC1CNOC1 MCULE-6176254900 [0,0,0,1,0,0|2,0,1]=4 1260 B6R1.2 IC1=COCC1 MCULE-3076361502 [0,0,0,1,0,0|2,0,1]=4 1261 B6R1.2 IC1CCOC1 MCULE-1379775972 [0,0,0,1,0,0|2,0,1]=4 1262 B6R1.2 I[C@@H]1CCOC1 MCULE-2036157502 [0,0,0,1,0,0|2,0,1]=4 1263 B6R1.2 I[C@@H]1CCOC1 MCULE-4800752659 [0,0,0,1,0,0|2,0,1]=4 1264 B6R1.2 I[C@H]1CCOC1 MCULE-4242860607 [0,0,0,1,0,0|2,0,1]=4 1265 B6R1.2 I[C@H]1CCOC1 MCULE-7095404975 [0,0,0,1,0,0|2,0,1]=4 1266 B6R1.2 NC1=NOCC1 MCULE-4971355735 [0,0,0,1,0,0|3,0,0]=4 1267 B6R1.2 NC1CCOC1 MCULE-1276945018 [0,0,0,1,0,0|2,0,1]=4 1268 B6R1.2 NC1CCOC1 MCULE-8146259495 [0,0,0,1,0,0|2,0,1]=4 1269 B6R1.2 N[C@@H]1CCOC1 MCULE-1100136080 [0,0,0,1,0,0|2,0,1]=4 1270 B6R1.2 N[C@@H]1CCOC1 MCULE-4493278911 [0,0,0,1,0,0|2,0,1]=4 1271 B6R1.2 N[C@@H]1CCOC1 MCULE-5574536510 [0,0,0,1,0,0|2,0,1]=4 1272 B6R1.2 N[C@@H]1CCOC1 MCULE-7204677203 [0,0,0,1,0,0|2,0,1]=4 1273 B6R1.2 N[C@H]1CCOC1 MCULE-2273771439 [0,0,0,1,0,0|2,0,1]=4 1274 B6R1.2 N[C@H]1CCOC1 MCULE-3567904137 [0,0,0,1,0,0|2,0,1]=4 1275 B6R1.2 N[C@H]1CCOC1 MCULE-5268616156 [0,0,0,1,0,0|2,0,1]=4 1276 B6R1.2 N[C@H]1CCOC1 MCULE-7351975857 [0,0,0,1,0,0|2,0,1]=4 1277 B6R1.2 O=C1C=CCC1 MCULE-1844779047 [0,0,0,1,0,0|2,0,1]=4 1278 B6R1.2 O=C1C=CSC1 MCULE-6580304664 [0,0,0,1,0,0|1,1,1]=4 1279 B6R1.2 O=C1CC=CC1 MCULE-7606670114 [0,0,0,1,0,0|2,0,0]=3 1280 B6R1.2 O=C1CC=NN1 MCULE-1672455504 [0,0,0,1,0,0|3,0,0]=4 1281 B6R1.2 O=C1CCCC1 MCULE-9455227735 [0,0,0,1,0,0|2,0,0]=3 1282 B6R1.2 O=C1CCCN1 MCULE-3061780794 [0,0,0,1,0,0|3,0,0]=4 1283 B6R1.2 O=C1CCCO1 MCULE-6795890265 [0,0,0,1,0,0|3,0,0]=4 1284 B6R1.2 O=C1CCCS1 MCULE-5361654550 [0,0,0,1,0,0|3,0,0]=4 1285 B6R1.2 O=C1CCNC1 MCULE-2947789259 [0,0,0,1,0,0|2,0,0]=3 1286 B6R1.2 O=C1CCNC1 MCULE-7192595052 [0,0,0,1,0,0|2,0,0]=3 1287 B6R1.2 O=C1CCNN1 MCULE-7030953666 [0,0,0,1,0,0|3,0,0]=4 1288 B6R1.2 O=C1CCOC1 MCULE-2031733910 [0,0,0,1,0,0|1,0,0]=2 1289 B6R1.2 O=C1CCON1 MCULE-6799359324 [0,0,0,1,0,0|2,0,0]=3 1290 B6R1.2 O=C1CCSC1 MCULE-2059655624 [0,0,0,1,0,0|1,1,0]=3 1291 B6R1.2 O=C1CC[NH2+]N1 MCULE-5327505055 [0,0,0,1,0,0|3,0,0]=4 1292 B6R1.2 O=C1CNCN1 MCULE-2645891847 [0,0,0,1,0,0|3,0,0]=4 1293 B6R1.2 O=C1CNCN1 MCULE-9269137129 [0,0,0,1,0,0|3,0,0]=4 1294 B6R1.2 O=C1CSCN1 MCULE-3946660854 [0,0,0,1,0,0|2,1,0]=4 1295 B6R1.2 O=S1CCCC1 MCULE-2442126780 [0,0,0,1,0,0|3,0,0]=4 1296 B6R1.2 OC1CCOC1 MCULE-4469581028 [0,0,0,1,0,0|1,0,2]=4 1297 B6R1.2 OC1CNOC1 MCULE-3414700581 [0,0,0,1,0,0|1,0,2]=4 1298 B6R1.2 OC1CNOC1 MCULE-8163403090 [0,0,0,1,0,0|1,0,2]=4 1299 B6R1.2 OC1CNOC1 MCULE-8644852072 [0,0,0,1,0,0|1,0,2]=4 1300 B6R1.2 OC1C[NH2+]OC1 MCULE-7865131527 [0,0,0,1,0,0|1,0,2]=4 1301 B6R1.2 O[C@@H]1CCOC1 MCULE-7739141732 [0,0,0,1,0,0|1,0,2]=4 1302 B6R1.2 O[C@@H]1CCOC1 MCULE-8344812226 [0,0,0,1,0,0|1,0,2]=4 1303 B6R1.2 O[C@@H]1CCOC1 MCULE-9098074990 [0,0,0,1,0,0|1,0,2]=4 1304 B6R1.2 O[C@@H]1CNOC1 MCULE-1481945185 [0,0,0,1,0,0|1,0,2]=4 1305 B6R1.2 O[C@@H]1CNOC1 MCULE-4156521353 [0,0,0,1,0,0|1,0,2]=4 1306 B6R1.2 O[C@@H]1CNOC1 MCULE-5692816168 [0,0,0,1,0,0|1,0,2]=4 1307 B6R1.2 O[C@@H]1CNOC1 MCULE-6838604903 [0,0,0,1,0,0|1,0,2]=4 1308 B6R1.2 O[C@H]1CCOC1 MCULE-8518846297 [0,0,0,1,0,0|1,0,2]=4 1309 B6R1.2 O[C@H]1CCOC1 MCULE-9544747995 [0,0,0,1,0,0|1,0,2]=4 1310 B6R1.2 O[C@H]1CNOC1 MCULE-1746817114 [0,0,0,1,0,0|1,0,2]=4 1311 B6R1.2 O[C@H]1CNOC1 MCULE-4469396812 [0,0,0,1,0,0|1,0,2]=4 1312 B6R1.2 O[C@H]1CNOC1 MCULE-7167785164 [0,0,0,1,0,0|1,0,2]=4 1313 B6R1.2 O[C@H]1CNOC1 MCULE-8409877332 [0,0,0,1,0,0|1,0,2]=4 1314 B6R1.2 SC1CCOC1 MCULE-9247906418 [0,0,0,1,0,0|1,1,1]=4 1315 B6R1.4 CC1CCC1=O MCULE-4548181715 [0,0,0,1,0,0|2,0,0]=3 1316 B6R1.4 CC1CCC1O MCULE-3852133104 [0,0,0,1,0,0|2,0,1]=4 1317 B6R1.4 CC1CNC1=O MCULE-5523309752 [0,0,0,1,0,0|3,0,0]=4 1318 B6R1.4 CC1COC1=O MCULE-9711165188 [0,0,0,1,0,0|3,0,0]=4 1319 B6R1.4 CC1OCC1=O MCULE-7718609686 [0,0,0,1,0,0|1,0,0]=2 1320 B6R1.4 CC1OCC1O MCULE-1893283492 [0,0,0,1,0,0|1,0,2]=4 1321 B6R1.4 NC1CCC1=O MCULE-3868209809 [0,0,0,1,0,0|2,0,0]=3 1322 B6R1.4 NC1CCC1=O MCULE-9741389143 [0,0,0,1,0,0|2,0,0]=3 1323 B6R1.4 NC1CCC1O MCULE-4636397534 [0,0,0,1,0,0|2,0,1]=4 1324 B6R1.4 NC1CCC1O MCULE-7148132261 [0,0,0,1,0,0|2,0,1]=4 1325 B6R1.4 NC1CNC1=O MCULE-2761616663 [0,0,0,1,0,0|3,0,0]=4 1326 B6R1.4 NC1CNC1=O MCULE-3021306383 [0,0,0,1,0,0|3,0,0]=4 1327 B6R1.4 NC1CNC1=O MCULE-3943057121 [0,0,0,1,0,0|3,0,0]=4 1328 B6R1.4 NC1COC1=O MCULE-6998565452 [0,0,0,1,0,0|3,0,0]=4 1329 B6R1.4 NN1CCC1=O MCULE-6200802911 [0,0,0,1,0,0|3,0,0]=4 1330 B6R1.4 NN1CCC1=O MCULE-8249778821 [0,0,0,1,0,0|3,0,0]=4 1331 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-1054283097 [0,0,0,1,0,0|2,0,1]=4 1332 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-3905992171 [0,0,0,1,0,0|2,0,1]=4 1333 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-6111990015 [0,0,0,1,0,0|2,0,1]=4 1334 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-9101755956 [0,0,0,1,0,0|2,0,1]=4 1335 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-1883601377 [0,0,0,1,0,0|2,0,1]=4 1336 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-6045787726 [0,0,0,1,0,0|2,0,1]=4 1337 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-7120290402 [0,0,0,1,0,0|2,0,1]=4 1338 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-8603369729 [0,0,0,1,0,0|2,0,1]=4 1339 B6R1.4 N[C@@H]1CNC1=O MCULE-3645662662 [0,0,0,1,0,0|3,0,0]=4 1340 B6R1.4 N[C@@H]1CNC1=O MCULE-4399212271 [0,0,0,1,0,0|3,0,0]=4 1341 B6R1.4 N[C@@H]1CNC1=O MCULE-6332076219 [0,0,0,1,0,0|3,0,0]=4 1342 B6R1.4 N[C@@H]1CNC1=O MCULE-6365012530 [0,0,0,1,0,0|3,0,0]=4 1343 B6R1.4 N[C@@H]1COC1=O MCULE-8080548213 [0,0,0,1,0,0|3,0,0]=4 1344 B6R1.4 N[C@@H]1COC1=O MCULE-9370092691 [0,0,0,1,0,0|3,0,0]=4 1345 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-1761694918 [0,0,0,1,0,0|2,0,1]=4 1346 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-2828590958 [0,0,0,1,0,0|2,0,1]=4 1347 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-3261752057 [0,0,0,1,0,0|2,0,1]=4 1348 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-7711512049 [0,0,0,1,0,0|2,0,1]=4 1349 B6R1.4 N[C@H]1CC[C@H]1O MCULE-3204268809 [0,0,0,1,0,0|2,0,1]=4 1350 B6R1.4 N[C@H]1CC[C@H]1O MCULE-4184135738 [0,0,0,1,0,0|2,0,1]=4 1351 B6R1.4 N[C@H]1CNC1=O MCULE-2792436534 [0,0,0,1,0,0|3,0,0]=4 1352 B6R1.4 N[C@H]1CNC1=O MCULE-6881316562 [0,0,0,1,0,0|3,0,0]=4 1353 B6R1.4 N[C@H]1CNC1=O MCULE-8864053661 [0,0,0,1,0,0|3,0,0]=4 1354 B6R1.4 N[C@H]1CNC1=O MCULE-9014449253 [0,0,0,1,0,0|3,0,0]=4 1355 B6R1.4 N[C@H]1COC1=O MCULE-4812631526 [0,0,0,1,0,0|3,0,0]=4 1356 B6R1.4 O=C1CCC1Br MCULE-1088592133 [0,0,0,1,0,0|2,0,0]=3 1357 B6R1.4 O=C1CCC1F MCULE-6197375881 [0,0,0,1,0,0|2,0,0]=3 1358 B6R1.4 O=C1CCC1O MCULE-1248327203 [0,0,0,1,0,0|1,0,0]=2 1359 B6R1.4 O=C1CC[C@@H]1Br MCULE-3455449754 [0,0,0,1,0,0|2,0,0]=3 1360 B6R1.4 OC1CCC1O MCULE-3286787157 [0,0,0,1,0,0|1,0,2]=4 1361 B6R1.4 O[C@@H]1CC[C@H]1O MCULE-5060593050 [0,0,0,1,0,0|1,0,2]=4 1362 B6R1.4 O[C@@H]1CC[C@H]1O MCULE-6357622033 [0,0,0,1,0,0|1,0,2]=4 1363 B6R1.4 O[C@H]1CC[C@H]1O MCULE-7964152901 [0,0,0,1,0,0|1,0,2]=4 1364 B6R1.4 [C@@H]1(COC1=O)N MCULE-7456320845 [0,0,0,1,0,0|3,0,0]=4 1365 B6R1.6 BrCC1COC1 MCULE-3267235863 [0,0,0,1,0,0|2,0,1]=4 1366 B6R1.6 C1(CCN1)CO MCULE-6309114010 [0,0,0,1,0,0|2,0,1]=4 1367 B6R1.6 ClCC1COC1 MCULE-1144637548 [0,0,0,1,0,0|2,0,1]=4 1368 B6R1.6 ICC1COC1 MCULE-6325029437 [0,0,0,1,0,0|2,0,1]=4 1369 B6R1.6 NCC1COC1 MCULE-4685637013 [0,0,0,1,0,0|2,0,1]=4 1370 B6R1.6 NCC1COC1 MCULE-6896653344 [0,0,0,1,0,0|2,0,1]=4 1371 B6R1.6 OCC1CCC1 MCULE-3046613150 [0,0,0,1,0,0|2,0,1]=4 1372 B6R1.6 OCC1CCN1 MCULE-1812443062 [0,0,0,1,0,0|2,0,1]=4 1373 B6R1.6 OCC1CCN1 MCULE-8390631765 [0,0,0,1,0,0|2,0,1]=4 1374 B6R1.6 OCC1CCO1 MCULE-7120761203 [0,0,0,1,0,0|1,0,2]=4 1375 B6R1.6 OCC1CCO1 MCULE-7517577386 [0,0,0,1,0,0|1,0,2]=4 1376 B6R1.6 OCC1CNC1 MCULE-1537874886 [0,0,0,1,0,0|2,0,1]=4 1377 B6R1.6 OCC1CNC1 MCULE-8316085177 [0,0,0,1,0,0|2,0,1]=4 1378 B6R1.6 OCC1COC1 MCULE-5031415478 [0,0,0,1,0,0|1,0,1]=3 1379 B6R1.6 OCC1CSC1 MCULE-9388221183 [0,0,0,1,0,0|1,1,1]=4 1380 B6R1.6 OC[C@@H]1CCN1 MCULE-5565957906 [0,0,0,1,0,0|2,0,1]=4 1381 B6R1.6 OC[C@@H]1CCN1 MCULE-7064010066 [0,0,0,1,0,0|2,0,1]=4 1382 B6R1.6 OC[C@@H]1CCN1 MCULE-7539121327 [0,0,0,1,0,0|2,0,1]=4 1383 B6R1.6 OC[C@@H]1CCN1 MCULE-9740096939 [0,0,0,1,0,0|2,0,1]=4 1384 B6R1.6 OC[C@@H]1CCO1 MCULE-7613449097 [0,0,0,1,0,0|1,0,2]=4 1385 B6R1.6 OC[C@@H]1CCO1 MCULE-9444003682 [0,0,0,1,0,0|1,0,2]=4 1386 B6R1.6 OC[C@H]1CCN1 MCULE-5733363493 [0,0,0,1,0,0|2,0,1]=4 1387 B6R1.6 OC[C@H]1CCN1 MCULE-8466413816 [0,0,0,1,0,0|2,0,1]=4 1388 B6R1.6 OC[C@H]1CCO1 MCULE-1446169257 [0,0,0,1,0,0|1,0,2]=4 1389 B6R1.6 OC[C@H]1CCO1 MCULE-2929052431 [0,0,0,1,0,0|1,0,2]=4 1390 B6R1.6 ON=C1CCC1 MCULE-4777625640 [0,0,0,1,0,0|3,0,0]=4 1391 B6R1.6 SCC1COC1 MCULE-7193197469 [0,0,0,1,0,0|1,1,1]=4 1392 B6R1.7 CC1(CC1)CO MCULE-9292264802 [0,0,0,1,0,0|2,0,1]=4 1393 B6R1.7 CC1(CO1)CBr MCULE-5372688659 [0,0,0,1,0,0|2,0,1]=4 1394 B6R1.7 CC1(CO1)CCl MCULE-8847094307 [0,0,0,1,0,0|2,0,1]=4 1395 B6R1.7 CC1(CO1)CO MCULE-1000912721 [0,0,0,1,0,0|1,0,1]=3 1396 B6R1.7 CCC1(CO1)C MCULE-5308881519 [0,0,0,1,0,0|2,0,1]=4 1397 B6R1.7 C[C@@]1(CO1)CO MCULE-2087028484 [0,0,0,1,0,0|1,0,1]=3 1398 B6R1.7 C[C@@]1(CO1)CO MCULE-6244999634 [0,0,0,1,0,0|1,0,1]=3 1399 B6R1.7 C[C@]1(CO1)CO MCULE-1098652766 [0,0,0,1,0,0|1,0,1]=3 1400 B6R1.7 C[C@]1(CO1)CO MCULE-9811443530 [0,0,0,1,0,0|1,0,1]=3 1401 B6R1.7 NC1(CC1)CO MCULE-5890036745 [0,0,0,1,0,0|2,0,1]=4 1402 B6R1.7 NC1(CC1)CO MCULE-6476116416 [0,0,0,1,0,0|2,0,1]=4 1403 B6R1.7 OCC1(CC1)Br MCULE-2797548638 [0,0,0,1,0,0|2,0,1]=4 1404 B6R1.7 OCC1(CC1)Cl MCULE-4350532922 [0,0,0,1,0,0|2,0,1]=4 1405 B6R1.7 OCC1(CC1)F MCULE-9539268105 [0,0,0,1,0,0|2,0,1]=4 1406 B6R1.7 OCC1(CC1)O MCULE-7768871656 [0,0,0,1,0,0|1,0,2]=4 1407 B6R1.8 CC1CC1CO MCULE-5196594569 [0,0,0,1,0,0|2,0,1]=4 1408 B6R1.8 CC1OC1CO MCULE-1680425960 [0,0,0,1,0,0|1,0,2]=4 1409 B6R1.8 C[C@@H]1C[C@@H]1CO MCULE-7143685612 [0,0,0,1,0,0|2,0,1]=4 1410 B6R1.8 C[C@@H]1C[C@H]1CO MCULE-3741611930 [0,0,0,1,0,0|2,0,1]=4 1411 B6R1.8 C[C@H]1C[C@@H]1CO MCULE-2846304871 [0,0,0,1,0,0|2,0,1]=4 1412 B6R1.8 C[C@H]1C[C@@H]1CO MCULE-9275931471 [0,0,0,1,0,0|2,0,1]=4 1413 B6R1.8 C[C@H]1C[C@H]1CO MCULE-3828120088 [0,0,0,1,0,0|2,0,1]=4 1414 B6R1.8 C[C@H]1C[C@H]1CO MCULE-8442952820 [0,0,0,1,0,0|2,0,1]=4 1415 B6R1.8 NC1CC1CO MCULE-7666097515 [0,0,0,1,0,0|2,0,1]=4 1416 B6R1.8 OCC1CC1Cl MCULE-1321755136 [0,0,0,1,0,0|2,0,1]=4 1417 B6R1.8 OCC1C[C@@H]1F MCULE-2637570432 [0,0,0,1,0,0|2,0,1]=4 1418 B6R1.8 OC[C@@H]1C[C@@H]1F MCULE-9090620006 [0,0,0,1,0,0|2,0,1]=4 1419 B6R1.8 OC[C@@H]1C[C@H]1Br MCULE-8344332753 [0,0,0,1,0,0|2,0,1]=4 1420 B6R1.8 OC[C@@H]1C[C@H]1F MCULE-6282037947 [0,0,0,1,0,0|2,0,1]=4 1421 B6R1.8 OC[C@@H]1C[C@H]1F MCULE-8944803823 [0,0,0,1,0,0|2,0,1]=4 1422 B6R1.8 OC[C@H]1C[C@@H]1F MCULE-3157094299 [0,0,0,1,0,0|2,0,1]=4 1423 B3R0.1 BrCCBr MCULE-7586462642 [2,0,0,0,0,0|2,0,0]=4 1424 B3R0.1 BrCCI MCULE-8691237057 [2,0,0,0,0,0|2,0,0]=4 1425 B3R0.1 C#CC=O MCULE-4187736819 [2,0,0,0,0,0|1,0,1]=4 1426 B3R0.1 C#CCO MCULE-3909200923 [2,0,0,0,0,0|0,0,2]=4 1427 B3R0.1 C/B=N/O MCULE-5227399299 [2,0,0,0,0,0|2,0,0]=4 1428 B3R0.1 C/C=C/Br MCULE-4076369660 [2,0,0,0,0,0|1,0,1]=4 1429 B3R0.1 C/C=N/O MCULE-2376410404 [2,0,0,0,0,0|1,0,0]=3 1430 B3R0.1 C=CC=O MCULE-2104890669 [2,0,0,0,0,0|1,0,1]=4 1431 B3R0.1 C=CCBr MCULE-9486454833 [2,0,0,0,0,0|1,0,1]=4 1432 B3R0.1 C=CCC MCULE-8167907130 [2,0,0,0,0,0|1,0,1]=4 1433 B3R0.1 C=CCCl MCULE-4067772785 [2,0,0,0,0,0|1,0,1]=4 1434 B3R0.1 C=CCF MCULE-7783191980 [2,0,0,0,0,0|1,0,1]=4 1435 B3R0.1 C=CCI MCULE-5037698873 [2,0,0,0,0,0|1,0,1]=4 1436 B3R0.1 C=CCN MCULE-2424616806 [2,0,0,0,0,0|1,0,1]=4 1437 B3R0.1 C=CCN MCULE-2473480946 [2,0,0,0,0,0|1,0,1]=4 1438 B3R0.1 C=CCO MCULE-2145308838 [2,0,0,0,0,0|0,0,1]=3 1439 B3R0.1 C=CCS MCULE-7270484838 [2,0,0,0,0,0|0,1,1]=4 1440 B3R0.1 CC=CBr MCULE-2098755460 [2,0,0,0,0,0|1,0,1]=4 1441 B3R0.1 CC=CCl MCULE-9225887510 [2,0,0,0,0,0|1,0,1]=4 1442 B3R0.1 CC=NO MCULE-9761317381 [2,0,0,0,0,0|1,0,0]=3 1443 B3R0.1 CCC=O MCULE-4079744837 [2,0,0,0,0,0|1,0,0]=3 1444 B3R0.1 CCCBr MCULE-2393970713 [2,0,0,0,0,0|1,0,1]=4 1445 B3R0.1 CCCC MCULE-9760497805 [2,0,0,0,0,0|1,0,1]=4 1446 B3R0.1 CCCCl MCULE-3496412829 [2,0,0,0,0,0|1,0,1]=4 1447 B3R0.1 CCCF MCULE-8540338768 [2,0,0,0,0,0|1,0,1]=4 1448 B3R0.1 CCCI MCULE-1721488805 [2,0,0,0,0,0|1,0,1]=4 1449 B3R0.1 CCCN MCULE-2885523792 [2,0,0,0,0,0|1,0,1]=4 1450 B3R0.1 CCCN MCULE-4318907091 [2,0,0,0,0,0|1,0,1]=4 1451 B3R0.1 CCCN MCULE-6330457870 [2,0,0,0,0,0|1,0,1]=4 1452 B3R0.1 CCCN MCULE-7146820007 [2,0,0,0,0,0|1,0,1]=4 1453 B3R0.1 CCCO MCULE-6252105126 [2,0,0,0,0,0|0,0,1]=3 1454 B3R0.1 CCCS MCULE-8267649092 [2,0,0,0,0,0|0,1,1]=4 1455 B3R0.1 CCNC MCULE-7215376398 [2,0,0,0,0,0|2,0,0]=4 1456 B3R0.1 CCNC MCULE-9811899205 [2,0,0,0,0,0|2,0,0]=4 1457 B3R0.1 CCNO MCULE-1215586669 [2,0,0,0,0,0|1,0,1]=4 1458 B3R0.1 CCNO MCULE-7075818857 [2,0,0,0,0,0|1,0,1]=4 1459 B3R0.1 CCSC MCULE-6944750263 [2,0,0,0,0,0|2,0,0]=4 1460 B3R0.1 CNC=O MCULE-4739122677 [2,0,0,0,0,0|2,0,0]=4 1461 B3R0.1 COC=O MCULE-9122749354 [2,0,0,0,0,0|2,0,0]=4 1462 B3R0.1 COCBr MCULE-2566721472 [2,0,0,0,0,0|2,0,0]=4 1463 B3R0.1 COCCl MCULE-5928768006 [2,0,0,0,0,0|2,0,0]=4 1464 B3R0.1 COCI MCULE-5215132549 [2,0,0,0,0,0|2,0,0]=4 1465 B3R0.1 CSCCl MCULE-1281800596 [2,0,0,0,0,0|2,0,0]=4 1466 B3R0.1 ClCCBr MCULE-3933774075 [2,0,0,0,0,0|2,0,0]=4 1467 B3R0.1 ClCCCl MCULE-3493741440 [2,0,0,0,0,0|2,0,0]=4 1468 B3R0.1 ClCCI MCULE-7847880962 [2,0,0,0,0,0|2,0,0]=4 1469 B3R0.1 FCCBr MCULE-3117974140 [2,0,0,0,0,0|2,0,0]=4 1470 B3R0.1 FCCCl MCULE-1862981403 [2,0,0,0,0,0|2,0,0]=4 1471 B3R0.1 FCCF MCULE-1975194621 [2,0,0,0,0,0|2,0,0]=4 1472 B3R0.1 FCCI MCULE-3689313503 [2,0,0,0,0,0|2,0,0]=4 1473 B3R0.1 ICCI MCULE-8025471988 [2,0,0,0,0,0|2,0,0]=4 1474 B3R0.1 N/C=N/O MCULE-9567664507 [2,0,0,0,0,0|2,0,0]=4 1475 B3R0.1 NCCBr MCULE-3401124597 [2,0,0,0,0,0|2,0,0]=4 1476 B3R0.1 NCCBr MCULE-6215378497 [2,0,0,0,0,0|2,0,0]=4 1477 B3R0.1 NCCCl MCULE-1458699843 [2,0,0,0,0,0|2,0,0]=4 1478 B3R0.1 NCCCl MCULE-6944306112 [2,0,0,0,0,0|2,0,0]=4 1479 B3R0.1 NCCF MCULE-1670520169 [2,0,0,0,0,0|2,0,0]=4 1480 B3R0.1 NCCF MCULE-4963351029 [2,0,0,0,0,0|2,0,0]=4 1481 B3R0.1 NCCI MCULE-6905308399 [2,0,0,0,0,0|2,0,0]=4 1482 B3R0.1 NCCI MCULE-7487764362 [2,0,0,0,0,0|2,0,0]=4 1483 B3R0.1 NCCN MCULE-4740333723 [2,0,0,0,0,0|2,0,0]=4 1484 B3R0.1 NCCN MCULE-6795272853 [2,0,0,0,0,0|2,0,0]=4 1485 B3R0.1 NCCN MCULE-8304126024 [2,0,0,0,0,0|2,0,0]=4 1486 B3R0.1 NCCN MCULE-8325612144 [2,0,0,0,0,0|2,0,0]=4 1487 B3R0.1 NCCO MCULE-5175116598 [2,0,0,0,0,0|1,0,0]=3 1488 B3R0.1 NCCO MCULE-8624730373 [2,0,0,0,0,0|1,0,0]=3 1489 B3R0.1 NCCS MCULE-1838427828 [2,0,0,0,0,0|1,1,0]=4 1490 B3R0.1 NCCS MCULE-2418938683 [2,0,0,0,0,0|1,1,0]=4 1491 B3R0.1 NNC=O MCULE-6986968107 [2,0,0,0,0,0|2,0,0]=4 1492 B3R0.1 NOC=O MCULE-4489199776 [2,0,0,0,0,0|2,0,0]=4 1493 B3R0.1 O=CC=O MCULE-3212938778 [2,0,0,0,0,0|0,0,2]=4 1494 B3R0.1 O=CCBr MCULE-9076011270 [2,0,0,0,0,0|1,0,0]=3 1495 B3R0.1 O=CCCl MCULE-7307216184 [2,0,0,0,0,0|1,0,0]=3 1496 B3R0.1 O=CCI MCULE-1146810366 [2,0,0,0,0,0|1,0,0]=3 1497 B3R0.1 OCCBr MCULE-5097256006 [2,0,0,0,0,0|1,0,0]=3 1498 B3R0.1 OCCCl MCULE-5139580173 [2,0,0,0,0,0|1,0,0]=3 1499 B3R0.1 OCCF MCULE-7590677201 [2,0,0,0,0,0|1,0,0]=3 1500 B3R0.1 OCCI MCULE-8359750387 [2,0,0,0,0,0|1,0,0]=3 1501 B3R0.1 OCCO MCULE-6366313128 [2,0,0,0,0,0|0,0,0]=2 1502 B3R0.1 OCCS MCULE-2252943288 [2,0,0,0,0,0|0,1,0]=3 1503 B3R0.1 PCCP MCULE-2159678577 [2,0,0,0,0,0|2,0,0]=4 1504 B3R0.1 SCCBr MCULE-5899941299 [2,0,0,0,0,0|1,1,0]=4 1505 B3R0.1 SCCS MCULE-8277435664 [2,0,0,0,0,0|0,2,0]=4 1506 B3R0.1 [NH3+]CCS MCULE-6407472407 [2,0,0,0,0,0|1,1,0]=4 1507 B3R0.1 [NH3+]CC[NH3+] MCULE-5313549416 [2,0,0,0,0,0|2,0,0]=4 1508 B3R0.2 BN(C)C MCULE-2470964161 [2,0,0,0,0,0|2,0,0]=4 1509 B3R0.2 C=C(C)Br MCULE-7805530064 [2,0,0,0,0,0|1,0,1]=4 1510 B3R0.2 C=C(C)C MCULE-5640095130 [2,0,0,0,0,0|1,0,0]=3 1511 B3R0.2 C=C(C)Cl MCULE-1752401095 [2,0,0,0,0,0|1,0,1]=4 1512 B3R0.2 C=C(C)F MCULE-3213198231 [2,0,0,0,0,0|1,0,1]=4 1513 B3R0.2 C=[N+](C)C MCULE-4450980212 [2,0,0,0,0,0|2,0,0]=4 1514 B3R0.2 C=[N+](C)C MCULE-5309464837 [2,0,0,0,0,0|2,0,0]=4 1515 B3R0.2 C=[N+](C)C MCULE-9321779445 [2,0,0,0,0,0|2,0,0]=4 1516 B3R0.2 CB(O)O MCULE-3510763826 [2,0,0,0,0,0|1,0,1]=4 1517 B3R0.2 CC(=N)N MCULE-3235425606 [2,0,0,0,0,0|2,0,0]=4 1518 B3R0.2 CC(=N)N MCULE-3546679379 [2,0,0,0,0,0|2,0,0]=4 1519 B3R0.2 CC(=N)N MCULE-3597638887 [2,0,0,0,0,0|2,0,0]=4 1520 B3R0.2 CC(=N)N MCULE-9831274654 [2,0,0,0,0,0|2,0,0]=4 1521 B3R0.2 CC(=O)Br MCULE-4892265063 [2,0,0,0,0,0|1,0,0]=3 1522 B3R0.2 CC(=O)C MCULE-6679625040 [2,0,0,0,0,0|0,0,0]=2 1523 B3R0.2 CC(=O)Cl MCULE-9041746362 [2,0,0,0,0,0|1,0,0]=3 1524 B3R0.2 CC(=O)I MCULE-4812718701 [2,0,0,0,0,0|1,0,0]=3 1525 B3R0.2 CC(=O)N MCULE-9280264861 [2,0,0,0,0,0|1,0,0]=3 1526 B3R0.2 CC(=O)O MCULE-1502330578 [2,0,0,0,0,0|0,0,0]=2 1527 B3R0.2 CC(=O)O MCULE-5514028500 [2,0,0,0,0,0|0,0,0]=2 1528 B3R0.2 CC(=O)O MCULE-5942589566 [2,0,0,0,0,0|0,0,0]=2 1529 B3R0.2 CC(=O)O MCULE-6780070129 [2,0,0,0,0,0|0,0,0]=2 1530 B3R0.2 CC(=O)O MCULE-8295936189 [2,0,0,0,0,0|0,0,0]=2 1531 B3R0.2 CC(=O)O MCULE-9103972283 [2,0,0,0,0,0|0,0,0]=2 1532 B3R0.2 CC(=O)O MCULE-9900518424 [2,0,0,0,0,0|0,0,0]=2 1533 B3R0.2 CC(=O)S MCULE-5769447035 [2,0,0,0,0,0|0,1,0]=3 1534 B3R0.2 CC(=O)[O-] MCULE-2314460022 [2,0,0,0,0,0|0,0,1]=3 1535 B3R0.2 CC(=O)[O-] MCULE-2960771771 [2,0,0,0,0,0|0,0,1]=3 1536 B3R0.2 CC(=O)[O-] MCULE-5334052410 [2,0,0,0,0,0|0,0,1]=3 1537 B3R0.2 CC(=O)[O-] MCULE-5482908386 [2,0,0,0,0,0|0,0,1]=3 1538 B3R0.2 CC(=O)[O-] MCULE-9723570182 [2,0,0,0,0,0|0,0,1]=3 1539 B3R0.2 CC(=O)[O-] MCULE-9910426896 [2,0,0,0,0,0|0,0,1]=3 1540 B3R0.2 CC(=S)N MCULE-4635097605 [2,0,0,0,0,0|1,1,0]=4 1541 B3R0.2 CC(=S)[O-] MCULE-1878530758 [2,0,0,0,0,0|0,1,1]=4 1542 B3R0.2 CC(C)Br MCULE-4068304617 [2,0,0,0,0,0|1,0,1]=4 1543 B3R0.2 CC(C)C MCULE-6616676274 [2,0,0,0,0,0|1,0,1]=4 1544 B3R0.2 CC(C)Cl MCULE-3190141598 [2,0,0,0,0,0|1,0,1]=4 1545 B3R0.2 CC(C)F MCULE-5333357055 [2,0,0,0,0,0|1,0,1]=4 1546 B3R0.2 CC(C)I MCULE-6151711033 [2,0,0,0,0,0|1,0,1]=4 1547 B3R0.2 CC(C)N MCULE-1048799006 [2,0,0,0,0,0|1,0,1]=4 1548 B3R0.2 CC(C)N MCULE-1125416142 [2,0,0,0,0,0|1,0,1]=4 1549 B3R0.2 CC(C)N MCULE-2418429353 [2,0,0,0,0,0|1,0,1]=4 1550 B3R0.2 CC(C)N MCULE-7280647435 [2,0,0,0,0,0|1,0,1]=4 1551 B3R0.2 CC(C)O MCULE-6646752234 [2,0,0,0,0,0|0,0,2]=4 1552 B3R0.2 CC(C)S MCULE-8283942088 [2,0,0,0,0,0|0,1,1]=4 1553 B3R0.2 CN(=O)=O MCULE-8704524604 [2,0,0,0,0,0|1,0,1]=4 1554 B3R0.2 CN(C)C MCULE-5179437979 [2,0,0,0,0,0|2,0,0]=4 1555 B3R0.2 CN(C)C MCULE-6816696733 [2,0,0,0,0,0|2,0,0]=4 1556 B3R0.2 CN(C)C MCULE-7903544426 [2,0,0,0,0,0|2,0,0]=4 1557 B3R0.2 CN(C)N MCULE-7177216911 [2,0,0,0,0,0|2,0,0]=4 1558 B3R0.2 CN(C)N MCULE-8775366011 [2,0,0,0,0,0|2,0,0]=4 1559 B3R0.2 CN(C)O MCULE-6572915706 [2,0,0,0,0,0|1,0,1]=4 1560 B3R0.2 CN(C)O MCULE-6950647562 [2,0,0,0,0,0|1,0,1]=4 1561 B3R0.2 CP(=O)C MCULE-6150886622 [2,0,0,0,0,0|1,0,0]=3 1562 B3R0.2 CP(C)C MCULE-6703190251 [2,0,0,0,0,0|2,0,0]=4 1563 B3R0.2 CS(=O)C MCULE-2005841258 [2,0,0,0,0,0|1,0,0]=3 1564 B3R0.2 CS(=O)Cl MCULE-1292201352 [2,0,0,0,0,0|2,0,0]=4 1565 B3R0.2 CS(=O)N MCULE-5162949591 [2,0,0,0,0,0|2,0,0]=4 1566 B3R0.2 CS(=O)O MCULE-8711306710 [2,0,0,0,0,0|1,0,0]=3 1567 B3R0.2 CS(=O)[O-] MCULE-1437194827 [2,0,0,0,0,0|1,0,1]=4 1568 B3R0.2 C[Ga](C)C MCULE-6013775603 [2,0,0,0,0,0|2,0,0]=4 1569 B3R0.2 C[In](C)C MCULE-1424187192 [2,0,0,0,0,0|2,0,0]=4 1570 B3R0.2 C[O+](C)C MCULE-2925451414 [2,0,0,0,0,0|2,0,0]=4 1571 B3R0.2 C[S+](C)Br MCULE-2734391695 [2,0,0,0,0,0|2,0,0]=4 1572 B3R0.2 C[S+](C)Br MCULE-6411921824 [2,0,0,0,0,0|2,0,0]=4 1573 B3R0.2 C[S+](C)C MCULE-5867625832 [2,0,0,0,0,0|2,0,0]=4 1574 B3R0.2 C[S+](C)C MCULE-7678314643 [2,0,0,0,0,0|2,0,0]=4 1575 B3R0.2 C[S+](C)C MCULE-8005905986 [2,0,0,0,0,0|2,0,0]=4 1576 B3R0.2 C[Se](=O)C MCULE-4596040471 [2,0,0,0,0,0|1,0,0]=3 1577 B3R0.2 C[Se](=O)O MCULE-5568767851 [2,0,0,0,0,0|1,0,0]=3 1578 B3R0.2 NC(=O)N MCULE-3224868954 [2,0,0,0,0,0|2,0,0]=4 1579 B3R0.2 NC(=O)N MCULE-8513891094 [2,0,0,0,0,0|2,0,0]=4 1580 B3R0.2 NC(=O)O MCULE-1579038047 [2,0,0,0,0,0|1,0,0]=3 1581 B3R0.2 NC(=O)O MCULE-3232812015 [2,0,0,0,0,0|1,0,0]=3 1582 B3R0.2 O=C(Cl)[Au] MCULE-6601882022 [2,0,0,0,0,0|2,0,0]=4 1583 B3R0.2 O=C(O)O MCULE-3743781291 [2,0,0,0,0,0|0,0,0]=2 1584 B3R0.2 O=C(O)O MCULE-6373078171 [2,0,0,0,0,0|0,0,0]=2 1585 B3R0.2 O=C([O-])O MCULE-5529655359 [2,0,0,0,0,0|0,0,1]=3 1586 B3R0.2 O=C([O-])O MCULE-7293729150 [2,0,0,0,0,0|0,0,1]=3 1587 B3R0.2 O=C([O-])[O-] MCULE-1092668330 [2,0,0,0,0,0|0,0,2]=4 1588 B3R0.2 O=C([O-])[O-] MCULE-1095103800 [2,0,0,0,0,0|0,0,2]=4 1589 B3R0.2 O=C([O-])[O-] MCULE-1597066471 [2,0,0,0,0,0|0,0,2]=4 1590 B3R0.2 O=C([O-])[O-] MCULE-2005483457 [2,0,0,0,0,0|0,0,2]=4 1591 B3R0.2 O=C([O-])[O-] MCULE-3299525070 [2,0,0,0,0,0|0,0,2]=4 1592 B3R0.2 O=C([O-])[O-] MCULE-4074516840 [2,0,0,0,0,0|0,0,2]=4 1593 B3R0.2 O=C([O-])[O-] MCULE-4180727513 [2,0,0,0,0,0|0,0,2]=4 1594 B3R0.2 O=C([O-])[O-] MCULE-4294265087 [2,0,0,0,0,0|0,0,2]=4 1595 B3R0.2 O=C([O-])[O-] MCULE-5127021441 [2,0,0,0,0,0|0,0,2]=4 1596 B3R0.2 O=C([O-])[O-] MCULE-5345790821 [2,0,0,0,0,0|0,0,2]=4 1597 B3R0.2 O=C([O-])[O-] MCULE-6214917073 [2,0,0,0,0,0|0,0,2]=4 1598 B3R0.2 O=C([O-])[O-] MCULE-6757968396 [2,0,0,0,0,0|0,0,2]=4 1599 B3R0.2 O=C([O-])[O-] MCULE-7714638074 [2,0,0,0,0,0|0,0,2]=4 1600 B3R0.2 O=C([O-])[O-] MCULE-8731559807 [2,0,0,0,0,0|0,0,2]=4 1601 B3R0.2 O=I(=O)O MCULE-6335954469 [2,0,0,0,0,0|1,0,1]=4 1602 B3R0.2 O=I(=O)O MCULE-7906123102 [2,0,0,0,0,0|1,0,1]=4 1603 B3R0.2 O=N(=O)O MCULE-5926867268 [2,0,0,0,0,0|1,0,1]=4 1604 B3R0.2 O=N(=O)O MCULE-8501453871 [2,0,0,0,0,0|1,0,1]=4 1605 B3R0.2 O=P(=O)O MCULE-3007887617 [2,0,0,0,0,0|1,0,1]=4 1606 B3R0.2 O=P(O)O MCULE-8889145943 [2,0,0,0,0,0|1,0,0]=3 1607 B3R0.2 O=P([O-])O MCULE-3773885400 [2,0,0,0,0,0|1,0,1]=4 1608 B3R0.2 O=P([O-])O MCULE-6745348516 [2,0,0,0,0,0|1,0,1]=4 1609 B3R0.2 O=S(=O)O MCULE-7070708516 [2,0,0,0,0,0|1,0,1]=4 1610 B3R0.2 O=S(O)O MCULE-3188569799 [2,0,0,0,0,0|1,0,0]=3 1611 B3R0.2 O=S(O)O MCULE-7812738469 [2,0,0,0,0,0|1,0,0]=3 1612 B3R0.2 O=[Se](O)O MCULE-9081277469 [2,0,0,0,0,0|1,0,0]=3 1613 B3R0.2 O=[Si](O)O MCULE-3228936275 [2,0,0,0,0,0|0,1,0]=3 1614 B3R0.2 OB(O)O MCULE-2905906674 [2,0,0,0,0,0|1,0,1]=4 1615 B3R0.2 OB(O)O MCULE-8095091838 [2,0,0,0,0,0|1,0,1]=4 1616 B3R0.2 OP(O)O MCULE-9313199709 [2,0,0,0,0,0|1,0,1]=4 1617 B5R0.1 C#CCC(=O)O MCULE-4680699666 [1,1,0,0,0,0|1,0,0]=3 1618 B5R0.1 C(C)(N)CCO MCULE-5545469271 [1,1,0,0,0,0|1,0,1]=4 1619 B5R0.1 C/C(=C/CI)/I MCULE-4907089043 [1,1,0,0,0,0|2,0,0]=4 1620 B5R0.1 C/C(=C/CN)/Cl MCULE-1091573118 [1,1,0,0,0,0|2,0,0]=4 1621 B5R0.1 C/C(=C/CN)/Cl MCULE-8112023611 [1,1,0,0,0,0|2,0,0]=4 1622 B5R0.1 C/C(=C\CCl)/Cl MCULE-6679259233 [1,1,0,0,0,0|2,0,0]=4 1623 B5R0.1 C/C=C/C(=O)C MCULE-2109656516 [1,1,0,0,0,0|1,0,1]=4 1624 B5R0.1 C/C=C/C(=O)O MCULE-6937494852 [1,1,0,0,0,0|1,0,1]=4 1625 B5R0.1 C=C(Br)CCO MCULE-3743908958 [1,1,0,0,0,0|1,0,1]=4 1626 B5R0.1 C=C(Br)COC MCULE-5349428431 [1,1,0,0,0,0|1,0,1]=4 1627 B5R0.1 C=C(C)CCBr MCULE-3439794005 [1,1,0,0,0,0|2,0,0]=4 1628 B5R0.1 C=C(C)CCC MCULE-8225129744 [1,1,0,0,0,0|2,0,0]=4 1629 B5R0.1 C=C(C)CCCl MCULE-2816016781 [1,1,0,0,0,0|2,0,0]=4 1630 B5R0.1 C=C(C)CCI MCULE-6317205481 [1,1,0,0,0,0|2,0,0]=4 1631 B5R0.1 C=C(C)CCN MCULE-4037025602 [1,1,0,0,0,0|2,0,0]=4 1632 B5R0.1 C=C(C)CCN MCULE-5001503744 [1,1,0,0,0,0|2,0,0]=4 1633 B5R0.1 C=C(C)CCO MCULE-2689800711 [1,1,0,0,0,0|1,0,0]=3 1634 B5R0.1 C=C(C)CNC MCULE-6783886553 [1,1,0,0,0,0|2,0,0]=4 1635 B5R0.1 C=C(C)CNC MCULE-8292313282 [1,1,0,0,0,0|2,0,0]=4 1636 B5R0.1 C=C(C)CNN MCULE-1117931770 [1,1,0,0,0,0|2,0,0]=4 1637 B5R0.1 C=C(C)CON MCULE-2773974323 [1,1,0,0,0,0|1,0,0]=3 1638 B5R0.1 C=C(C)CON MCULE-5978680243 [1,1,0,0,0,0|1,0,0]=3 1639 B5R0.1 C=C(C)OCC MCULE-5303468686 [1,1,0,0,0,0|2,0,0]=4 1640 B5R0.1 C=CCC(=C)C MCULE-6294070836 [1,1,0,0,0,0|2,0,0]=4 1641 B5R0.1 C=CCC(=O)Cl MCULE-6033189203 [1,1,0,0,0,0|2,0,0]=4 1642 B5R0.1 C=CCC(=O)N MCULE-1205335257 [1,1,0,0,0,0|2,0,0]=4 1643 B5R0.1 C=CCC(=O)O MCULE-6288979337 [1,1,0,0,0,0|1,0,0]=3 1644 B5R0.1 C=CNC(=O)C MCULE-1260296806 [1,1,0,0,0,0|1,0,1]=4 1645 B5R0.1 C=COC(=O)C MCULE-7626795765 [1,1,0,0,0,0|1,0,1]=4 1646 B5R0.1 C=NCC(=O)N MCULE-7609497329 [1,1,0,0,0,0|2,0,0]=4 1647 B5R0.1 CC#CC(=O)C MCULE-4083248904 [1,1,0,0,0,0|1,0,1]=4 1648 B5R0.1 CC#CC(=O)O MCULE-9994142213 [1,1,0,0,0,0|1,0,1]=4 1649 B5R0.1 CC(=CCBr)C MCULE-7961276795 [1,1,0,0,0,0|2,0,0]=4 1650 B5R0.1 CC(=CCCl)C MCULE-1110417103 [1,1,0,0,0,0|2,0,0]=4 1651 B5R0.1 CC(=CCCl)Cl MCULE-9735045489 [1,1,0,0,0,0|2,0,0]=4 1652 B5R0.1 CC(=CCI)I MCULE-4204968539 [1,1,0,0,0,0|2,0,0]=4 1653 B5R0.1 CC(=CCN)C MCULE-7220252581 [1,1,0,0,0,0|2,0,0]=4 1654 B5R0.1 CC(=CCN)C MCULE-8394581250 [1,1,0,0,0,0|2,0,0]=4 1655 B5R0.1 CC(=CCN)Cl MCULE-1749173363 [1,1,0,0,0,0|2,0,0]=4 1656 B5R0.1 CC(=CCN)Cl MCULE-5722512850 [1,1,0,0,0,0|2,0,0]=4 1657 B5R0.1 CC(=CCO)C MCULE-3984123588 [1,1,0,0,0,0|1,0,0]=3 1658 B5R0.1 CC(=CCO)Cl MCULE-6459066496 [1,1,0,0,0,0|1,0,0]=3 1659 B5R0.1 CC(=CCO)I MCULE-4600854759 [1,1,0,0,0,0|1,0,0]=3 1660 B5R0.1 CC(=CCS)C MCULE-4180446913 [1,1,0,0,0,0|1,1,0]=4 1661 B5R0.1 CC(=O)/C=N/O MCULE-5424156575 [1,1,0,0,0,0|0,0,1]=3 1662 B5R0.1 CC(=O)/C=N\O MCULE-9083768531 [1,1,0,0,0,0|0,0,1]=3 1663 B5R0.1 CC(=O)C=C=O MCULE-4335598177 [1,1,0,0,0,0|0,0,2]=4 1664 B5R0.1 CC(=O)C=NO MCULE-5513006918 [1,1,0,0,0,0|0,0,1]=3 1665 B5R0.1 CC(=O)CC#N MCULE-7203242552 [1,1,0,0,0,0|1,0,0]=3 1666 B5R0.1 CC(=O)CCBr MCULE-2615300206 [1,1,0,0,0,0|1,0,0]=3 1667 B5R0.1 CC(=O)CCCl MCULE-8019748964 [1,1,0,0,0,0|1,0,0]=3 1668 B5R0.1 CC(=O)CCN MCULE-7550348751 [1,1,0,0,0,0|1,0,0]=3 1669 B5R0.1 CC(=O)CCN MCULE-9519063810 [1,1,0,0,0,0|1,0,0]=3 1670 B5R0.1 CC(=O)CCO MCULE-6328537335 [1,1,0,0,0,0|0,0,0]=2 1671 B5R0.1 CC(=O)N=C=S MCULE-7540453687 [1,1,0,0,0,0|0,1,1]=4 1672 B5R0.1 CC(=O)N=S=O MCULE-1420371815 [1,1,0,0,0,0|1,0,1]=4 1673 B5R0.1 CC(=O)NC#N MCULE-8444599659 [1,1,0,0,0,0|1,0,1]=4 1674 B5R0.1 CC(=O)NCO MCULE-4563335540 [1,1,0,0,0,0|0,0,0]=2 1675 B5R0.1 CC(=O)OCBr MCULE-9842804945 [1,1,0,0,0,0|1,0,0]=3 1676 B5R0.1 CC(=O)OCCl MCULE-6822222026 [1,1,0,0,0,0|1,0,0]=3 1677 B5R0.1 CC(=O)SCBr MCULE-9794607323 [1,1,0,0,0,0|1,0,0]=3 1678 B5R0.1 CC(C)CCO MCULE-7411270401 [1,1,0,0,0,0|1,0,1]=4 1679 B5R0.1 CC(C)CON MCULE-3476786246 [1,1,0,0,0,0|1,0,1]=4 1680 B5R0.1 CC(C)CON MCULE-4450654727 [1,1,0,0,0,0|1,0,1]=4 1681 B5R0.1 CC(Cl)CCO MCULE-1955496242 [1,1,0,0,0,0|1,0,1]=4 1682 B5R0.1 CC(N)CCO MCULE-1771399942 [1,1,0,0,0,0|1,0,1]=4 1683 B5R0.1 CC(N)CCO MCULE-7239872808 [1,1,0,0,0,0|1,0,1]=4 1684 B5R0.1 CC(O)CCO MCULE-1694239851 [1,1,0,0,0,0|0,0,2]=4 1685 B5R0.1 CC(O)CCO MCULE-7784884948 [1,1,0,0,0,0|0,0,2]=4 1686 B5R0.1 CC(O)CON MCULE-1051091134 [1,1,0,0,0,0|0,0,2]=4 1687 B5R0.1 CC(O)CON MCULE-6722092589 [1,1,0,0,0,0|0,0,2]=4 1688 B5R0.1 CC(S)CCO MCULE-5702212503 [1,1,0,0,0,0|0,1,1]=4 1689 B5R0.1 CC=CC(=O)C MCULE-4826977340 [1,1,0,0,0,0|1,0,1]=4 1690 B5R0.1 CC=CC(=O)O MCULE-7970410217 [1,1,0,0,0,0|1,0,1]=4 1691 B5R0.1 CCC=C(C)C MCULE-2405063894 [1,1,0,0,0,0|2,0,0]=4 1692 B5R0.1 CCCC(=O)C MCULE-7174095676 [1,1,0,0,0,0|1,0,0]=3 1693 B5R0.1 CCCC(=O)Cl MCULE-3288175193 [1,1,0,0,0,0|2,0,0]=4 1694 B5R0.1 CCCC(=O)N MCULE-2712067671 [1,1,0,0,0,0|2,0,0]=4 1695 B5R0.1 CCCC(=O)O MCULE-4116382006 [1,1,0,0,0,0|1,0,0]=3 1696 B5R0.1 CCCC(=O)[O-] MCULE-8706538802 [1,1,0,0,0,0|1,0,1]=4 1697 B5R0.1 CCCC(=O)[O-] MCULE-9764702574 [1,1,0,0,0,0|1,0,1]=4 1698 B5R0.1 CCCC(=S)O MCULE-3382199964 [1,1,0,0,0,0|1,1,0]=4 1699 B5R0.1 CCNC(=O)C MCULE-7543656350 [1,1,0,0,0,0|1,0,0]=3 1700 B5R0.1 CCNC(=O)Cl MCULE-5831262934 [1,1,0,0,0,0|2,0,0]=4 1701 B5R0.1 CCNC(=O)N MCULE-1913599861 [1,1,0,0,0,0|2,0,0]=4 1702 B5R0.1 CCOC(=N)C MCULE-3060267072 [1,1,0,0,0,0|2,0,0]=4 1703 B5R0.1 CCOC(=N)C MCULE-3943786182 [1,1,0,0,0,0|2,0,0]=4 1704 B5R0.1 CCOC(=O)C MCULE-6628539781 [1,1,0,0,0,0|1,0,0]=3 1705 B5R0.1 CCOC(=O)Cl MCULE-4167904934 [1,1,0,0,0,0|2,0,0]=4 1706 B5R0.1 CCOC(=O)N MCULE-1776877276 [1,1,0,0,0,0|2,0,0]=4 1707 B5R0.1 CCOC(=S)C MCULE-3358897597 [1,1,0,0,0,0|1,1,0]=4 1708 B5R0.1 CCSC(=O)C MCULE-8015440229 [1,1,0,0,0,0|1,0,0]=3 1709 B5R0.1 CCSC(=S)C MCULE-1502137460 [1,1,0,0,0,0|1,1,0]=4 1710 B5R0.1 CN(C)CCO MCULE-5715813465 [1,1,0,0,0,0|2,0,0]=4 1711 B5R0.1 CN(C)CCO MCULE-7567469160 [1,1,0,0,0,0|2,0,0]=4 1712 B5R0.1 CN(C)CCO MCULE-9024108074 [1,1,0,0,0,0|2,0,0]=4 1713 B5R0.1 CNCC(=O)C MCULE-3695443024 [1,1,0,0,0,0|1,0,0]=3 1714 B5R0.1 CNCC(=O)C MCULE-7402723072 [1,1,0,0,0,0|1,0,0]=3 1715 B5R0.1 CNCC(=O)N MCULE-2328887394 [1,1,0,0,0,0|2,0,0]=4 1716 B5R0.1 CNCC(=O)N MCULE-3031605853 [1,1,0,0,0,0|2,0,0]=4 1717 B5R0.1 CNCC(=O)N MCULE-7300977677 [1,1,0,0,0,0|2,0,0]=4 1718 B5R0.1 CNCC(=O)O MCULE-3448356048 [1,1,0,0,0,0|1,0,0]=3 1719 B5R0.1 CNCC(=O)O MCULE-4484444573 [1,1,0,0,0,0|1,0,0]=3 1720 B5R0.1 CNCC(=O)[O-] MCULE-7993701866 [1,1,0,0,0,0|1,0,1]=4 1721 B5R0.1 CNOC(=O)C MCULE-1464426541 [1,1,0,0,0,0|2,0,0]=4 1722 B5R0.1 CNOC(=O)C MCULE-2976282666 [1,1,0,0,0,0|2,0,0]=4 1723 B5R0.1 COC=C(C)C MCULE-6348538911 [1,1,0,0,0,0|1,0,1]=4 1724 B5R0.1 COCC(=N)N MCULE-4711728356 [1,1,0,0,0,0|2,0,0]=4 1725 B5R0.1 COCC(=N)N MCULE-7163250467 [1,1,0,0,0,0|2,0,0]=4 1726 B5R0.1 COCC(=O)C MCULE-7262197587 [1,1,0,0,0,0|0,0,0]=2 1727 B5R0.1 COCC(=O)Cl MCULE-5449267495 [1,1,0,0,0,0|1,0,0]=3 1728 B5R0.1 COCC(=O)N MCULE-6674958132 [1,1,0,0,0,0|1,0,0]=3 1729 B5R0.1 COCC(=O)O MCULE-3945589151 [1,1,0,0,0,0|0,0,0]=2 1730 B5R0.1 COCC(=S)N MCULE-2046809269 [1,1,0,0,0,0|1,1,0]=4 1731 B5R0.1 COCC(C)Br MCULE-6850689931 [1,1,0,0,0,0|1,0,1]=4 1732 B5R0.1 COCC(C)I MCULE-8608265714 [1,1,0,0,0,0|1,0,1]=4 1733 B5R0.1 COCC(C)N MCULE-1896873634 [1,1,0,0,0,0|1,0,1]=4 1734 B5R0.1 COCC(C)N MCULE-2549420211 [1,1,0,0,0,0|1,0,1]=4 1735 B5R0.1 COCC(C)N MCULE-3490410444 [1,1,0,0,0,0|1,0,1]=4 1736 B5R0.1 COCC(C)N MCULE-7089888882 [1,1,0,0,0,0|1,0,1]=4 1737 B5R0.1 COCC(C)O MCULE-4022733014 [1,1,0,0,0,0|0,0,2]=4 1738 B5R0.1 COCC(C)O MCULE-7513310960 [1,1,0,0,0,0|0,0,2]=4 1739 B5R0.1 COCN(C)C MCULE-1963225930 [1,1,0,0,0,0|2,0,0]=4 1740 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [1,1,0,0,0,0|1,0,1]=4 1741 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [1,1,0,0,0,0|1,0,1]=4 1742 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [1,1,0,0,0,0|1,0,1]=4 1743 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [1,1,0,0,0,0|1,0,1]=4 1744 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [1,1,0,0,0,0|0,0,2]=4 1745 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [1,1,0,0,0,0|0,0,2]=4 1746 B5R0.1 COC[C@H](C)N MCULE-2465679418 [1,1,0,0,0,0|1,0,1]=4 1747 B5R0.1 COC[C@H](C)N MCULE-2998593539 [1,1,0,0,0,0|1,0,1]=4 1748 B5R0.1 COC[C@H](C)N MCULE-3161045661 [1,1,0,0,0,0|1,0,1]=4 1749 B5R0.1 COC[C@H](C)N MCULE-9550165578 [1,1,0,0,0,0|1,0,1]=4 1750 B5R0.1 COC[C@H](C)O MCULE-5908531683 [1,1,0,0,0,0|0,0,2]=4 1751 B5R0.1 COC[C@H](C)O MCULE-8619138238 [1,1,0,0,0,0|0,0,2]=4 1752 B5R0.1 CONC(=O)C MCULE-6601866630 [1,1,0,0,0,0|1,0,0]=3 1753 B5R0.1 CONC(=O)N MCULE-3063713861 [1,1,0,0,0,0|2,0,0]=4 1754 B5R0.1 CONC(=S)C MCULE-1876042939 [1,1,0,0,0,0|1,1,0]=4 1755 B5R0.1 CS(=O)CC#N MCULE-1246621507 [1,1,0,0,0,0|2,0,0]=4 1756 B5R0.1 CS(=O)CCBr MCULE-7846126230 [1,1,0,0,0,0|2,0,0]=4 1757 B5R0.1 CS(=O)CCCl MCULE-7012781505 [1,1,0,0,0,0|2,0,0]=4 1758 B5R0.1 CS(=O)CCN MCULE-6497874560 [1,1,0,0,0,0|2,0,0]=4 1759 B5R0.1 CS(=O)CCN MCULE-8275663766 [1,1,0,0,0,0|2,0,0]=4 1760 B5R0.1 CS(=O)CCN MCULE-8330490290 [1,1,0,0,0,0|2,0,0]=4 1761 B5R0.1 CS(=O)CCO MCULE-8331553582 [1,1,0,0,0,0|1,0,0]=3 1762 B5R0.1 CSCC(=O)C MCULE-4131794172 [1,1,0,0,0,0|0,1,0]=3 1763 B5R0.1 CSCC(=O)Cl MCULE-9750052685 [1,1,0,0,0,0|1,1,0]=4 1764 B5R0.1 CSCC(=O)N MCULE-4865579476 [1,1,0,0,0,0|1,1,0]=4 1765 B5R0.1 CSCC(=O)O MCULE-7003418159 [1,1,0,0,0,0|0,1,0]=3 1766 B5R0.1 CSCS(=O)C MCULE-3167702486 [1,1,0,0,0,0|1,1,0]=4 1767 B5R0.1 CSNC(=O)C MCULE-7350061514 [1,1,0,0,0,0|1,1,0]=4 1768 B5R0.1 C[C@@H](N)CCO MCULE-4224878672 [1,1,0,0,0,0|1,0,1]=4 1769 B5R0.1 C[C@@H](N)CCO MCULE-5727539473 [1,1,0,0,0,0|1,0,1]=4 1770 B5R0.1 C[C@@H](O)CCO MCULE-6277947442 [1,1,0,0,0,0|0,0,2]=4 1771 B5R0.1 C[C@@H](O)CCO MCULE-9742368348 [1,1,0,0,0,0|0,0,2]=4 1772 B5R0.1 C[C@@H](O)CON MCULE-3740397343 [1,1,0,0,0,0|0,0,2]=4 1773 B5R0.1 C[C@@H](O)CON MCULE-8274376872 [1,1,0,0,0,0|0,0,2]=4 1774 B5R0.1 C[C@H](N)CCO MCULE-1496375567 [1,1,0,0,0,0|1,0,1]=4 1775 B5R0.1 C[C@H](N)CCO MCULE-4744824708 [1,1,0,0,0,0|1,0,1]=4 1776 B5R0.1 C[C@H](N)CCO MCULE-7219173683 [1,1,0,0,0,0|1,0,1]=4 1777 B5R0.1 C[C@H](N)CCO MCULE-9164942837 [1,1,0,0,0,0|1,0,1]=4 1778 B5R0.1 C[C@H](O)CCO MCULE-2504912618 [1,1,0,0,0,0|0,0,2]=4 1779 B5R0.1 C[C@H](O)CCO MCULE-2958119786 [1,1,0,0,0,0|0,0,2]=4 1780 B5R0.1 C[C@H](O)CON MCULE-4216605221 [1,1,0,0,0,0|0,0,2]=4 1781 B5R0.1 C[C@H](O)CON MCULE-9863094719 [1,1,0,0,0,0|0,0,2]=4 1782 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [1,1,0,0,0,0|1,0,0]=3 1783 B5R0.1 N#CCC(=O)Cl MCULE-7971055738 [1,1,0,0,0,0|2,0,0]=4 1784 B5R0.1 N#CCC(=O)N MCULE-8538286230 [1,1,0,0,0,0|2,0,0]=4 1785 B5R0.1 N#CCC(=O)O MCULE-3440765061 [1,1,0,0,0,0|1,0,0]=3 1786 B5R0.1 N#CCC(=O)[O-] MCULE-2598625909 [1,1,0,0,0,0|1,0,1]=4 1787 B5R0.1 N#CCC(=O)[O-] MCULE-3532110520 [1,1,0,0,0,0|1,0,1]=4 1788 B5R0.1 N=C(N)CCO MCULE-4567824707 [1,1,0,0,0,0|2,0,0]=4 1789 B5R0.1 N=C(N)CCO MCULE-7139693715 [1,1,0,0,0,0|2,0,0]=4 1790 B5R0.1 NC(=O)C=NO MCULE-6447662753 [1,1,0,0,0,0|1,0,1]=4 1791 B5R0.1 NC(=O)CCBr MCULE-3930714776 [1,1,0,0,0,0|2,0,0]=4 1792 B5R0.1 NC(=O)CCCl MCULE-8300320959 [1,1,0,0,0,0|2,0,0]=4 1793 B5R0.1 NC(=O)CCO MCULE-4026170350 [1,1,0,0,0,0|1,0,0]=3 1794 B5R0.1 NC(=O)CCS MCULE-7451827717 [1,1,0,0,0,0|1,1,0]=4 1795 B5R0.1 NC(=O)NCO MCULE-7403641101 [1,1,0,0,0,0|1,0,0]=3 1796 B5R0.1 NCCC(=O)Cl MCULE-1298355499 [1,1,0,0,0,0|2,0,0]=4 1797 B5R0.1 NCCC(=O)N MCULE-2899414135 [1,1,0,0,0,0|2,0,0]=4 1798 B5R0.1 NCCC(=O)N MCULE-6993286668 [1,1,0,0,0,0|2,0,0]=4 1799 B5R0.1 NCCC(=O)O MCULE-1344289084 [1,1,0,0,0,0|1,0,0]=3 1800 B5R0.1 NCCC(=O)O MCULE-2298605337 [1,1,0,0,0,0|1,0,0]=3 1801 B5R0.1 NCCC(=O)O MCULE-9375577631 [1,1,0,0,0,0|1,0,0]=3 1802 B5R0.1 NCCC(=O)[O-] MCULE-2492250086 [1,1,0,0,0,0|1,0,1]=4 1803 B5R0.1 NCCP(=O)O MCULE-7093964616 [1,1,0,0,0,0|2,0,0]=4 1804 B5R0.1 NCCS(=O)O MCULE-4372248641 [1,1,0,0,0,0|2,0,0]=4 1805 B5R0.1 NNCC(=O)N MCULE-2794619708 [1,1,0,0,0,0|2,0,0]=4 1806 B5R0.1 NNCC(=O)N MCULE-6773156087 [1,1,0,0,0,0|2,0,0]=4 1807 B5R0.1 NNCC(=O)O MCULE-4908184724 [1,1,0,0,0,0|1,0,0]=3 1808 B5R0.1 NNCC(=O)O MCULE-6315598774 [1,1,0,0,0,0|1,0,0]=3 1809 B5R0.1 NOCC(=O)O MCULE-4566186819 [1,1,0,0,0,0|0,0,0]=2 1810 B5R0.1 NOCC(=O)O MCULE-4824237418 [1,1,0,0,0,0|0,0,0]=2 1811 B5R0.1 NOCC(=O)O MCULE-8132180423 [1,1,0,0,0,0|0,0,0]=2 1812 B5R0.1 O=C(Cl)CCBr MCULE-4659506608 [1,1,0,0,0,0|2,0,0]=4 1813 B5R0.1 O=C(Cl)CCCl MCULE-3313924878 [1,1,0,0,0,0|2,0,0]=4 1814 B5R0.1 O=C(Cl)CCF MCULE-3316397790 [1,1,0,0,0,0|2,0,0]=4 1815 B5R0.1 O=C(Cl)OCCl MCULE-2130588147 [1,1,0,0,0,0|2,0,0]=4 1816 B5R0.1 O=C(O)/C=C/Br MCULE-7284519266 [1,1,0,0,0,0|1,0,1]=4 1817 B5R0.1 O=C(O)/C=C/Cl MCULE-1625781671 [1,1,0,0,0,0|1,0,1]=4 1818 B5R0.1 O=C(O)/C=C/I MCULE-3339607379 [1,1,0,0,0,0|1,0,1]=4 1819 B5R0.1 O=C(O)/C=C\Br MCULE-6149049313 [1,1,0,0,0,0|1,0,1]=4 1820 B5R0.1 O=C(O)/C=C\Cl MCULE-1221996674 [1,1,0,0,0,0|1,0,1]=4 1821 B5R0.1 O=C(O)/C=C\I MCULE-3065405012 [1,1,0,0,0,0|1,0,1]=4 1822 B5R0.1 O=C(O)/C=N/O MCULE-2471349844 [1,1,0,0,0,0|0,0,1]=3 1823 B5R0.1 O=C(O)C#CBr MCULE-1997285471 [1,1,0,0,0,0|1,0,1]=4 1824 B5R0.1 O=C(O)C=CBr MCULE-2956464856 [1,1,0,0,0,0|1,0,1]=4 1825 B5R0.1 O=C(O)C=CCl MCULE-6369812151 [1,1,0,0,0,0|1,0,1]=4 1826 B5R0.1 O=C(O)C=CI MCULE-7162332129 [1,1,0,0,0,0|1,0,1]=4 1827 B5R0.1 O=C(O)C=NO MCULE-2039309679 [1,1,0,0,0,0|0,0,1]=3 1828 B5R0.1 O=C(O)CCBr MCULE-2816055853 [1,1,0,0,0,0|1,0,0]=3 1829 B5R0.1 O=C(O)CCCl MCULE-8511144183 [1,1,0,0,0,0|1,0,0]=3 1830 B5R0.1 O=C(O)CCF MCULE-4382025684 [1,1,0,0,0,0|1,0,0]=3 1831 B5R0.1 O=C(O)CCI MCULE-3371354708 [1,1,0,0,0,0|1,0,0]=3 1832 B5R0.1 O=C(O)CCO MCULE-3428604829 [1,1,0,0,0,0|0,0,0]=2 1833 B5R0.1 O=C(O)CCS MCULE-3211932163 [1,1,0,0,0,0|0,1,0]=3 1834 B5R0.1 O=C(O)CNO MCULE-4437067339 [1,1,0,0,0,0|0,0,0]=2 1835 B5R0.1 O=C([O-])C#CO MCULE-3725047218 [1,1,0,0,0,0|0,0,2]=4 1836 B5R0.1 O=C([O-])C#CO MCULE-9125153565 [1,1,0,0,0,0|0,0,2]=4 1837 B5R0.1 O=C([O-])CCO MCULE-4429611588 [1,1,0,0,0,0|0,0,1]=3 1838 B5R0.1 O=N(=O)CCO MCULE-2060841405 [1,1,0,0,0,0|1,0,1]=4 1839 B5R0.1 OCC=C(Cl)Cl MCULE-6473037027 [1,1,0,0,0,0|2,0,0]=4 1840 B5R0.4 CC(C)(Br)CO MCULE-5949221311 [1,1,0,0,0,0|1,0,1]=4 1841 B5R0.4 CC(C)(C)CO MCULE-4399535684 [1,1,0,0,0,0|1,0,1]=4 1842 B5R0.4 CC(C)(F)CO MCULE-1700621997 [1,1,0,0,0,0|1,0,1]=4 1843 B5R0.4 CC(C)(N)CO MCULE-4072416202 [1,1,0,0,0,0|1,0,1]=4 1844 B5R0.4 CC(C)(N)CO MCULE-4209651459 [1,1,0,0,0,0|1,0,1]=4 1845 B5R0.4 CC(C)(N)CO MCULE-6047079177 [1,1,0,0,0,0|1,0,1]=4 1846 B5R0.4 CC(C)(O)CO MCULE-6797456030 [1,1,0,0,0,0|0,0,2]=4 1847 B5R0.4 CC(C)(S)CO MCULE-6119329508 [1,1,0,0,0,0|0,1,1]=4 1848 B5R0.4 CC(F)(F)CO MCULE-1049181656 [1,1,0,0,0,0|1,0,1]=4 1849 B5R0.4 CCP(=O)(O)O MCULE-5185791919 [1,1,0,0,0,0|2,0,0]=4 1850 B5R0.4 CCS(=N)(=O)C MCULE-6682726319 [1,1,0,0,0,0|2,0,0]=4 1851 B5R0.4 CCS(=O)(=O)C MCULE-8932195925 [1,1,0,0,0,0|2,0,0]=4 1852 B5R0.4 CCS(=O)(=O)O MCULE-4408374633 [1,1,0,0,0,0|2,0,0]=4 1853 B5R0.4 CCS(=O)(=S)O MCULE-3229359913 [1,1,0,0,0,0|2,0,0]=4 1854 B5R0.4 CP(=O)(C)CCl MCULE-8860798375 [1,1,0,0,0,0|2,0,0]=4 1855 B5R0.4 CS(=O)(=O)CBr MCULE-2231437619 [1,1,0,0,0,0|2,0,0]=4 1856 B5R0.4 CS(=O)(=O)CCl MCULE-3138137071 [1,1,0,0,0,0|2,0,0]=4 1857 B5R0.4 CS(=O)(=O)NO MCULE-6576734604 [1,1,0,0,0,0|2,0,0]=4 1858 B5R0.4 C[Si](C)(C)CO MCULE-7434746060 [1,1,0,0,0,0|1,1,0]=4 1859 B5R0.4 NCP(=O)(O)O MCULE-5036947233 [1,1,0,0,0,0|2,0,0]=4 1860 B5R0.4 NCS(=O)(=O)O MCULE-2178285528 [1,1,0,0,0,0|2,0,0]=4 1861 B5R0.4 O=P(O)(O)CCl MCULE-3749129481 [1,1,0,0,0,0|2,0,0]=4 1862 B5R0.4 O=P(O)(O)CO MCULE-9997097349 [1,1,0,0,0,0|1,0,0]=3 1863 B5R0.4 O=S(=O)(O)CBr MCULE-7461723318 [1,1,0,0,0,0|2,0,0]=4 1864 B5R0.4 O=S(=O)(O)CCl MCULE-4274838804 [1,1,0,0,0,0|2,0,0]=4 1865 B5R0.4 O=S(=O)(O)CO MCULE-9647441782 [1,1,0,0,0,0|1,0,0]=3 1866 B5R0.4 O=S(=O)([O-])CO MCULE-5488503909 [1,1,0,0,0,0|1,0,1]=4 1867 B5R0.5 C=C(Br)C(=O)O MCULE-2068246942 [1,1,0,0,0,0|1,0,1]=4 1868 B5R0.5 C=C(C)B(O)O MCULE-1381151629 [1,1,0,0,0,0|2,0,0]=4 1869 B5R0.5 C=C(C)C(=O)C MCULE-5872425076 [1,1,0,0,0,0|1,0,1]=4 1870 B5R0.5 C=C(C)C(=O)O MCULE-9899621926 [1,1,0,0,0,0|1,0,1]=4 1871 B5R0.5 C=C(C)C(C)C MCULE-2535284443 [1,1,0,0,0,0|2,0,0]=4 1872 B5R0.5 C=C(C)C(C)Cl MCULE-5294924458 [1,1,0,0,0,0|2,0,0]=4 1873 B5R0.5 C=C(C)C(C)O MCULE-3768810742 [1,1,0,0,0,0|1,0,0]=3 1874 B5R0.5 C=C(C)C(Cl)Cl MCULE-4460311331 [1,1,0,0,0,0|2,0,0]=4 1875 B5R0.5 C=C(C)C(Cl)Cl MCULE-5923487420 [1,1,0,0,0,0|2,0,0]=4 1876 B5R0.5 C=C(Cl)C(=O)O MCULE-8316225208 [1,1,0,0,0,0|1,0,1]=4 1877 B5R0.5 C=C(F)C(=O)O MCULE-7137929861 [1,1,0,0,0,0|1,0,1]=4 1878 B5R0.5 CC(=O)C(=O)C MCULE-5742661187 [1,1,0,0,0,0|0,0,2]=4 1879 B5R0.5 CC(=O)C(=O)Cl MCULE-3413498860 [1,1,0,0,0,0|0,0,2]=4 1880 B5R0.5 CC(=O)C(=O)N MCULE-6804734996 [1,1,0,0,0,0|0,0,2]=4 1881 B5R0.5 CC(=O)C(=O)O MCULE-8587144313 [1,1,0,0,0,0|0,0,1]=3 1882 B5R0.5 CC(=O)C(=O)[O-] MCULE-2773521709 [1,1,0,0,0,0|0,0,2]=4 1883 B5R0.5 CC(=O)C(=O)[O-] MCULE-7007482346 [1,1,0,0,0,0|0,0,2]=4 1884 B5R0.5 CC(=O)C(=O)[O-] MCULE-8344520452 [1,1,0,0,0,0|0,0,2]=4 1885 B5R0.5 CC(=O)C(=S)N MCULE-3142518834 [1,1,0,0,0,0|0,1,1]=4 1886 B5R0.5 CC(=O)C(C)Br MCULE-3764525199 [1,1,0,0,0,0|1,0,0]=3 1887 B5R0.5 CC(=O)C(C)C MCULE-5982732938 [1,1,0,0,0,0|1,0,0]=3 1888 B5R0.5 CC(=O)C(C)Cl MCULE-5065840606 [1,1,0,0,0,0|1,0,0]=3 1889 B5R0.5 CC(=O)C(C)F MCULE-2129925918 [1,1,0,0,0,0|1,0,0]=3 1890 B5R0.5 CC(=O)C(C)N MCULE-5716124999 [1,1,0,0,0,0|1,0,0]=3 1891 B5R0.5 CC(=O)C(C)N MCULE-9248002534 [1,1,0,0,0,0|1,0,0]=3 1892 B5R0.5 CC(=O)C(C)O MCULE-5374414264 [1,1,0,0,0,0|0,0,0]=2 1893 B5R0.5 CC(=O)C(C)S MCULE-2716722148 [1,1,0,0,0,0|0,1,0]=3 1894 B5R0.5 CC(=O)C(Cl)Cl MCULE-9043899746 [1,1,0,0,0,0|1,0,0]=3 1895 B5R0.5 CC(=O)C(F)F MCULE-9206168077 [1,1,0,0,0,0|1,0,0]=3 1896 B5R0.5 CC(=O)N(C)C MCULE-4256511309 [1,1,0,0,0,0|2,0,0]=4 1897 B5R0.5 CC(=O)N(C)N MCULE-2447375293 [1,1,0,0,0,0|2,0,0]=4 1898 B5R0.5 CC(=O)[C@H](C)N MCULE-2609095078 [1,1,0,0,0,0|1,0,0]=3 1899 B5R0.5 CC(=O)[C@H](C)N MCULE-6039921944 [1,1,0,0,0,0|1,0,0]=3 1900 B5R0.5 CC(=O)[C@H](C)N MCULE-6387613992 [1,1,0,0,0,0|1,0,0]=3 1901 B5R0.5 CC(=O)[C@H](C)N MCULE-7052375323 [1,1,0,0,0,0|1,0,0]=3 1902 B5R0.5 CC(Br)C(=O)Br MCULE-2400047844 [1,1,0,0,0,0|2,0,0]=4 1903 B5R0.5 CC(Br)C(=O)Cl MCULE-7431871683 [1,1,0,0,0,0|2,0,0]=4 1904 B5R0.5 CC(Br)C(=O)N MCULE-9226586148 [1,1,0,0,0,0|2,0,0]=4 1905 B5R0.5 CC(Br)C(=O)O MCULE-3935837943 [1,1,0,0,0,0|1,0,0]=3 1906 B5R0.5 CC(Br)C(=O)O MCULE-6068441065 [1,1,0,0,0,0|1,0,0]=3 1907 B5R0.5 CC(C)C(=O)Br MCULE-3679003896 [1,1,0,0,0,0|2,0,0]=4 1908 B5R0.5 CC(C)C(=O)Cl MCULE-6582236331 [1,1,0,0,0,0|2,0,0]=4 1909 B5R0.5 CC(C)C(=O)N MCULE-9773835068 [1,1,0,0,0,0|2,0,0]=4 1910 B5R0.5 CC(C)C(=O)O MCULE-7783770647 [1,1,0,0,0,0|1,0,0]=3 1911 B5R0.5 CC(C)C(=O)S MCULE-9552406593 [1,1,0,0,0,0|1,1,0]=4 1912 B5R0.5 CC(C)C(C)O MCULE-4829392845 [1,1,0,0,0,0|1,0,1]=4 1913 B5R0.5 CC(C)S(=O)O MCULE-5200056082 [1,1,0,0,0,0|2,0,0]=4 1914 B5R0.5 CC(C)[C@@H](C)O MCULE-3565458505 [1,1,0,0,0,0|1,0,1]=4 1915 B5R0.5 CC(C)[C@H](C)O MCULE-1553214756 [1,1,0,0,0,0|1,0,1]=4 1916 B5R0.5 CC(C)[C@H](C)O MCULE-8141633445 [1,1,0,0,0,0|1,0,1]=4 1917 B5R0.5 CC(Cl)C(=O)Cl MCULE-6547241717 [1,1,0,0,0,0|2,0,0]=4 1918 B5R0.5 CC(Cl)C(=O)N MCULE-5322078211 [1,1,0,0,0,0|2,0,0]=4 1919 B5R0.5 CC(Cl)C(=O)O MCULE-3597230803 [1,1,0,0,0,0|1,0,0]=3 1920 B5R0.5 CC(Cl)C(=O)O MCULE-5449120618 [1,1,0,0,0,0|1,0,0]=3 1921 B5R0.5 CC(F)C(=O)O MCULE-7334922730 [1,1,0,0,0,0|1,0,0]=3 1922 B5R0.5 CC(I)C(=O)N MCULE-8608495554 [1,1,0,0,0,0|2,0,0]=4 1923 B5R0.5 CC(N)C(=O)N MCULE-1264398810 [1,1,0,0,0,0|2,0,0]=4 1924 B5R0.5 CC(N)C(=O)N MCULE-2251123672 [1,1,0,0,0,0|2,0,0]=4 1925 B5R0.5 CC(N)C(=O)N MCULE-2273926073 [1,1,0,0,0,0|2,0,0]=4 1926 B5R0.5 CC(N)C(=O)N MCULE-5340923071 [1,1,0,0,0,0|2,0,0]=4 1927 B5R0.5 CC(N)C(=O)N MCULE-6061233032 [1,1,0,0,0,0|2,0,0]=4 1928 B5R0.5 CC(N)C(=O)N MCULE-9273221837 [1,1,0,0,0,0|2,0,0]=4 1929 B5R0.5 CC(N)C(=O)O MCULE-3498369789 [1,1,0,0,0,0|1,0,0]=3 1930 B5R0.5 CC(N)C(=O)O MCULE-3809839392 [1,1,0,0,0,0|1,0,0]=3 1931 B5R0.5 CC(N)C(=O)O MCULE-4751903561 [1,1,0,0,0,0|1,0,0]=3 1932 B5R0.5 CC(N)C(=O)O MCULE-6963397848 [1,1,0,0,0,0|1,0,0]=3 1933 B5R0.5 CC(N)C(C)O MCULE-3512899672 [1,1,0,0,0,0|1,0,1]=4 1934 B5R0.5 CC(N)C(C)O MCULE-6286987696 [1,1,0,0,0,0|1,0,1]=4 1935 B5R0.5 CC(O)C(=N)N MCULE-4358846536 [1,1,0,0,0,0|2,0,0]=4 1936 B5R0.5 CC(O)C(=N)N MCULE-5644516205 [1,1,0,0,0,0|2,0,0]=4 1937 B5R0.5 CC(O)C(=O)N MCULE-6247123668 [1,1,0,0,0,0|1,0,0]=3 1938 B5R0.5 CC(O)C(=O)N MCULE-7823792358 [1,1,0,0,0,0|1,0,0]=3 1939 B5R0.5 CC(O)C(=O)O MCULE-3922256529 [1,1,0,0,0,0|0,0,0]=2 1940 B5R0.5 CC(O)C(=O)O MCULE-5387110670 [1,1,0,0,0,0|0,0,0]=2 1941 B5R0.5 CC(O)C(=O)[O-] MCULE-1056716990 [1,1,0,0,0,0|0,0,1]=3 1942 B5R0.5 CC(O)C(=O)[O-] MCULE-8184872865 [1,1,0,0,0,0|0,0,1]=3 1943 B5R0.5 CC(O)C(=O)[O-] MCULE-8730993694 [1,1,0,0,0,0|0,0,1]=3 1944 B5R0.5 CC(O)C(C)Br MCULE-1140424623 [1,1,0,0,0,0|1,0,1]=4 1945 B5R0.5 CC(O)C(C)Cl MCULE-3352632568 [1,1,0,0,0,0|1,0,1]=4 1946 B5R0.5 CC(O)C(C)O MCULE-2858785316 [1,1,0,0,0,0|0,0,2]=4 1947 B5R0.5 CC(O)C(C)S MCULE-3741743569 [1,1,0,0,0,0|0,1,1]=4 1948 B5R0.5 CC(S)C(=O)N MCULE-1465182001 [1,1,0,0,0,0|1,1,0]=4 1949 B5R0.5 CC(S)C(=O)O MCULE-6944738352 [1,1,0,0,0,0|0,1,0]=3 1950 B5R0.5 CN(C)C(=O)O MCULE-1039144559 [1,1,0,0,0,0|2,0,0]=4 1951 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8303539222 [1,1,0,0,0,0|1,0,0]=3 1952 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8530283309 [1,1,0,0,0,0|1,0,0]=3 1953 B5R0.5 C[C@@H](Cl)C(=O)Cl MCULE-3579498695 [1,1,0,0,0,0|2,0,0]=4 1954 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-6578788045 [1,1,0,0,0,0|1,0,0]=3 1955 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-8314108697 [1,1,0,0,0,0|1,0,0]=3 1956 B5R0.5 C[C@@H](F)C(=O)N MCULE-1505685009 [1,1,0,0,0,0|2,0,0]=4 1957 B5R0.5 C[C@@H](N)C(=O)N MCULE-4677983549 [1,1,0,0,0,0|2,0,0]=4 1958 B5R0.5 C[C@@H](N)C(=O)N MCULE-6112443507 [1,1,0,0,0,0|2,0,0]=4 1959 B5R0.5 C[C@@H](N)C(=O)N MCULE-7940270709 [1,1,0,0,0,0|2,0,0]=4 1960 B5R0.5 C[C@@H](N)C(=O)N MCULE-8482332558 [1,1,0,0,0,0|2,0,0]=4 1961 B5R0.5 C[C@@H](N)C(=O)O MCULE-3571488623 [1,1,0,0,0,0|1,0,0]=3 1962 B5R0.5 C[C@@H](N)C(=O)O MCULE-9756365751 [1,1,0,0,0,0|1,0,0]=3 1963 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-4537991630 [1,1,0,0,0,0|1,0,1]=4 1964 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5710552020 [1,1,0,0,0,0|1,0,1]=4 1965 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5951487868 [1,1,0,0,0,0|1,0,1]=4 1966 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8093543292 [1,1,0,0,0,0|1,0,1]=4 1967 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8196664475 [1,1,0,0,0,0|1,0,1]=4 1968 B5R0.5 C[C@@H](O)C(=N)N MCULE-1498978023 [1,1,0,0,0,0|2,0,0]=4 1969 B5R0.5 C[C@@H](O)C(=N)N MCULE-6124491136 [1,1,0,0,0,0|2,0,0]=4 1970 B5R0.5 C[C@@H](O)C(=N)N MCULE-7410387081 [1,1,0,0,0,0|2,0,0]=4 1971 B5R0.5 C[C@@H](O)C(=N)N MCULE-9566288141 [1,1,0,0,0,0|2,0,0]=4 1972 B5R0.5 C[C@@H](O)C(=O)N MCULE-2026557726 [1,1,0,0,0,0|1,0,0]=3 1973 B5R0.5 C[C@@H](O)C(=O)N MCULE-8056291801 [1,1,0,0,0,0|1,0,0]=3 1974 B5R0.5 C[C@@H](O)C(=O)O MCULE-4625208788 [1,1,0,0,0,0|0,0,0]=2 1975 B5R0.5 C[C@@H](O)C(=O)O MCULE-9141235095 [1,1,0,0,0,0|0,0,0]=2 1976 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-5673591667 [1,1,0,0,0,0|0,0,1]=3 1977 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-8146434340 [1,1,0,0,0,0|0,0,1]=3 1978 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-9026662277 [1,1,0,0,0,0|0,0,1]=3 1979 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-2843927827 [1,1,0,0,0,0|0,0,2]=4 1980 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-3739961672 [1,1,0,0,0,0|0,0,2]=4 1981 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-5488313047 [1,1,0,0,0,0|0,0,2]=4 1982 B5R0.5 C[C@H](Br)C(=O)Cl MCULE-2960953088 [1,1,0,0,0,0|2,0,0]=4 1983 B5R0.5 C[C@H](Br)C(=O)O MCULE-4788730445 [1,1,0,0,0,0|1,0,0]=3 1984 B5R0.5 C[C@H](Br)C(=O)O MCULE-9354978281 [1,1,0,0,0,0|1,0,0]=3 1985 B5R0.5 C[C@H](Cl)C(=O)O MCULE-4816831649 [1,1,0,0,0,0|1,0,0]=3 1986 B5R0.5 C[C@H](Cl)C(=O)O MCULE-8389122613 [1,1,0,0,0,0|1,0,0]=3 1987 B5R0.5 C[C@H](F)C(=O)N MCULE-7457242428 [1,1,0,0,0,0|2,0,0]=4 1988 B5R0.5 C[C@H](N)C(=O)N MCULE-4716963408 [1,1,0,0,0,0|2,0,0]=4 1989 B5R0.5 C[C@H](N)C(=O)N MCULE-6879702251 [1,1,0,0,0,0|2,0,0]=4 1990 B5R0.5 C[C@H](N)C(=O)N MCULE-7090555441 [1,1,0,0,0,0|2,0,0]=4 1991 B5R0.5 C[C@H](N)C(=O)N MCULE-7293369315 [1,1,0,0,0,0|2,0,0]=4 1992 B5R0.5 C[C@H](N)C(=O)N MCULE-7341432132 [1,1,0,0,0,0|2,0,0]=4 1993 B5R0.5 C[C@H](N)C(=O)N MCULE-7556063213 [1,1,0,0,0,0|2,0,0]=4 1994 B5R0.5 C[C@H](N)C(=O)N MCULE-8320991932 [1,1,0,0,0,0|2,0,0]=4 1995 B5R0.5 C[C@H](N)C(=O)N MCULE-8491573930 [1,1,0,0,0,0|2,0,0]=4 1996 B5R0.5 C[C@H](N)C(=O)O MCULE-4916719758 [1,1,0,0,0,0|1,0,0]=3 1997 B5R0.5 C[C@H](N)C(=O)O MCULE-5261590548 [1,1,0,0,0,0|1,0,0]=3 1998 B5R0.5 C[C@H](N)C(=O)O MCULE-7791919887 [1,1,0,0,0,0|1,0,0]=3 1999 B5R0.5 C[C@H](N)C(=O)O MCULE-8724854497 [1,1,0,0,0,0|1,0,0]=3 2000 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-6389040758 [1,1,0,0,0,0|1,0,1]=4 2001 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-7956913866 [1,1,0,0,0,0|1,0,1]=4 2002 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1340338147 [1,1,0,0,0,0|1,0,1]=4 2003 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1738016964 [1,1,0,0,0,0|1,0,1]=4 2004 B5R0.5 C[C@H](N)[C@H](C)O MCULE-2254798251 [1,1,0,0,0,0|1,0,1]=4 2005 B5R0.5 C[C@H](N)[C@H](C)O MCULE-7688101680 [1,1,0,0,0,0|1,0,1]=4 2006 B5R0.5 C[C@H](O)C(=O)N MCULE-8400190365 [1,1,0,0,0,0|1,0,0]=3 2007 B5R0.5 C[C@H](O)C(=O)O MCULE-5695391344 [1,1,0,0,0,0|0,0,0]=2 2008 B5R0.5 C[C@H](O)C(=O)O MCULE-8864689875 [1,1,0,0,0,0|0,0,0]=2 2009 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-1034285072 [1,1,0,0,0,0|0,0,1]=3 2010 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-3598405830 [1,1,0,0,0,0|0,0,1]=3 2011 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-7525689298 [1,1,0,0,0,0|0,0,1]=3 2012 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8057429776 [1,1,0,0,0,0|0,0,1]=3 2013 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8729310894 [1,1,0,0,0,0|0,0,1]=3 2014 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-3776841970 [1,1,0,0,0,0|1,0,1]=4 2015 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-4906999918 [1,1,0,0,0,0|1,0,1]=4 2016 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5860404631 [1,1,0,0,0,0|1,0,1]=4 2017 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5888789996 [1,1,0,0,0,0|1,0,1]=4 2018 B5R0.5 C[C@H](O)[C@@H](C)O MCULE-8389904530 [1,1,0,0,0,0|0,0,2]=4 2019 B5R0.5 C[C@H](O)[C@H](C)O MCULE-8448870055 [1,1,0,0,0,0|0,0,2]=4 2020 B5R0.5 C[C@H](O)[C@H](C)O MCULE-9615630900 [1,1,0,0,0,0|0,0,2]=4 2021 B5R0.5 C[C@H](S)[C@@H](C)O MCULE-3347141817 [1,1,0,0,0,0|0,1,1]=4 2022 B5R0.5 NC(=O)C(=O)O MCULE-4442165428 [1,1,0,0,0,0|0,0,2]=4 2023 B5R0.5 NC(=O)C(Cl)Br MCULE-9082770089 [1,1,0,0,0,0|2,0,0]=4 2024 B5R0.5 NC(=O)C(Cl)Cl MCULE-3389337354 [1,1,0,0,0,0|2,0,0]=4 2025 B5R0.5 NC(=O)C(F)Br MCULE-8795303515 [1,1,0,0,0,0|2,0,0]=4 2026 B5R0.5 NC(=O)C(F)Cl MCULE-4267127037 [1,1,0,0,0,0|2,0,0]=4 2027 B5R0.5 NC(=O)C(F)F MCULE-7881392368 [1,1,0,0,0,0|2,0,0]=4 2028 B5R0.5 NC(=O)C(F)I MCULE-6067421301 [1,1,0,0,0,0|2,0,0]=4 2029 B5R0.5 NC(O)C(=O)O MCULE-6546070388 [1,1,0,0,0,0|0,0,0]=2 2030 B5R0.5 O=C(Cl)C(Cl)Cl MCULE-2883143305 [1,1,0,0,0,0|2,0,0]=4 2031 B5R0.5 O=C(Cl)C(F)Cl MCULE-1579940277 [1,1,0,0,0,0|2,0,0]=4 2032 B5R0.5 O=C(Cl)C(F)F MCULE-6700400389 [1,1,0,0,0,0|2,0,0]=4 2033 B5R0.5 O=C(F)C(F)F MCULE-6722746663 [1,1,0,0,0,0|2,0,0]=4 2034 B5R0.5 O=C(O)C(=O)O MCULE-2859436444 [1,1,0,0,0,0|0,0,1]=3 2035 B5R0.5 O=C(O)C(=O)O MCULE-3054574273 [1,1,0,0,0,0|0,0,1]=3 2036 B5R0.5 O=C(O)C(=O)O MCULE-4285591204 [1,1,0,0,0,0|0,0,1]=3 2037 B5R0.5 O=C(O)C(=O)O MCULE-4461843798 [1,1,0,0,0,0|0,0,1]=3 2038 B5R0.5 O=C(O)C(=O)O MCULE-6031758101 [1,1,0,0,0,0|0,0,1]=3 2039 B5R0.5 O=C(O)C(=O)O MCULE-6647815245 [1,1,0,0,0,0|0,0,1]=3 2040 B5R0.5 O=C(O)C(=O)O MCULE-7895971003 [1,1,0,0,0,0|0,0,1]=3 2041 B5R0.5 O=C(O)C(=O)O MCULE-8046063377 [1,1,0,0,0,0|0,0,1]=3 2042 B5R0.5 O=C(O)C(=O)O MCULE-8198551041 [1,1,0,0,0,0|0,0,1]=3 2043 B5R0.5 O=C(O)C(=O)O MCULE-8472527874 [1,1,0,0,0,0|0,0,1]=3 2044 B5R0.5 O=C(O)C(=O)O MCULE-9701145416 [1,1,0,0,0,0|0,0,1]=3 2045 B5R0.5 O=C(O)C(Br)Br MCULE-4908900588 [1,1,0,0,0,0|1,0,0]=3 2046 B5R0.5 O=C(O)C(Cl)Br MCULE-4569127340 [1,1,0,0,0,0|1,0,0]=3 2047 B5R0.5 O=C(O)C(Cl)Cl MCULE-1246638159 [1,1,0,0,0,0|1,0,0]=3 2048 B5R0.5 O=C(O)C(F)Br MCULE-5639771935 [1,1,0,0,0,0|1,0,0]=3 2049 B5R0.5 O=C(O)C(F)Cl MCULE-8791727704 [1,1,0,0,0,0|1,0,0]=3 2050 B5R0.5 O=C(O)C(F)F MCULE-9791449975 [1,1,0,0,0,0|1,0,0]=3 2051 B5R0.5 O=C(O)C(F)I MCULE-2596137309 [1,1,0,0,0,0|1,0,0]=3 2052 B5R0.5 O=C(O)C(O)O MCULE-8045135900 [1,1,0,0,0,0|0,0,0]=2 2053 B5R0.5 O=C(O)[C@@H](F)Cl MCULE-9934674808 [1,1,0,0,0,0|1,0,0]=3 2054 B5R0.5 O=C(O)[C@H](F)Cl MCULE-8184552815 [1,1,0,0,0,0|1,0,0]=3 2055 B5R0.5 O=C([O-])C(F)Br MCULE-3214706920 [1,1,0,0,0,0|1,0,1]=4 2056 B5R0.5 O=C([O-])C(F)Cl MCULE-6121365584 [1,1,0,0,0,0|1,0,1]=4 2057 B5R0.5 O=C([O-])C(F)I MCULE-5263796115 [1,1,0,0,0,0|1,0,1]=4 2058 B5R0.5 O=S(O)C(F)F MCULE-6110273161 [1,1,0,0,0,0|2,0,0]=4 2059 B5R0.5 [C@@H](C)(O)C(=O)N MCULE-6953360641 [1,1,0,0,0,0|1,0,0]=3 2060 B5R0.2 BrC/C=C/CBr MCULE-9004545331 [1,1,0,0,0,0|2,0,0]=4 2061 B5R0.2 BrCC=CCBr MCULE-4240565660 [1,1,0,0,0,0|2,0,0]=4 2062 B5R0.2 C#CCCCO MCULE-6360852809 [1,1,0,0,0,0|1,0,1]=4 2063 B5R0.2 C(=CCCl)CN MCULE-8092426171 [1,1,0,0,0,0|2,0,0]=4 2064 B5R0.2 C(=CCCl)CN MCULE-9706120646 [1,1,0,0,0,0|2,0,0]=4 2065 B5R0.2 C(=C\CCl)\CN MCULE-3474871402 [1,1,0,0,0,0|2,0,0]=4 2066 B5R0.2 C/C=C/CCO MCULE-3952855392 [1,1,0,0,0,0|1,0,1]=4 2067 B5R0.2 C=C=CCCO MCULE-1054355649 [1,1,0,0,0,0|1,0,1]=4 2068 B5R0.2 C=CCCCO MCULE-5946342321 [1,1,0,0,0,0|1,0,1]=4 2069 B5R0.2 CC/C=C/CC MCULE-6762040186 [1,1,0,0,0,0|2,0,0]=4 2070 B5R0.2 CC/C=C\CC MCULE-9418110460 [1,1,0,0,0,0|2,0,0]=4 2071 B5R0.2 CC/C=C\CO MCULE-5480473249 [1,1,0,0,0,0|1,0,0]=3 2072 B5R0.2 CC=CCCO MCULE-4302367089 [1,1,0,0,0,0|1,0,1]=4 2073 B5R0.2 CCC#CCO MCULE-8633965917 [1,1,0,0,0,0|1,0,1]=4 2074 B5R0.2 CCC=CCBr MCULE-5326763881 [1,1,0,0,0,0|2,0,0]=4 2075 B5R0.2 CCC=CCC MCULE-5435957422 [1,1,0,0,0,0|2,0,0]=4 2076 B5R0.2 CCC=CCO MCULE-5633399984 [1,1,0,0,0,0|1,0,0]=3 2077 B5R0.2 CCCC=NO MCULE-7364375780 [1,1,0,0,0,0|2,0,0]=4 2078 B5R0.2 CCCCCO MCULE-8714292632 [1,1,0,0,0,0|1,0,1]=4 2079 B5R0.2 CCCCNO MCULE-1911206569 [1,1,0,0,0,0|1,0,1]=4 2080 B5R0.2 CCCCNO MCULE-3820646216 [1,1,0,0,0,0|1,0,1]=4 2081 B5R0.2 CCCCOC MCULE-9814272675 [1,1,0,0,0,0|1,0,1]=4 2082 B5R0.2 CCCCON MCULE-7582349983 [1,1,0,0,0,0|1,0,1]=4 2083 B5R0.2 CCCCON MCULE-8175627798 [1,1,0,0,0,0|1,0,1]=4 2084 B5R0.2 CCNCCO MCULE-2537734730 [1,1,0,0,0,0|1,0,1]=4 2085 B5R0.2 CCNCCO MCULE-3738714907 [1,1,0,0,0,0|1,0,1]=4 2086 B5R0.2 CCOCCO MCULE-4311513289 [1,1,0,0,0,0|1,0,1]=4 2087 B5R0.2 CCSCCO MCULE-3557086162 [1,1,0,0,0,0|1,0,1]=4 2088 B5R0.2 CNCCCO MCULE-9530478547 [1,1,0,0,0,0|1,0,1]=4 2089 B5R0.2 COCCCBr MCULE-6489536401 [1,1,0,0,0,0|1,0,1]=4 2090 B5R0.2 COCCCCl MCULE-9192274624 [1,1,0,0,0,0|1,0,1]=4 2091 B5R0.2 COCCCF MCULE-5055725246 [1,1,0,0,0,0|1,0,1]=4 2092 B5R0.2 COCCCI MCULE-9111605439 [1,1,0,0,0,0|1,0,1]=4 2093 B5R0.2 COCCCN MCULE-1421362990 [1,1,0,0,0,0|1,0,1]=4 2094 B5R0.2 COCCCN MCULE-4783132205 [1,1,0,0,0,0|1,0,1]=4 2095 B5R0.2 COCCCO MCULE-4041418048 [1,1,0,0,0,0|0,0,1]=3 2096 B5R0.2 COCCCS MCULE-2371333731 [1,1,0,0,0,0|0,1,1]=4 2097 B5R0.2 CONCCO MCULE-9787830121 [1,1,0,0,0,0|1,0,1]=4 2098 B5R0.2 CSCCCO MCULE-9232413185 [1,1,0,0,0,0|0,1,1]=4 2099 B5R0.2 ClC/C=C/CCl MCULE-3586653669 [1,1,0,0,0,0|2,0,0]=4 2100 B5R0.2 ClC/C=C\CCl MCULE-9193094097 [1,1,0,0,0,0|2,0,0]=4 2101 B5R0.2 ClCC=CCCl MCULE-9190878082 [1,1,0,0,0,0|2,0,0]=4 2102 B5R0.2 N#CCCCO MCULE-2108386837 [1,1,0,0,0,0|1,0,1]=4 2103 B5R0.2 NC/C=C/CN MCULE-3194321905 [1,1,0,0,0,0|2,0,0]=4 2104 B5R0.2 NC/C=C/CN MCULE-8357316852 [1,1,0,0,0,0|2,0,0]=4 2105 B5R0.2 NC/C=C\CCl MCULE-7895966955 [1,1,0,0,0,0|2,0,0]=4 2106 B5R0.2 NC/C=C\CN MCULE-6310541400 [1,1,0,0,0,0|2,0,0]=4 2107 B5R0.2 NC/C=C\CN MCULE-8765736519 [1,1,0,0,0,0|2,0,0]=4 2108 B5R0.2 NCC#CCO MCULE-4844677613 [1,1,0,0,0,0|1,0,1]=4 2109 B5R0.2 NCC#CCO MCULE-9095239812 [1,1,0,0,0,0|1,0,1]=4 2110 B5R0.2 NCC=CCN MCULE-3768809289 [1,1,0,0,0,0|2,0,0]=4 2111 B5R0.2 NCC=CCN MCULE-4004493343 [1,1,0,0,0,0|2,0,0]=4 2112 B5R0.2 NCC=CCN MCULE-6780035248 [1,1,0,0,0,0|2,0,0]=4 2113 B5R0.2 NCC=CCO MCULE-4993379992 [1,1,0,0,0,0|1,0,0]=3 2114 B5R0.2 NCCCCO MCULE-7395674091 [1,1,0,0,0,0|1,0,1]=4 2115 B5R0.2 NCCCON MCULE-1071170242 [1,1,0,0,0,0|1,0,1]=4 2116 B5R0.2 NCCCON MCULE-7767315563 [1,1,0,0,0,0|1,0,1]=4 2117 B5R0.2 NNCCCO MCULE-5557482626 [1,1,0,0,0,0|1,0,1]=4 2118 B5R0.2 NNCCCO MCULE-7351853032 [1,1,0,0,0,0|1,0,1]=4 2119 B5R0.2 NNCCCO MCULE-7919314403 [1,1,0,0,0,0|1,0,1]=4 2120 B5R0.2 NOC/C=C/Cl MCULE-3781481075 [1,1,0,0,0,0|1,0,1]=4 2121 B5R0.2 NOC/C=C/Cl MCULE-8874475488 [1,1,0,0,0,0|1,0,1]=4 2122 B5R0.2 NOCC=CCl MCULE-5233830243 [1,1,0,0,0,0|1,0,1]=4 2123 B5R0.2 NOCC=CCl MCULE-7677577759 [1,1,0,0,0,0|1,0,1]=4 2124 B5R0.2 NOCCCO MCULE-1072312935 [1,1,0,0,0,0|0,0,1]=3 2125 B5R0.2 NOCCCO MCULE-3715520109 [1,1,0,0,0,0|0,0,1]=3 2126 B5R0.2 NOCCCS MCULE-2063976508 [1,1,0,0,0,0|0,1,1]=4 2127 B5R0.2 NOCCCS MCULE-3464018652 [1,1,0,0,0,0|0,1,1]=4 2128 B5R0.2 O/N=C/C=N/O MCULE-6032089277 [1,1,0,0,0,0|1,0,1]=4 2129 B5R0.2 O=CCCCO MCULE-8728420992 [1,1,0,0,0,0|0,0,2]=4 2130 B5R0.2 OC/C=C/CCl MCULE-4378785113 [1,1,0,0,0,0|1,0,0]=3 2131 B5R0.2 OC/C=C/CO MCULE-4752272005 [1,1,0,0,0,0|0,0,0]=2 2132 B5R0.2 OC/C=C\CO MCULE-2695577582 [1,1,0,0,0,0|0,0,0]=2 2133 B5R0.2 OC=CCCBr MCULE-3964604828 [1,1,0,0,0,0|1,0,1]=4 2134 B5R0.2 OC=CCCBr MCULE-5728835735 [1,1,0,0,0,0|1,0,1]=4 2135 B5R0.2 OCC#CCBr MCULE-1662147427 [1,1,0,0,0,0|1,0,1]=4 2136 B5R0.2 OCC#CCCl MCULE-9445494949 [1,1,0,0,0,0|1,0,1]=4 2137 B5R0.2 OCC#CCO MCULE-2650636766 [1,1,0,0,0,0|0,0,1]=3 2138 B5R0.2 OCC=CCCl MCULE-7597942117 [1,1,0,0,0,0|1,0,0]=3 2139 B5R0.2 OCC=CCO MCULE-9559211408 [1,1,0,0,0,0|0,0,0]=2 2140 B5R0.2 OCCCCBr MCULE-9231591925 [1,1,0,0,0,0|1,0,1]=4 2141 B5R0.2 OCCCCCl MCULE-3507644812 [1,1,0,0,0,0|1,0,1]=4 2142 B5R0.2 OCCCCF MCULE-9242285588 [1,1,0,0,0,0|1,0,1]=4 2143 B5R0.2 OCCCCI MCULE-8723720522 [1,1,0,0,0,0|1,0,1]=4 2144 B5R0.2 OCCCCO MCULE-2010022287 [1,1,0,0,0,0|0,0,1]=3 2145 B5R0.2 OCCCCO MCULE-6551106098 [1,1,0,0,0,0|0,0,1]=3 2146 B5R0.2 OCCCCS MCULE-8169490949 [1,1,0,0,0,0|0,1,1]=4 2147 B5R0.2 OCCNCO MCULE-2141033453 [1,1,0,0,0,0|0,0,1]=3 2148 B5R0.2 ON=CC=NO MCULE-4643147888 [1,1,0,0,0,0|1,0,1]=4 2149 B7R0.2 CC(C)/C=C(\F)/CO MCULE-5089231546 [0,2,0,0,0,0|2,0,0]=4 2150 B7R0.2 CC(C)CC(=O)CBr MCULE-3556695745 [0,2,0,0,0,0|2,0,0]=4 2151 B7R0.2 CC(C)CC(=O)CCl MCULE-6858533367 [0,2,0,0,0,0|2,0,0]=4 2152 B7R0.2 CC(C)CC(=O)CN MCULE-2435223768 [0,2,0,0,0,0|2,0,0]=4 2153 B7R0.2 CC(C)CC(=O)CN MCULE-7131454463 [0,2,0,0,0,0|2,0,0]=4 2154 B7R0.2 CC(C)NC(=O)CBr MCULE-1272363222 [0,2,0,0,0,0|2,0,0]=4 2155 B7R0.2 CC(C)NC(=O)CCl MCULE-8342964960 [0,2,0,0,0,0|2,0,0]=4 2156 B7R0.2 CC(C)NC(=O)CI MCULE-8316056040 [0,2,0,0,0,0|2,0,0]=4 2157 B7R0.2 CC(C)NC(=O)CN MCULE-7188824856 [0,2,0,0,0,0|2,0,0]=4 2158 B7R0.2 CC(C)NC(=O)CN MCULE-8867435369 [0,2,0,0,0,0|2,0,0]=4 2159 B7R0.2 CC(C)NC(=O)CO MCULE-5386700783 [0,2,0,0,0,0|1,0,0]=3 2160 B7R0.2 CC(C)OC(=O)CBr MCULE-1610339208 [0,2,0,0,0,0|2,0,0]=4 2161 B7R0.2 CC(C)OC(=O)CCl MCULE-3017211046 [0,2,0,0,0,0|2,0,0]=4 2162 B7R0.2 CC(C)OC(=O)CN MCULE-4475626262 [0,2,0,0,0,0|2,0,0]=4 2163 B7R0.2 CC(C)OC(=O)CN MCULE-5696337645 [0,2,0,0,0,0|2,0,0]=4 2164 B7R0.2 CC(C)OC(=O)CO MCULE-4694316703 [0,2,0,0,0,0|1,0,0]=3 2165 B7R0.2 CC(C)OC(=O)CS MCULE-5298940210 [0,2,0,0,0,0|1,1,0]=4 2166 B7R0.2 CC(O)CC(=O)NN MCULE-2521784411 [0,2,0,0,0,0|2,0,0]=4 2167 B7R0.2 CCC(=O)CC(=O)C MCULE-1892470405 [0,2,0,0,0,0|1,0,1]=4 2168 B7R0.2 CCC(=O)CC(=O)O MCULE-1083768149 [0,2,0,0,0,0|1,0,0]=3 2169 B7R0.2 CCC(=O)CC(C)C MCULE-8378320990 [0,2,0,0,0,0|2,0,0]=4 2170 B7R0.2 CCC(=O)NC(C)C MCULE-3565002235 [0,2,0,0,0,0|2,0,0]=4 2171 B7R0.2 CCC(=O)OC(C)C MCULE-6546381101 [0,2,0,0,0,0|2,0,0]=4 2172 B7R0.2 CCS(=O)CC(=O)O MCULE-5648298475 [0,2,0,0,0,0|2,0,0]=4 2173 B7R0.2 CNC(=O)CC(=O)O MCULE-3506871336 [0,2,0,0,0,0|2,0,0]=4 2174 B7R0.2 COC(=O)CC(=O)O MCULE-7983457925 [0,2,0,0,0,0|2,0,0]=4 2175 B7R0.2 COC(=O)CC(C)O MCULE-7542131760 [0,2,0,0,0,0|2,0,0]=4 2176 B7R0.2 COC(=O)CC(C)O MCULE-7559608260 [0,2,0,0,0,0|2,0,0]=4 2177 B7R0.2 COC(=O)C[C@@H](C)O MCULE-1647366037 [0,2,0,0,0,0|2,0,0]=4 2178 B7R0.2 COC(=O)C[C@@H](C)O MCULE-7832771936 [0,2,0,0,0,0|2,0,0]=4 2179 B7R0.2 COC(=O)C[C@H](C)O MCULE-5154734951 [0,2,0,0,0,0|2,0,0]=4 2180 B7R0.2 COC(=O)C[C@H](C)O MCULE-7031738180 [0,2,0,0,0,0|2,0,0]=4 2181 B7R0.2 N/C(=N/O)/CC(=O)O MCULE-5236282846 [0,2,0,0,0,0|2,0,0]=4 2182 B7R0.2 N=C(N)NC(=O)CO MCULE-1435627041 [0,2,0,0,0,0|1,0,1]=4 2183 B7R0.2 NC(CO)CC(=O)O MCULE-4749383822 [0,2,0,0,0,0|1,0,1]=4 2184 B7R0.2 NC(CO)CC(=O)O MCULE-7973334774 [0,2,0,0,0,0|1,0,1]=4 2185 B7R0.2 NC(CO)CC(=O)O MCULE-8406665261 [0,2,0,0,0,0|1,0,1]=4 2186 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-1773927420 [0,2,0,0,0,0|1,0,1]=4 2187 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-2797951743 [0,2,0,0,0,0|1,0,1]=4 2188 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-3839766977 [0,2,0,0,0,0|1,0,1]=4 2189 B7R0.2 N[C@H](CO)CC(=O)O MCULE-4130106630 [0,2,0,0,0,0|1,0,1]=4 2190 B7R0.2 O=C(Br)CC(=O)CBr MCULE-5776576043 [0,2,0,0,0,0|1,0,1]=4 2191 B7R0.2 O=C(Cl)CC(=O)CCl MCULE-6416318811 [0,2,0,0,0,0|1,0,1]=4 2192 B7R0.2 O=C(O)CC(=O)CCl MCULE-9671015150 [0,2,0,0,0,0|1,0,0]=3 2193 B7R0.2 O=C(O)CC(=O)CO MCULE-2224143705 [0,2,0,0,0,0|0,0,0]=2 2194 B7R0.2 O=C(O)CC(O)CO MCULE-2851149196 [0,2,0,0,0,0|0,0,2]=4 2195 B7R0.2 O=C(O)C[C@H](O)CO MCULE-5671818548 [0,2,0,0,0,0|0,0,2]=4 2196 B7R0.3 C#CCNC(=O)CBr MCULE-4982494323 [0,2,0,0,0,0|2,0,0]=4 2197 B7R0.3 C#CCNC(=O)CC MCULE-2258533582 [0,2,0,0,0,0|2,0,0]=4 2198 B7R0.3 C#CCNC(=O)CCl MCULE-8014837574 [0,2,0,0,0,0|2,0,0]=4 2199 B7R0.3 C#CCNC(=O)CI MCULE-1660068128 [0,2,0,0,0,0|2,0,0]=4 2200 B7R0.3 C#CCNC(=O)CN MCULE-4492178837 [0,2,0,0,0,0|2,0,0]=4 2201 B7R0.3 C#CCNC(=O)CN MCULE-7672614770 [0,2,0,0,0,0|2,0,0]=4 2202 B7R0.3 C#CCOC(=O)CC MCULE-9368945481 [0,2,0,0,0,0|2,0,0]=4 2203 B7R0.3 C=C(CCl)OCOC MCULE-3049043061 [0,2,0,0,0,0|2,0,0]=4 2204 B7R0.3 C=CC(=O)NCCO MCULE-2036150536 [0,2,0,0,0,0|1,0,1]=4 2205 B7R0.3 C=CC(=O)OCCO MCULE-3147939665 [0,2,0,0,0,0|1,0,1]=4 2206 B7R0.3 C=CCCC(=O)CBr MCULE-8443541398 [0,2,0,0,0,0|2,0,0]=4 2207 B7R0.3 C=CCCC(=O)CC MCULE-7933484898 [0,2,0,0,0,0|2,0,0]=4 2208 B7R0.3 C=CCCC(=O)CCl MCULE-4669619111 [0,2,0,0,0,0|2,0,0]=4 2209 B7R0.3 C=CCNC(=O)CBr MCULE-5894560132 [0,2,0,0,0,0|2,0,0]=4 2210 B7R0.3 C=CCNC(=O)CCl MCULE-4830676670 [0,2,0,0,0,0|2,0,0]=4 2211 B7R0.3 C=CCNC(=O)CN MCULE-8221456161 [0,2,0,0,0,0|2,0,0]=4 2212 B7R0.3 C=CCNC(=O)CN MCULE-9764331326 [0,2,0,0,0,0|2,0,0]=4 2213 B7R0.3 C=CCNC(=O)CO MCULE-1240234665 [0,2,0,0,0,0|1,0,0]=3 2214 B7R0.3 C=CCNC(=O)CS MCULE-1040670812 [0,2,0,0,0,0|1,1,0]=4 2215 B7R0.3 C=CCOC(=O)CBr MCULE-1915528510 [0,2,0,0,0,0|2,0,0]=4 2216 B7R0.3 C=CCOC(=O)CCl MCULE-4722834512 [0,2,0,0,0,0|2,0,0]=4 2217 B7R0.3 C=CCOC(=O)CI MCULE-1155914135 [0,2,0,0,0,0|2,0,0]=4 2218 B7R0.3 C=CCOC(=O)CN MCULE-2053601318 [0,2,0,0,0,0|2,0,0]=4 2219 B7R0.3 C=CCOC(=O)CN MCULE-8513191813 [0,2,0,0,0,0|2,0,0]=4 2220 B7R0.3 C=CCOC(=O)CS MCULE-3191036289 [0,2,0,0,0,0|1,1,0]=4 2221 B7R0.3 CC(CO)CCCO MCULE-8589885622 [0,2,0,0,0,0|1,0,1]=4 2222 B7R0.3 CC(CO)NCCO MCULE-5180763491 [0,2,0,0,0,0|1,0,1]=4 2223 B7R0.3 CCC(=O)CCCBr MCULE-3298679210 [0,2,0,0,0,0|2,0,0]=4 2224 B7R0.3 CCC(=O)CCCCl MCULE-3397599793 [0,2,0,0,0,0|2,0,0]=4 2225 B7R0.3 CCC(=O)NCCN MCULE-3384406070 [0,2,0,0,0,0|2,0,0]=4 2226 B7R0.3 CCC(=O)NCCN MCULE-3992696592 [0,2,0,0,0,0|2,0,0]=4 2227 B7R0.3 CCC(=O)NCCN MCULE-4556462042 [0,2,0,0,0,0|2,0,0]=4 2228 B7R0.3 CCC(=O)NCCO MCULE-7351790148 [0,2,0,0,0,0|1,0,0]=3 2229 B7R0.3 CCC(=O)OCCCl MCULE-7825392065 [0,2,0,0,0,0|2,0,0]=4 2230 B7R0.3 CCC(=O)OCCO MCULE-6019276519 [0,2,0,0,0,0|1,0,0]=3 2231 B7R0.3 CCC(=O)OCOC MCULE-8101176829 [0,2,0,0,0,0|1,0,0]=3 2232 B7R0.3 CCCCC(=O)CBr MCULE-5866288227 [0,2,0,0,0,0|2,0,0]=4 2233 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [0,2,0,0,0,0|2,0,0]=4 2234 B7R0.3 CCCCC(=O)CCl MCULE-9673190063 [0,2,0,0,0,0|2,0,0]=4 2235 B7R0.3 CCCNC(=O)CBr MCULE-3357000060 [0,2,0,0,0,0|2,0,0]=4 2236 B7R0.3 CCCNC(=O)CCl MCULE-3171078913 [0,2,0,0,0,0|2,0,0]=4 2237 B7R0.3 CCCNC(=O)CN MCULE-2964958967 [0,2,0,0,0,0|2,0,0]=4 2238 B7R0.3 CCCNC(=O)CN MCULE-4880764199 [0,2,0,0,0,0|2,0,0]=4 2239 B7R0.3 CCCOC(=O)CBr MCULE-9392658897 [0,2,0,0,0,0|2,0,0]=4 2240 B7R0.3 CCCOC(=O)CC MCULE-2749425161 [0,2,0,0,0,0|2,0,0]=4 2241 B7R0.3 CCCOC(=O)CCl MCULE-4900509903 [0,2,0,0,0,0|2,0,0]=4 2242 B7R0.3 CCCOC(=O)CN MCULE-5016724090 [0,2,0,0,0,0|2,0,0]=4 2243 B7R0.3 CCCOC(=O)CN MCULE-9899563764 [0,2,0,0,0,0|2,0,0]=4 2244 B7R0.3 CCCOC(=O)CS MCULE-7918412380 [0,2,0,0,0,0|1,1,0]=4 2245 B7R0.3 CCOCC(=O)CCl MCULE-3495077500 [0,2,0,0,0,0|1,0,0]=3 2246 B7R0.3 CCOCC(=O)NN MCULE-1157330147 [0,2,0,0,0,0|2,0,0]=4 2247 B7R0.3 CCOCC(=O)NN MCULE-3371253482 [0,2,0,0,0,0|2,0,0]=4 2248 B7R0.3 CCOCC(=O)OC MCULE-5158396979 [0,2,0,0,0,0|2,0,0]=4 2249 B7R0.3 CCOCC(C)CO MCULE-6831759423 [0,2,0,0,0,0|1,0,1]=4 2250 B7R0.3 CCOCC(N)CO MCULE-8546500751 [0,2,0,0,0,0|1,0,1]=4 2251 B7R0.3 CCOCC(O)CO MCULE-2728952355 [0,2,0,0,0,0|0,0,2]=4 2252 B7R0.3 CCONC(=O)CN MCULE-8014418978 [0,2,0,0,0,0|2,0,0]=4 2253 B7R0.3 CCONC(=O)CN MCULE-9229677559 [0,2,0,0,0,0|2,0,0]=4 2254 B7R0.3 CNC(=O)CCCO MCULE-2592655912 [0,2,0,0,0,0|2,0,0]=4 2255 B7R0.3 CNC(=O)CCOC MCULE-1263122933 [0,2,0,0,0,0|2,0,0]=4 2256 B7R0.3 CNC(=O)NCCO MCULE-7936045962 [0,2,0,0,0,0|2,0,0]=4 2257 B7R0.3 CNC(=O)OCCO MCULE-7181085118 [0,2,0,0,0,0|2,0,0]=4 2258 B7R0.3 CNOCC(=O)OC MCULE-1491246414 [0,2,0,0,0,0|2,0,0]=4 2259 B7R0.3 CNOCC(=O)OC MCULE-2119135006 [0,2,0,0,0,0|2,0,0]=4 2260 B7R0.3 COC(=O)C#CCO MCULE-5683806193 [0,2,0,0,0,0|2,0,0]=4 2261 B7R0.3 COC(=O)CCCO MCULE-6149839873 [0,2,0,0,0,0|2,0,0]=4 2262 B7R0.3 COC(=O)NCCO MCULE-7141835204 [0,2,0,0,0,0|2,0,0]=4 2263 B7R0.3 COCC/C(=N\O)/N MCULE-3175892655 [0,2,0,0,0,0|2,0,0]=4 2264 B7R0.3 COCC/C(=N\O)/N MCULE-8002911611 [0,2,0,0,0,0|2,0,0]=4 2265 B7R0.3 COCCC(=O)CCl MCULE-2918704994 [0,2,0,0,0,0|1,0,0]=3 2266 B7R0.3 COCCC(=O)NN MCULE-6895114863 [0,2,0,0,0,0|2,0,0]=4 2267 B7R0.3 COCCC(=O)OC MCULE-5918489580 [0,2,0,0,0,0|2,0,0]=4 2268 B7R0.3 COCCC(N)CO MCULE-9758817920 [0,2,0,0,0,0|1,0,1]=4 2269 B7R0.3 COCOC(C)CO MCULE-5033492685 [0,2,0,0,0,0|1,0,1]=4 2270 B7R0.3 COCO[C@@H](C)CO MCULE-2279257941 [0,2,0,0,0,0|1,0,1]=4 2271 B7R0.3 COCO[C@H](C)CO MCULE-6639618074 [0,2,0,0,0,0|1,0,1]=4 2272 B7R0.3 COCO[C@H](C)CO MCULE-9421136678 [0,2,0,0,0,0|1,0,1]=4 2273 B7R0.3 N#CCNC(=O)CCl MCULE-3245517796 [0,2,0,0,0,0|2,0,0]=4 2274 B7R0.3 N#CCNC(=O)CN MCULE-1672566609 [0,2,0,0,0,0|2,0,0]=4 2275 B7R0.3 N#CCNC(=O)CN MCULE-7737504322 [0,2,0,0,0,0|2,0,0]=4 2276 B7R0.3 NCC(=O)NCCF MCULE-1969796129 [0,2,0,0,0,0|2,0,0]=4 2277 B7R0.3 NCC(=O)NCCF MCULE-9924478230 [0,2,0,0,0,0|2,0,0]=4 2278 B7R0.3 NCC(=O)NCCO MCULE-3809178129 [0,2,0,0,0,0|1,0,0]=3 2279 B7R0.3 NCC(=O)NCCO MCULE-7057019123 [0,2,0,0,0,0|1,0,0]=3 2280 B7R0.3 NCC(=O)OCCCl MCULE-7924059164 [0,2,0,0,0,0|2,0,0]=4 2281 B7R0.3 NCC(=O)OCCCl MCULE-9260214783 [0,2,0,0,0,0|2,0,0]=4 2282 B7R0.3 NCCNC(=O)CCl MCULE-6059411085 [0,2,0,0,0,0|2,0,0]=4 2283 B7R0.3 NCCNC(=O)CCl MCULE-7545329795 [0,2,0,0,0,0|2,0,0]=4 2284 B7R0.3 NNC(=O)CCCO MCULE-4131007358 [0,2,0,0,0,0|2,0,0]=4 2285 B7R0.3 NNC(=O)OCCO MCULE-9375766063 [0,2,0,0,0,0|2,0,0]=4 2286 B7R0.3 O=C(CCl)/N=C/NO MCULE-8588086105 [0,2,0,0,0,0|1,0,1]=4 2287 B7R0.3 O=C(CCl)CCCCl MCULE-2362491395 [0,2,0,0,0,0|2,0,0]=4 2288 B7R0.3 O=C(CCl)NCCCl MCULE-2029189763 [0,2,0,0,0,0|2,0,0]=4 2289 B7R0.3 O=C(CCl)NCCO MCULE-2803332455 [0,2,0,0,0,0|1,0,0]=3 2290 B7R0.3 O=C(CCl)OCCCl MCULE-7706105725 [0,2,0,0,0,0|2,0,0]=4 2291 B7R0.3 O=C(CO)NCCO MCULE-8933511918 [0,2,0,0,0,0|0,0,0]=2 2292 B7R0.3 OCCCC(O)CO MCULE-3529953491 [0,2,0,0,0,0|0,0,2]=4 2293 B7R0.5 C=C(C)C(=O)NCO MCULE-2758821094 [0,2,0,0,0,0|1,0,1]=4 2294 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [0,2,0,0,0,0|1,0,1]=4 2295 B7R0.5 C=C(COC)C(=O)O MCULE-8964616960 [0,2,0,0,0,0|1,0,1]=4 2296 B7R0.5 CC(C)C(=O)CC#N MCULE-1573579728 [0,2,0,0,0,0|2,0,0]=4 2297 B7R0.5 CC(C)C(=O)CCN MCULE-1638964690 [0,2,0,0,0,0|2,0,0]=4 2298 B7R0.5 CC(C)C(=O)CCN MCULE-5188027669 [0,2,0,0,0,0|2,0,0]=4 2299 B7R0.5 CC(C)C(=O)NCO MCULE-4279406951 [0,2,0,0,0,0|1,0,0]=3 2300 B7R0.5 CC(C)C(=O)OCBr MCULE-3276711258 [0,2,0,0,0,0|2,0,0]=4 2301 B7R0.5 CC(C)C(=O)OCCl MCULE-2226037128 [0,2,0,0,0,0|2,0,0]=4 2302 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [0,2,0,0,0,0|1,0,1]=4 2303 B7R0.5 CCCC(=O)C(C)Br MCULE-8743472868 [0,2,0,0,0,0|2,0,0]=4 2304 B7R0.5 CCCC(=O)C(C)C MCULE-7690543374 [0,2,0,0,0,0|2,0,0]=4 2305 B7R0.5 CCNC(=O)C(=O)O MCULE-1213485294 [0,2,0,0,0,0|1,0,1]=4 2306 B7R0.5 CCNC(=O)C(C)Br MCULE-4342500989 [0,2,0,0,0,0|2,0,0]=4 2307 B7R0.5 CCNC(=O)C(C)Cl MCULE-2094375104 [0,2,0,0,0,0|2,0,0]=4 2308 B7R0.5 CCNC(=O)C(C)N MCULE-7767946644 [0,2,0,0,0,0|2,0,0]=4 2309 B7R0.5 CCNC(=O)C(C)N MCULE-8324775088 [0,2,0,0,0,0|2,0,0]=4 2310 B7R0.5 CCNC(=O)C(C)N MCULE-9028977052 [0,2,0,0,0,0|2,0,0]=4 2311 B7R0.5 CCNC(=O)[C@H](C)N MCULE-1043080386 [0,2,0,0,0,0|2,0,0]=4 2312 B7R0.5 CCNC(=O)[C@H](C)O MCULE-9098995292 [0,2,0,0,0,0|1,0,0]=3 2313 B7R0.5 CCOC(=N)C(C)O MCULE-4906645723 [0,2,0,0,0,0|2,0,0]=4 2314 B7R0.5 CCOC(=N)C(C)O MCULE-6342692176 [0,2,0,0,0,0|2,0,0]=4 2315 B7R0.5 CCOC(=O)C(=O)O MCULE-2368024441 [0,2,0,0,0,0|1,0,1]=4 2316 B7R0.5 CCOC(=O)C(Br)Br MCULE-8701615311 [0,2,0,0,0,0|2,0,0]=4 2317 B7R0.5 CCOC(=O)C(C)Br MCULE-3184697988 [0,2,0,0,0,0|2,0,0]=4 2318 B7R0.5 CCOC(=O)C(C)C MCULE-7190269066 [0,2,0,0,0,0|2,0,0]=4 2319 B7R0.5 CCOC(=O)C(C)Cl MCULE-8192833024 [0,2,0,0,0,0|2,0,0]=4 2320 B7R0.5 CCOC(=O)C(C)F MCULE-5743308430 [0,2,0,0,0,0|2,0,0]=4 2321 B7R0.5 CCOC(=O)C(C)I MCULE-5895787216 [0,2,0,0,0,0|2,0,0]=4 2322 B7R0.5 CCOC(=O)C(C)N MCULE-1694144423 [0,2,0,0,0,0|2,0,0]=4 2323 B7R0.5 CCOC(=O)C(C)N MCULE-4073874506 [0,2,0,0,0,0|2,0,0]=4 2324 B7R0.5 CCOC(=O)C(C)N MCULE-4082731166 [0,2,0,0,0,0|2,0,0]=4 2325 B7R0.5 CCOC(=O)C(C)N MCULE-5175870607 [0,2,0,0,0,0|2,0,0]=4 2326 B7R0.5 CCOC(=O)C(C)O MCULE-8057202883 [0,2,0,0,0,0|1,0,0]=3 2327 B7R0.5 CCOC(=O)C(C)O MCULE-9679398205 [0,2,0,0,0,0|1,0,0]=3 2328 B7R0.5 CCOC(=O)C(C)S MCULE-7890942953 [0,2,0,0,0,0|1,1,0]=4 2329 B7R0.5 CCOC(=O)C(Cl)Cl MCULE-3838429635 [0,2,0,0,0,0|2,0,0]=4 2330 B7R0.5 CCOC(=O)C(F)Br MCULE-5661791694 [0,2,0,0,0,0|2,0,0]=4 2331 B7R0.5 CCOC(=O)C(F)Cl MCULE-4260692293 [0,2,0,0,0,0|2,0,0]=4 2332 B7R0.5 CCOC(=O)C(F)F MCULE-6388513707 [0,2,0,0,0,0|2,0,0]=4 2333 B7R0.5 CCOC(=O)C(F)I MCULE-4681224874 [0,2,0,0,0,0|2,0,0]=4 2334 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1032359164 [0,2,0,0,0,0|2,0,0]=4 2335 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1087923626 [0,2,0,0,0,0|2,0,0]=4 2336 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-1553164105 [0,2,0,0,0,0|2,0,0]=4 2337 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-2294196196 [0,2,0,0,0,0|2,0,0]=4 2338 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-4613491627 [0,2,0,0,0,0|2,0,0]=4 2339 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-8190900780 [0,2,0,0,0,0|2,0,0]=4 2340 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-3372948910 [0,2,0,0,0,0|1,0,0]=3 2341 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-5795033916 [0,2,0,0,0,0|1,0,0]=3 2342 B7R0.5 CCOC(=O)[C@H](C)F MCULE-3258014155 [0,2,0,0,0,0|2,0,0]=4 2343 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4397919899 [0,2,0,0,0,0|2,0,0]=4 2344 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4404274511 [0,2,0,0,0,0|2,0,0]=4 2345 B7R0.5 CCOC(=O)[C@H](C)N MCULE-7626045082 [0,2,0,0,0,0|2,0,0]=4 2346 B7R0.5 CCOC(=O)[C@H](C)N MCULE-8333235087 [0,2,0,0,0,0|2,0,0]=4 2347 B7R0.5 CCOC(=O)[C@H](C)O MCULE-4333545760 [0,2,0,0,0,0|1,0,0]=3 2348 B7R0.5 CCOC(=O)[C@H](C)O MCULE-8787861948 [0,2,0,0,0,0|1,0,0]=3 2349 B7R0.5 CCSC(=O)C(C)N MCULE-3205133332 [0,2,0,0,0,0|2,0,0]=4 2350 B7R0.5 CCSC(=O)C(C)N MCULE-4228316337 [0,2,0,0,0,0|2,0,0]=4 2351 B7R0.5 CCSC(=O)[C@H](C)N MCULE-3136283874 [0,2,0,0,0,0|2,0,0]=4 2352 B7R0.5 CCSC(=O)[C@H](C)N MCULE-7218618193 [0,2,0,0,0,0|2,0,0]=4 2353 B7R0.5 CCSC(=O)[C@H](C)N MCULE-8421179745 [0,2,0,0,0,0|2,0,0]=4 2354 B7R0.5 CCSC(=O)[C@H](C)N MCULE-9872171069 [0,2,0,0,0,0|2,0,0]=4 2355 B7R0.5 CN(C)C(=O)CCO MCULE-8849440937 [0,2,0,0,0,0|2,0,0]=4 2356 B7R0.5 CN(C)C(=O)CON MCULE-4400747484 [0,2,0,0,0,0|2,0,0]=4 2357 B7R0.5 COCC(=O)C(C)C MCULE-8251961368 [0,2,0,0,0,0|1,0,0]=3 2358 B7R0.5 COCC(=O)N(C)C MCULE-4175778673 [0,2,0,0,0,0|2,0,0]=4 2359 B7R0.5 N#CCC(=O)C(F)F MCULE-2655907742 [0,2,0,0,0,0|2,0,0]=4 2360 B7R0.7 C#CCC(=O)OCC MCULE-2012473321 [0,2,0,0,0,0|2,0,0]=4 2361 B7R0.7 C=C(CCC)CCO MCULE-1774943854 [0,2,0,0,0,0|2,0,0]=4 2362 B7R0.7 C=CCC(=O)OCC MCULE-2006542536 [0,2,0,0,0,0|2,0,0]=4 2363 B7R0.7 CC(CCO)CCO MCULE-5426211201 [0,2,0,0,0,0|1,0,1]=4 2364 B7R0.7 CCCC(=O)CC#N MCULE-7580308812 [0,2,0,0,0,0|2,0,0]=4 2365 B7R0.7 CCCC(=O)CCC MCULE-1621649928 [0,2,0,0,0,0|2,0,0]=4 2366 B7R0.7 CCCC(=O)OCC MCULE-9977024136 [0,2,0,0,0,0|2,0,0]=4 2367 B7R0.7 CCCC(=O)OCCl MCULE-5186069317 [0,2,0,0,0,0|2,0,0]=4 2368 B7R0.7 CCNC(=O)CC#N MCULE-4756290560 [0,2,0,0,0,0|2,0,0]=4 2369 B7R0.7 CCNC(=O)CCCl MCULE-3246776319 [0,2,0,0,0,0|2,0,0]=4 2370 B7R0.7 CCNC(=O)CCN MCULE-2856252531 [0,2,0,0,0,0|2,0,0]=4 2371 B7R0.7 CCNC(=O)CCN MCULE-3929666209 [0,2,0,0,0,0|2,0,0]=4 2372 B7R0.7 CCNC(=O)CCO MCULE-3624072697 [0,2,0,0,0,0|1,0,0]=3 2373 B7R0.7 CCNC(=O)CNC MCULE-1939824251 [0,2,0,0,0,0|2,0,0]=4 2374 B7R0.7 CCNC(=O)CNC MCULE-2815515396 [0,2,0,0,0,0|2,0,0]=4 2375 B7R0.7 CCNC(=O)NCC MCULE-2253571388 [0,2,0,0,0,0|2,0,0]=4 2376 B7R0.7 CCNC(=O)OCC MCULE-3910060770 [0,2,0,0,0,0|2,0,0]=4 2377 B7R0.7 CCOC(=N)CCO MCULE-8135932013 [0,2,0,0,0,0|2,0,0]=4 2378 B7R0.7 CCOC(=N)CCO MCULE-9125708150 [0,2,0,0,0,0|2,0,0]=4 2379 B7R0.7 CCOC(=N)COC MCULE-1358920023 [0,2,0,0,0,0|2,0,0]=4 2380 B7R0.7 CCOC(=N)COC MCULE-8494947544 [0,2,0,0,0,0|2,0,0]=4 2381 B7R0.7 CCOC(=O)/C=C/O MCULE-1984925411 [0,2,0,0,0,0|1,0,1]=4 2382 B7R0.7 CCOC(=O)C=CO MCULE-2570791221 [0,2,0,0,0,0|1,0,1]=4 2383 B7R0.7 CCOC(=O)C=NO MCULE-8888029932 [0,2,0,0,0,0|1,0,1]=4 2384 B7R0.7 CCOC(=O)CC#N MCULE-3161671261 [0,2,0,0,0,0|2,0,0]=4 2385 B7R0.7 CCOC(=O)CC=O MCULE-5042552247 [0,2,0,0,0,0|1,0,1]=4 2386 B7R0.7 CCOC(=O)CCBr MCULE-1898467026 [0,2,0,0,0,0|2,0,0]=4 2387 B7R0.7 CCOC(=O)CCCl MCULE-2623656770 [0,2,0,0,0,0|2,0,0]=4 2388 B7R0.7 CCOC(=O)CCI MCULE-9651397551 [0,2,0,0,0,0|2,0,0]=4 2389 B7R0.7 CCOC(=O)CCN MCULE-4383008445 [0,2,0,0,0,0|2,0,0]=4 2390 B7R0.7 CCOC(=O)CCN MCULE-6873709061 [0,2,0,0,0,0|2,0,0]=4 2391 B7R0.7 CCOC(=O)CCO MCULE-3972081033 [0,2,0,0,0,0|1,0,0]=3 2392 B7R0.7 CCOC(=O)CCS MCULE-3955367746 [0,2,0,0,0,0|1,1,0]=4 2393 B7R0.7 CCOC(=O)CNC MCULE-3219895330 [0,2,0,0,0,0|2,0,0]=4 2394 B7R0.7 CCOC(=O)CNC MCULE-6164649520 [0,2,0,0,0,0|2,0,0]=4 2395 B7R0.7 CCOC(=O)CNN MCULE-2832319636 [0,2,0,0,0,0|2,0,0]=4 2396 B7R0.7 CCOC(=O)CNN MCULE-3479623348 [0,2,0,0,0,0|2,0,0]=4 2397 B7R0.7 CCOC(=O)CNN MCULE-5066106273 [0,2,0,0,0,0|2,0,0]=4 2398 B7R0.7 CCOC(=O)COC MCULE-7739678079 [0,2,0,0,0,0|1,0,0]=3 2399 B7R0.7 CCOC(=O)CON MCULE-4924818206 [0,2,0,0,0,0|1,0,0]=3 2400 B7R0.7 CCOC(=O)CSC MCULE-5199209389 [0,2,0,0,0,0|1,1,0]=4 2401 B7R0.7 CCOC(=O)NCCl MCULE-9646468987 [0,2,0,0,0,0|2,0,0]=4 2402 B7R0.7 CCOC(=O)NCO MCULE-1265242244 [0,2,0,0,0,0|1,0,0]=3 2403 B7R0.7 CCOC(=O)NOC MCULE-2256963329 [0,2,0,0,0,0|2,0,0]=4 2404 B7R0.7 CCOC(=O)OCC MCULE-1394890550 [0,2,0,0,0,0|2,0,0]=4 2405 B7R0.7 CCOC(=O)OCCl MCULE-9723292956 [0,2,0,0,0,0|2,0,0]=4 2406 B7R0.7 CCOC(=O)OCI MCULE-7994621582 [0,2,0,0,0,0|2,0,0]=4 2407 B7R0.7 CCSC(=O)SCC MCULE-7783165279 [0,2,0,0,0,0|2,0,0]=4 2408 B7R0.7 CN(CCO)CCO MCULE-3967840948 [0,2,0,0,0,0|2,0,0]=4 2409 B7R0.7 CN(CCO)CCO MCULE-6878116085 [0,2,0,0,0,0|2,0,0]=4 2410 B7R0.7 COCC(=CCBr)C MCULE-6258296852 [0,2,0,0,0,0|2,0,0]=4 2411 B7R0.7 COCC(=O)CC#N MCULE-7023614757 [0,2,0,0,0,0|1,0,0]=3 2412 B7R0.7 COCC(=O)COC MCULE-5119511792 [0,2,0,0,0,0|0,0,0]=2 2413 B7R0.7 COCC(Br)COC MCULE-8590528928 [0,2,0,0,0,0|1,0,1]=4 2414 B7R0.7 COCC(C)CCO MCULE-6812981556 [0,2,0,0,0,0|1,0,1]=4 2415 B7R0.7 COCC(Cl)COC MCULE-1871071718 [0,2,0,0,0,0|1,0,1]=4 2416 B7R0.7 COCC(N)CCO MCULE-2569422233 [0,2,0,0,0,0|1,0,1]=4 2417 B7R0.7 COCC(N)COC MCULE-3531117264 [0,2,0,0,0,0|1,0,1]=4 2418 B7R0.7 COCC(N)COC MCULE-3609597955 [0,2,0,0,0,0|1,0,1]=4 2419 B7R0.7 COCC(O)COC MCULE-5364514636 [0,2,0,0,0,0|0,0,2]=4 2420 B7R0.7 COCC(O)CON MCULE-3159534337 [0,2,0,0,0,0|0,0,2]=4 2421 B7R0.7 O=C(CCBr)CCBr MCULE-4794296091 [0,2,0,0,0,0|2,0,0]=4 2422 B7R0.7 O=C(CCCl)CCCl MCULE-1408529874 [0,2,0,0,0,0|2,0,0]=4 2423 B7R0.7 O=C(CCO)CCO MCULE-8765223516 [0,2,0,0,0,0|0,0,0]=2 2424 B7R0.7 O=C(NCO)NCO MCULE-8625819432 [0,2,0,0,0,0|0,0,0]=2 2425 B7R0.7 O=S(CCO)CCO MCULE-3068452870 [0,2,0,0,0,0|1,0,0]=3 2426 B7R0.7 OCCC(O)CCO MCULE-1162803524 [0,2,0,0,0,0|0,0,2]=4 2427 B7R0.7 OCNC(=S)NCO MCULE-4551702004 [0,2,0,0,0,0|0,1,0]=3 2428 B7R0.10 C=C(CO)C(=O)OC MCULE-8888105984 [0,2,0,0,0,0|1,0,1]=4 2429 B7R0.10 C=CC(O)C(=O)OC MCULE-8475572887 [0,2,0,0,0,0|2,0,0]=4 2430 B7R0.10 CCC(=O)C(=NO)C MCULE-5669219787 [0,2,0,0,0,0|1,0,1]=4 2431 B7R0.10 CCC(=O)C(=O)CC MCULE-4346857339 [0,2,0,0,0,0|2,0,0]=4 2432 B7R0.10 CCC(=O)C(=O)OC MCULE-6526576267 [0,2,0,0,0,0|1,0,1]=4 2433 B7R0.10 CCC(=O)C(C)C#N MCULE-5937845036 [0,2,0,0,0,0|2,0,0]=4 2434 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [0,2,0,0,0,0|1,0,0]=3 2435 B7R0.10 CCC(=O)N(C)CC MCULE-1764457516 [0,2,0,0,0,0|2,0,0]=4 2436 B7R0.10 CCC(=O)N(C)OC MCULE-7450696534 [0,2,0,0,0,0|2,0,0]=4 2437 B7R0.10 CCC(C)C(=O)CBr MCULE-7022126762 [0,2,0,0,0,0|2,0,0]=4 2438 B7R0.10 CCC(C)C(=O)CCl MCULE-6800466655 [0,2,0,0,0,0|2,0,0]=4 2439 B7R0.10 CCC(N)C(=O)NO MCULE-9162328479 [0,2,0,0,0,0|2,0,0]=4 2440 B7R0.10 CCC(O)C(=O)OC MCULE-8768500574 [0,2,0,0,0,0|2,0,0]=4 2441 B7R0.10 CCC(O)C(C)CO MCULE-3930931405 [0,2,0,0,0,0|1,0,1]=4 2442 B7R0.10 CCC(O)C(C)CO MCULE-4472852672 [0,2,0,0,0,0|1,0,1]=4 2443 B7R0.10 CCN(C)C(=O)CBr MCULE-4444194334 [0,2,0,0,0,0|2,0,0]=4 2444 B7R0.10 CCN(C)C(=O)CCl MCULE-7762522604 [0,2,0,0,0,0|2,0,0]=4 2445 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-6916010003 [0,2,0,0,0,0|2,0,0]=4 2446 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-9376722018 [0,2,0,0,0,0|2,0,0]=4 2447 B7R0.10 CC[C@H](O)C(=O)OC MCULE-5873092635 [0,2,0,0,0,0|2,0,0]=4 2448 B7R0.10 CC[C@H](O)C(=O)OC MCULE-8209874812 [0,2,0,0,0,0|2,0,0]=4 2449 B7R0.10 CNC(=O)C(N)CO MCULE-1507161216 [0,2,0,0,0,0|2,0,0]=4 2450 B7R0.10 CNC(=O)C(O)CN MCULE-4650373222 [0,2,0,0,0,0|2,0,0]=4 2451 B7R0.10 CNC(=O)C(O)CN MCULE-8978952332 [0,2,0,0,0,0|2,0,0]=4 2452 B7R0.10 COC(=O)C(=O)CBr MCULE-7596502094 [0,2,0,0,0,0|1,0,1]=4 2453 B7R0.10 COC(=O)C(Br)CO MCULE-1678765423 [0,2,0,0,0,0|2,0,0]=4 2454 B7R0.10 COC(=O)C(Br)CO MCULE-8437488397 [0,2,0,0,0,0|2,0,0]=4 2455 B7R0.10 COC(=O)C(Br)OC MCULE-5672396067 [0,2,0,0,0,0|2,0,0]=4 2456 B7R0.10 COC(=O)C(C)CO MCULE-1168600238 [0,2,0,0,0,0|2,0,0]=4 2457 B7R0.10 COC(=O)C(C)CO MCULE-9207150786 [0,2,0,0,0,0|2,0,0]=4 2458 B7R0.10 COC(=O)C(C)OC MCULE-3274761391 [0,2,0,0,0,0|2,0,0]=4 2459 B7R0.10 COC(=O)C(C)ON MCULE-1829014190 [0,2,0,0,0,0|2,0,0]=4 2460 B7R0.10 COC(=O)C(C)ON MCULE-4104938309 [0,2,0,0,0,0|2,0,0]=4 2461 B7R0.10 COC(=O)C(Cl)CO MCULE-9496750776 [0,2,0,0,0,0|2,0,0]=4 2462 B7R0.10 COC(=O)C(Cl)OC MCULE-8296320773 [0,2,0,0,0,0|2,0,0]=4 2463 B7R0.10 COC(=O)C(F)CO MCULE-2188518229 [0,2,0,0,0,0|2,0,0]=4 2464 B7R0.10 COC(=O)C(N)CO MCULE-1874204534 [0,2,0,0,0,0|2,0,0]=4 2465 B7R0.10 COC(=O)C(N)CO MCULE-1907797317 [0,2,0,0,0,0|2,0,0]=4 2466 B7R0.10 COC(=O)C(N)CO MCULE-3851022091 [0,2,0,0,0,0|2,0,0]=4 2467 B7R0.10 COC(=O)C(N)CO MCULE-9875856930 [0,2,0,0,0,0|2,0,0]=4 2468 B7R0.10 COC(=O)C(O)C#N MCULE-2296440580 [0,2,0,0,0,0|2,0,0]=4 2469 B7R0.10 COC(=O)C(O)CCl MCULE-1480405341 [0,2,0,0,0,0|2,0,0]=4 2470 B7R0.10 COC(=O)C(O)CN MCULE-1003241246 [0,2,0,0,0,0|2,0,0]=4 2471 B7R0.10 COC(=O)C(O)CN MCULE-9006804473 [0,2,0,0,0,0|2,0,0]=4 2472 B7R0.10 COC(=O)C(O)CO MCULE-1234820163 [0,2,0,0,0,0|2,0,0]=4 2473 B7R0.10 COC(=O)C(O)CO MCULE-2142801284 [0,2,0,0,0,0|2,0,0]=4 2474 B7R0.10 COC(=O)C(O)OC MCULE-5465190164 [0,2,0,0,0,0|2,0,0]=4 2475 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8075978888 [0,2,0,0,0,0|2,0,0]=4 2476 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8903256620 [0,2,0,0,0,0|2,0,0]=4 2477 B7R0.10 COC(=O)[C@@H](C)CO MCULE-6738074317 [0,2,0,0,0,0|2,0,0]=4 2478 B7R0.10 COC(=O)[C@@H](C)CO MCULE-9697255968 [0,2,0,0,0,0|2,0,0]=4 2479 B7R0.10 COC(=O)[C@@H](N)CO MCULE-2171593224 [0,2,0,0,0,0|2,0,0]=4 2480 B7R0.10 COC(=O)[C@@H](N)CO MCULE-3393088985 [0,2,0,0,0,0|2,0,0]=4 2481 B7R0.10 COC(=O)[C@@H](N)CO MCULE-5476910845 [0,2,0,0,0,0|2,0,0]=4 2482 B7R0.10 COC(=O)[C@@H](N)CO MCULE-9984439264 [0,2,0,0,0,0|2,0,0]=4 2483 B7R0.10 COC(=O)[C@@H](O)CN MCULE-1265508864 [0,2,0,0,0,0|2,0,0]=4 2484 B7R0.10 COC(=O)[C@@H](O)CN MCULE-2334791448 [0,2,0,0,0,0|2,0,0]=4 2485 B7R0.10 COC(=O)[C@@H](O)CN MCULE-6207278824 [0,2,0,0,0,0|2,0,0]=4 2486 B7R0.10 COC(=O)[C@@H](O)CN MCULE-6634004594 [0,2,0,0,0,0|2,0,0]=4 2487 B7R0.10 COC(=O)[C@@H](O)CO MCULE-3655137528 [0,2,0,0,0,0|2,0,0]=4 2488 B7R0.10 COC(=O)[C@@H](O)CO MCULE-5801355812 [0,2,0,0,0,0|2,0,0]=4 2489 B7R0.10 COC(=O)[C@H](Br)CO MCULE-8230787734 [0,2,0,0,0,0|2,0,0]=4 2490 B7R0.10 COC(=O)[C@H](C)CO MCULE-5719676432 [0,2,0,0,0,0|2,0,0]=4 2491 B7R0.10 COC(=O)[C@H](C)CO MCULE-8479546806 [0,2,0,0,0,0|2,0,0]=4 2492 B7R0.10 COC(=O)[C@H](C)OC MCULE-3095326114 [0,2,0,0,0,0|2,0,0]=4 2493 B7R0.10 COC(=O)[C@H](N)CO MCULE-4463451892 [0,2,0,0,0,0|2,0,0]=4 2494 B7R0.10 COC(=O)[C@H](N)CO MCULE-5622938569 [0,2,0,0,0,0|2,0,0]=4 2495 B7R0.10 COC(=O)[C@H](N)CO MCULE-6021580541 [0,2,0,0,0,0|2,0,0]=4 2496 B7R0.10 COC(=O)[C@H](N)CO MCULE-8237708167 [0,2,0,0,0,0|2,0,0]=4 2497 B7R0.10 COC(=O)[C@H](O)CN MCULE-5902729244 [0,2,0,0,0,0|2,0,0]=4 2498 B7R0.10 COC(=O)[C@H](O)CN MCULE-9252373981 [0,2,0,0,0,0|2,0,0]=4 2499 B7R0.10 COC(=O)[C@H](O)CO MCULE-4219956218 [0,2,0,0,0,0|2,0,0]=4 2500 B7R0.10 COC(=O)[C@H](O)CO MCULE-8891571940 [0,2,0,0,0,0|2,0,0]=4 2501 B7R0.10 COC(C)/C(=N/O)/N MCULE-3009628521 [0,2,0,0,0,0|2,0,0]=4 2502 B7R0.10 COC(C)C(=O)NN MCULE-7263059210 [0,2,0,0,0,0|2,0,0]=4 2503 B7R0.10 CON(C)C(=O)CBr MCULE-2482429241 [0,2,0,0,0,0|2,0,0]=4 2504 B7R0.10 CON(C)C(=O)CCl MCULE-1502732282 [0,2,0,0,0,0|2,0,0]=4 2505 B7R0.10 CON(C)C(=O)CF MCULE-9037247053 [0,2,0,0,0,0|2,0,0]=4 2506 B7R0.10 CON(C)C(=O)CN MCULE-1461344814 [0,2,0,0,0,0|2,0,0]=4 2507 B7R0.10 CON(C)C(=O)CN MCULE-5305104539 [0,2,0,0,0,0|2,0,0]=4 2508 B7R0.10 NC(CCl)C(=O)NO MCULE-8256545065 [0,2,0,0,0,0|2,0,0]=4 2509 B7R0.10 NNC(=O)C(N)CO MCULE-3324075598 [0,2,0,0,0,0|2,0,0]=4 2510 B7R0.10 NNC(=O)C(N)CO MCULE-6651241883 [0,2,0,0,0,0|2,0,0]=4 2511 B7R0.10 N[C@@H](CO)[C@@H](N)CO MCULE-2394488011 [0,2,0,0,0,0|1,0,1]=4 2512 B7R0.10 O=C(CBr)C(=O)CBr MCULE-2533799421 [0,2,0,0,0,0|2,0,0]=4 2513 B7R0.10 O=C(CO)C(O)CO MCULE-9818197491 [0,2,0,0,0,0|0,0,0]=2 2514 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8306776225 [0,2,0,0,0,0|0,0,0]=2 2515 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8666498937 [0,2,0,0,0,0|0,0,0]=2 2516 B7R0.10 O=C(CO)[C@H](O)CO MCULE-7828531161 [0,2,0,0,0,0|0,0,0]=2 2517 B7R0.10 O=CC(O)C(O)CO MCULE-9564469242 [0,2,0,0,0,0|0,0,2]=4 2518 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-3532911413 [0,2,0,0,0,0|0,0,2]=4 2519 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-5707669784 [0,2,0,0,0,0|0,0,2]=4 2520 B7R0.10 O=C[C@@H](O)[C@H](O)CO MCULE-4902023669 [0,2,0,0,0,0|0,0,2]=4 2521 B7R0.10 O=C[C@H](O)[C@@H](O)CO MCULE-5975565699 [0,2,0,0,0,0|0,0,2]=4 2522 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-3036594515 [0,2,0,0,0,0|0,0,2]=4 2523 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-5412566780 [0,2,0,0,0,0|0,0,2]=4 2524 B7R0.10 OC/C(=C(\Br)/CO)/Br MCULE-4124313752 [0,2,0,0,0,0|1,0,0]=3 2525 B7R0.10 OC/C(=C(\I)/CO)/I MCULE-1498396594 [0,2,0,0,0,0|1,0,0]=3 2526 B7R0.10 OCC(=C(Br)CO)Br MCULE-5802887340 [0,2,0,0,0,0|1,0,0]=3 2527 B7R0.10 OCC(=C(F)CBr)F MCULE-8689735335 [0,2,0,0,0,0|2,0,0]=4 2528 B7R0.10 OCC(=C(I)CO)I MCULE-4534512400 [0,2,0,0,0,0|1,0,0]=3 2529 B7R0.10 OCC(Br)C(Br)CO MCULE-4593943249 [0,2,0,0,0,0|1,0,1]=4 2530 B7R0.10 OCC(O)C(O)CO MCULE-9009953851 [0,2,0,0,0,0|0,0,2]=4 2531 B7R0.10 OC[C@@H](Br)[C@H](Br)CO MCULE-7293448690 [0,2,0,0,0,0|1,0,1]=4 2532 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-1593828237 [0,2,0,0,0,0|0,0,2]=4 2533 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-7577661973 [0,2,0,0,0,0|0,0,2]=4 2534 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-7306394407 [0,2,0,0,0,0|0,0,2]=4 2535 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-8013265935 [0,2,0,0,0,0|0,0,2]=4 2536 B7R0.10 OC[C@H](O)[C@H](O)CO MCULE-6886999157 [0,2,0,0,0,0|0,0,2]=4 2537 B7R0.11 CC(C)(CO)CCO MCULE-1756560398 [0,2,0,0,0,0|1,0,1]=4 2538 B7R0.11 CC(O)(CO)CCO MCULE-4148316300 [0,2,0,0,0,0|0,0,2]=4 2539 B7R0.11 CCS(=O)(=O)CCO MCULE-1810929722 [0,2,0,0,0,0|2,0,0]=4 2540 B7R0.11 COCC(C)(C)CO MCULE-2985367717 [0,2,0,0,0,0|1,0,1]=4 2541 B7R0.11 COCC(C)(N)CO MCULE-2603485329 [0,2,0,0,0,0|1,0,1]=4 2542 B7R0.11 COCC(C)(N)CO MCULE-3416999559 [0,2,0,0,0,0|1,0,1]=4 2543 B7R0.11 COCC(F)(F)CO MCULE-7603400715 [0,2,0,0,0,0|1,0,1]=4 2544 B7R0.11 OCCC(F)(F)CO MCULE-9524877710 [0,2,0,0,0,0|1,0,1]=4 2545 B7R0.12 C=CCC(CO)CO MCULE-4178696072 [0,2,0,0,0,0|1,0,1]=4 2546 B7R0.12 CCCC(CO)CO MCULE-2372919180 [0,2,0,0,0,0|1,0,1]=4 2547 B7R0.12 CCN(CCO)N=O MCULE-3100234015 [0,2,0,0,0,0|2,0,0]=4 2548 B7R0.12 COCC(CO)OC MCULE-6775038884 [0,2,0,0,0,0|0,0,2]=4 2549 B7R0.12 COC[C@@H](CO)OC MCULE-7098934437 [0,2,0,0,0,0|0,0,2]=4 2550 B7R0.12 NCCC(CO)CO MCULE-7028267284 [0,2,0,0,0,0|1,0,1]=4 2551 B7R0.12 NCCC(CO)CO MCULE-8865812482 [0,2,0,0,0,0|1,0,1]=4 2552 B7R0.12 OCC=C(CCl)CCl MCULE-4216885258 [0,2,0,0,0,0|2,0,0]=4 2553 B7R0.12 OCCC(CO)CO MCULE-7198799967 [0,2,0,0,0,0|0,0,2]=4 2554 B7R0.13 CC(O)C(C)(C)CO MCULE-1064066796 [0,2,0,0,0,0|1,0,1]=4 2555 B7R0.14 C/C(=N\O)/C(C)(C)O MCULE-4351772949 [0,2,0,0,0,0|2,0,0]=4 2556 B7R0.14 CC(=NO)C(C)(C)O MCULE-8500175274 [0,2,0,0,0,0|2,0,0]=4 2557 B7R0.14 CC(C)(Br)C(=O)CBr MCULE-1166951923 [0,2,0,0,0,0|2,0,0]=4 2558 B7R0.14 CC(C)(C)C(=O)CBr MCULE-9372273167 [0,2,0,0,0,0|2,0,0]=4 2559 B7R0.14 CC(C)(C)C(=O)CCl MCULE-1894659371 [0,2,0,0,0,0|2,0,0]=4 2560 B7R0.14 CC(C)(C)C(=O)CN MCULE-7674237053 [0,2,0,0,0,0|2,0,0]=4 2561 B7R0.14 CC(C)(C)C(=O)CN MCULE-8608463504 [0,2,0,0,0,0|2,0,0]=4 2562 B7R0.14 CC(C)(C)C(=O)CN MCULE-9702095018 [0,2,0,0,0,0|2,0,0]=4 2563 B7R0.14 CC(C)(C)C(=O)CO MCULE-4134803818 [0,2,0,0,0,0|1,0,0]=3 2564 B7R0.14 CC(C)(C)C(=O)CS MCULE-7051407339 [0,2,0,0,0,0|1,1,0]=4 2565 B7R0.14 CC(C)(C)C(=O)NO MCULE-8308717662 [0,2,0,0,0,0|2,0,0]=4 2566 B7R0.14 CC(C)(O)C(=N)NO MCULE-3400813193 [0,2,0,0,0,0|2,0,0]=4 2567 B7R0.14 CC(C)(O)C(=O)NN MCULE-2403937132 [0,2,0,0,0,0|2,0,0]=4 2568 B7R0.14 CC(CO)C(C)(C)O MCULE-8073024148 [0,2,0,0,0,0|1,0,1]=4 2569 B7R0.14 CC(F)(F)C(=O)CCl MCULE-3815783104 [0,2,0,0,0,0|2,0,0]=4 2570 B7R0.14 CCC(=O)C(C)(C)C MCULE-1267009248 [0,2,0,0,0,0|2,0,0]=4 2571 B7R0.14 CCC(=O)C(F)(F)F MCULE-1722149066 [0,2,0,0,0,0|2,0,0]=4 2572 B7R0.14 COC(=O)C(C)(C)O MCULE-2680975247 [0,2,0,0,0,0|2,0,0]=4 2573 B7R0.14 C[C@@H](CO)C(C)(C)O MCULE-1478332547 [0,2,0,0,0,0|1,0,1]=4 2574 B7R0.14 C[C@@H](CO)C(C)(C)O MCULE-2286439441 [0,2,0,0,0,0|1,0,1]=4 2575 B7R0.14 O=C(CBr)C(F)(F)F MCULE-9734425316 [0,2,0,0,0,0|2,0,0]=4 2576 B7R0.14 O=C(CCl)C(F)(F)F MCULE-6496991998 [0,2,0,0,0,0|2,0,0]=4 2577 B7R0.14 O=C(CI)C(F)(F)F MCULE-5851805636 [0,2,0,0,0,0|2,0,0]=4 2578 B7R0.15 CC(=O)C(CO)CO MCULE-6408384667 [0,2,0,0,0,0|0,0,1]=3 2579 B7R0.15 CC(C)C(CO)CO MCULE-8569465631 [0,2,0,0,0,0|1,0,1]=4 2580 B7R0.15 CC(O)C(CO)CO MCULE-9986430379 [0,2,0,0,0,0|0,0,2]=4 2581 B7R0.15 CCC(CO)C(=O)O MCULE-9435802738 [0,2,0,0,0,0|1,0,1]=4 2582 B7R0.15 CCC(CO)C(=O)[O-] MCULE-4277685135 [0,2,0,0,0,0|1,0,1]=4 2583 B7R0.15 CC[C@H](CO)C(=O)O MCULE-3017159819 [0,2,0,0,0,0|1,0,1]=4 2584 B7R0.15 CN(C)C(CO)CO MCULE-6589056011 [0,2,0,0,0,0|1,0,1]=4 2585 B7R0.15 NC(=O)N(CO)CO MCULE-8654518853 [0,2,0,0,0,0|1,0,0]=3 2586 B7R0.15 NCC(CO)C(=O)O MCULE-5510878508 [0,2,0,0,0,0|1,0,1]=4 2587 B7R0.15 NCC(CO)C(=O)O MCULE-9991285445 [0,2,0,0,0,0|1,0,1]=4 2588 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-4607648703 [0,2,0,0,0,0|1,0,1]=4 2589 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-8943978569 [0,2,0,0,0,0|1,0,1]=4 2590 B7R0.15 NC[C@H](CO)C(=O)O MCULE-8459713640 [0,2,0,0,0,0|1,0,1]=4 2591 B7R0.15 O=N(=O)C(CO)CO MCULE-8874921455 [0,2,0,0,0,0|0,0,1]=3 2592 B7R0.16 CC(Br)C(=O)C(C)Br MCULE-8131454981 [0,2,0,0,0,0|2,0,0]=4 2593 B7R0.16 CC(C)C(=O)C(=O)O MCULE-9877767821 [0,2,0,0,0,0|1,0,1]=4 2594 B7R0.16 CC(C)C(=O)C(C)Br MCULE-3431811578 [0,2,0,0,0,0|2,0,0]=4 2595 B7R0.16 CC(C)C(=O)C(C)C MCULE-2525492530 [0,2,0,0,0,0|2,0,0]=4 2596 B7R0.16 CC(O)C(=O)N(C)C MCULE-9214363632 [0,2,0,0,0,0|2,0,0]=4 2597 B7R0.16 O=C(C(Br)Br)C(Br)Br MCULE-7461631667 [0,2,0,0,0,0|2,0,0]=4 2598 B7R0.16 O=C(C(F)F)C(Br)Br MCULE-8989993970 [0,2,0,0,0,0|2,0,0]=4 2599 B7R0.16 O=C(O)C(=O)C(=O)O MCULE-9031084199 [0,2,0,0,0,0|0,0,2]=4 2600 B7R0.16 O=C(O)C(=O)C(Br)Br MCULE-6847251467 [0,2,0,0,0,0|1,0,1]=4 2601 B7R0.18 CC(C=O)(CO)CO MCULE-2216366062 [0,2,0,0,0,0|0,0,1]=3 2602 B7R0.18 CC(CN)(CO)CO MCULE-8513833512 [0,2,0,0,0,0|1,0,1]=4 2603 B7R0.18 CC(CO)(CO)CBr MCULE-5696396166 [0,2,0,0,0,0|1,0,1]=4 2604 B7R0.18 CC(CO)(CO)CO MCULE-1228441837 [0,2,0,0,0,0|0,0,2]=4 2605 B7R0.18 CCC(C)(CO)CO MCULE-6918244309 [0,2,0,0,0,0|1,0,1]=4 2606 B7R0.18 CCC(N)(CO)CO MCULE-6627376273 [0,2,0,0,0,0|1,0,1]=4 2607 B7R0.18 COC(N)(CO)CO MCULE-3562349590 [0,2,0,0,0,0|0,0,2]=4 2608 B7R0.18 COC(N)(CO)CO MCULE-5361347592 [0,2,0,0,0,0|0,0,2]=4 2609 B7R0.18 NC(CO)(CO)CO MCULE-1491189847 [0,2,0,0,0,0|0,0,2]=4 2610 B7R0.18 NC(CO)(CO)CO MCULE-2267999286 [0,2,0,0,0,0|0,0,2]=4 2611 B7R0.18 NC(CO)(CO)CO MCULE-4100030243 [0,2,0,0,0,0|0,0,2]=4 2612 B7R0.18 NC(CO)(CO)CO MCULE-4852633554 [0,2,0,0,0,0|0,0,2]=4 2613 B7R0.18 NC(CO)(CO)CO MCULE-6369744326 [0,2,0,0,0,0|0,0,2]=4 2614 B7R0.18 NC(CO)(CO)CO MCULE-7300085951 [0,2,0,0,0,0|0,0,2]=4 2615 B7R0.18 NC(CO)(CO)CO MCULE-8252586319 [0,2,0,0,0,0|0,0,2]=4 2616 B7R0.18 NC(CO)(CO)CO MCULE-8592789920 [0,2,0,0,0,0|0,0,2]=4 2617 B7R0.18 NC(CO)(CO)CO MCULE-9200014500 [0,2,0,0,0,0|0,0,2]=4 2618 B7R0.18 [NH3+]C(CO)(CO)CO MCULE-6464912245 [0,2,0,0,0,0|0,0,2]=4 2619 B5R1.2 BrC1COC1 MCULE-7527620035 [1,0,0,1,0,0|1,0,1]=4 2620 B5R1.2 C=C1CCC1 MCULE-8318650413 [1,0,0,1,0,0|2,0,0]=4 2621 B5R1.2 C=C1CNC1 MCULE-1391021267 [1,0,0,1,0,0|2,0,0]=4 2622 B5R1.2 C=C1CNC1 MCULE-7957953185 [1,0,0,1,0,0|2,0,0]=4 2623 B5R1.2 C=C1COC1 MCULE-1822645869 [1,0,0,1,0,0|1,0,0]=3 2624 B5R1.2 ClC1COC1 MCULE-7266812470 [1,0,0,1,0,0|1,0,1]=4 2625 B5R1.2 FC1COC1 MCULE-7899811313 [1,0,0,1,0,0|1,0,1]=4 2626 B5R1.2 IC1COC1 MCULE-6736781201 [1,0,0,1,0,0|1,0,1]=4 2627 B5R1.2 NC1COC1 MCULE-3457998413 [1,0,0,1,0,0|1,0,1]=4 2628 B5R1.2 NC1COC1 MCULE-8439862131 [1,0,0,1,0,0|1,0,1]=4 2629 B5R1.2 O=C1CCC1 MCULE-4870967355 [1,0,0,1,0,0|1,0,0]=3 2630 B5R1.2 O=C1CCN1 MCULE-9053067221 [1,0,0,1,0,0|2,0,0]=4 2631 B5R1.2 O=C1CCO1 MCULE-1277069147 [1,0,0,1,0,0|1,0,0]=3 2632 B5R1.2 O=C1CNC1 MCULE-5171659870 [1,0,0,1,0,0|1,0,0]=3 2633 B5R1.2 O=C1CNC1 MCULE-8293494956 [1,0,0,1,0,0|1,0,0]=3 2634 B5R1.2 O=C1COC1 MCULE-6847248632 [1,0,0,1,0,0|0,0,0]=2 2635 B5R1.2 O=C1CSC1 MCULE-4436071261 [1,0,0,1,0,0|0,1,0]=3 2636 B5R1.2 OC1COC1 MCULE-2630355859 [1,0,0,1,0,0|0,0,2]=4 2637 B5R1.2 SC1COC1 MCULE-2175099379 [1,0,0,1,0,0|0,1,1]=4 2638 B5R1.3 OCC1CC1 MCULE-4492474357 [1,0,0,1,0,0|1,0,1]=4 2639 B5R1.3 OCC1CO1 MCULE-2158628585 [1,0,0,1,0,0|0,0,2]=4 2640 B5R1.3 OCC1CO1 MCULE-4063620133 [1,0,0,1,0,0|0,0,2]=4 2641 B5R1.3 OC[C@@H]1CO1 MCULE-4213198809 [1,0,0,1,0,0|0,0,2]=4 2642 B5R1.3 OC[C@@H]1CO1 MCULE-6922911793 [1,0,0,1,0,0|0,0,2]=4 2643 B5R1.3 OC[C@H]1CO1 MCULE-2018407404 [1,0,0,1,0,0|0,0,2]=4 2644 B5R1.3 OC[C@H]1CO1 MCULE-9773081927 [1,0,0,1,0,0|0,0,2]=4 2645 B5R1.4 CC1CC1O MCULE-2006758475 [1,0,0,1,0,0|1,0,1]=4 2646 B5R1.4 NC1CC1O MCULE-2677451452 [1,0,0,1,0,0|1,0,1]=4 2647 B5R1.4 NC1CC1O MCULE-2909581707 [1,0,0,1,0,0|1,0,1]=4 2648 B5R1.4 N[C@@H]1C[C@@H]1O MCULE-1950197706 [1,0,0,1,0,0|1,0,1]=4 2649 B5R1.4 N[C@@H]1C[C@H]1O MCULE-5188790849 [1,0,0,1,0,0|1,0,1]=4 2650 B5R1.4 N[C@@H]1C[C@H]1O MCULE-8531829585 [1,0,0,1,0,0|1,0,1]=4 2651 B5R1.4 N[C@H]1C[C@@H]1O MCULE-4699241997 [1,0,0,1,0,0|1,0,1]=4 2652 B5R1.4 N[C@H]1C[C@H]1O MCULE-3609246488 [1,0,0,1,0,0|1,0,1]=4 2653 B5R1.4 N[C@H]1C[C@H]1O MCULE-3860963329 [1,0,0,1,0,0|1,0,1]=4 2654 B5R1.5 CC1(CO1)C MCULE-4247049920 [1,0,0,1,0,0|1,0,1]=4 2655 B5R1.1 B1CCOO1 MCULE-4859234466 [1,0,0,1,0,0|1,0,1]=4 2656 B5R1.1 C1=CCOC1 MCULE-1252378718 [1,0,0,1,0,0|1,0,1]=4 2657 B5R1.1 C1=COCC1 MCULE-7714726225 [1,0,0,1,0,0|1,0,1]=4 2658 B5R1.1 C1CCOC1 MCULE-3873245085 [1,0,0,1,0,0|1,0,1]=4 2659 B5R1.1 C1CNOC1 MCULE-3922840312 [1,0,0,1,0,0|1,0,1]=4 2660 B5R1.1 C1CNOC1 MCULE-6084499894 [1,0,0,1,0,0|1,0,1]=4 2661 B5R1.1 C1COCN1 MCULE-4693733872 [1,0,0,1,0,0|2,0,0]=4 2662 B5R1.1 C1COCO1 MCULE-3967810235 [1,0,0,1,0,0|2,0,0]=4 2663 B7R1.1 C1(CCOC1)CO MCULE-2350780678 [0,1,0,1,0,0|1,0,1]=4 2664 B7R1.1 ClCC1=NOCC1 MCULE-8714304275 [0,1,0,1,0,0|2,0,0]=4 2665 B7R1.1 O=CC1CCOC1 MCULE-9515567606 [0,1,0,1,0,0|1,0,1]=4 2666 B7R1.1 O=C[C@@H]1CCOC1 MCULE-5181257964 [0,1,0,1,0,0|1,0,1]=4 2667 B7R1.1 O=C[C@H]1CCOC1 MCULE-4532427366 [0,1,0,1,0,0|1,0,1]=4 2668 B7R1.1 OCC1=CCCC1 MCULE-8850570361 [0,1,0,1,0,0|2,0,0]=4 2669 B7R1.1 OCC1=COC=C1 MCULE-1188853308 [0,1,0,1,0,0|1,0,1]=4 2670 B7R1.1 OCC1=COC=N1 MCULE-6953437959 [0,1,0,1,0,0|1,0,1]=4 2671 B7R1.1 OCC1=CON=C1 MCULE-5122190603 [0,1,0,1,0,0|1,0,1]=4 2672 B7R1.1 OCC1=NCCO1 MCULE-9432593363 [0,1,0,1,0,0|1,0,1]=4 2673 B7R1.1 OCC1=NOC=C1 MCULE-3216265153 [0,1,0,1,0,0|1,0,1]=4 2674 B7R1.1 OCC1=NOC=N1 MCULE-8130425281 [0,1,0,1,0,0|1,0,1]=4 2675 B7R1.1 OCC1=NON=C1 MCULE-7693226761 [0,1,0,1,0,0|1,0,1]=4 2676 B7R1.1 OCC1CCOC1 MCULE-8926405046 [0,1,0,1,0,0|1,0,1]=4 2677 B7R1.1 OCC1CCON1 MCULE-1199975481 [0,1,0,1,0,0|1,0,1]=4 2678 B7R1.1 OCC1CCON1 MCULE-4772487016 [0,1,0,1,0,0|1,0,1]=4 2679 B7R1.1 OCC1COCO1 MCULE-3470022742 [0,1,0,1,0,0|0,0,2]=4 2680 B7R1.1 OC[C@@H]1CCOC1 MCULE-2004616524 [0,1,0,1,0,0|1,0,1]=4 2681 B7R1.1 OC[C@@H]1CCOC1 MCULE-3801423698 [0,1,0,1,0,0|1,0,1]=4 2682 B7R1.1 OC[C@H]1CCOC1 MCULE-4226412289 [0,1,0,1,0,0|1,0,1]=4 2683 B7R1.1 OC[C@H]1CCOC1 MCULE-9076004118 [0,1,0,1,0,0|1,0,1]=4 2684 B7R1.2 C1(CNC(=O)C1)O MCULE-5557473335 [0,1,0,1,0,0|2,0,0]=4 2685 B7R1.2 CC1=CC(=O)CO1 MCULE-6570401610 [0,1,0,1,0,0|1,0,1]=4 2686 B7R1.2 CC1CC(=O)CO1 MCULE-7022597277 [0,1,0,1,0,0|1,0,0]=3 2687 B7R1.2 CC1CC(=O)CS1 MCULE-7518365363 [0,1,0,1,0,0|1,1,0]=4 2688 B7R1.2 CC1CCC(=O)C1 MCULE-6716533429 [0,1,0,1,0,0|2,0,0]=4 2689 B7R1.2 CC1CCC(=O)N1 MCULE-8928464449 [0,1,0,1,0,0|2,0,0]=4 2690 B7R1.2 CC1CCC(=O)N1 MCULE-9236321365 [0,1,0,1,0,0|2,0,0]=4 2691 B7R1.2 CC1CCC(=O)O1 MCULE-3014789527 [0,1,0,1,0,0|2,0,0]=4 2692 B7R1.2 CC1NCC(=O)N1 MCULE-9790180398 [0,1,0,1,0,0|2,0,0]=4 2693 B7R1.2 CN1CCC(=O)C1 MCULE-4017029823 [0,1,0,1,0,0|2,0,0]=4 2694 B7R1.2 CN1CCC(=O)C1 MCULE-8684002131 [0,1,0,1,0,0|2,0,0]=4 2695 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-1621276410 [0,1,0,1,0,0|2,0,0]=4 2696 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-8721208019 [0,1,0,1,0,0|2,0,0]=4 2697 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-2915942259 [0,1,0,1,0,0|2,0,0]=4 2698 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-8123247569 [0,1,0,1,0,0|2,0,0]=4 2699 B7R1.2 C[C@@H]1CCC(=O)O1 MCULE-5934008113 [0,1,0,1,0,0|2,0,0]=4 2700 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-3272300487 [0,1,0,1,0,0|2,0,0]=4 2701 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-4583858198 [0,1,0,1,0,0|2,0,0]=4 2702 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-5135895304 [0,1,0,1,0,0|2,0,0]=4 2703 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-6058896534 [0,1,0,1,0,0|2,0,0]=4 2704 B7R1.2 C[C@H]1CCC(=O)C1 MCULE-7319626625 [0,1,0,1,0,0|2,0,0]=4 2705 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-2618122031 [0,1,0,1,0,0|2,0,0]=4 2706 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-6630066118 [0,1,0,1,0,0|2,0,0]=4 2707 B7R1.2 C[C@H]1CCC(=O)O1 MCULE-5274272771 [0,1,0,1,0,0|2,0,0]=4 2708 B7R1.2 NC1=NC(=O)CO1 MCULE-5739646901 [0,1,0,1,0,0|1,0,1]=4 2709 B7R1.2 NC1CCC(=O)C1 MCULE-5102535286 [0,1,0,1,0,0|2,0,0]=4 2710 B7R1.2 NC1CCC(=O)C1 MCULE-7722818264 [0,1,0,1,0,0|2,0,0]=4 2711 B7R1.2 NC1CCC(=O)N1 MCULE-1843033026 [0,1,0,1,0,0|2,0,0]=4 2712 B7R1.2 NC1CCC(=O)N1 MCULE-7671057220 [0,1,0,1,0,0|2,0,0]=4 2713 B7R1.2 NC1NC(=O)CS1 MCULE-5789159592 [0,1,0,1,0,0|1,1,0]=4 2714 B7R1.2 O=C1C=C(CC1)O MCULE-4815747510 [0,1,0,1,0,0|1,0,1]=4 2715 B7R1.2 O=C1C=CC(C1)O MCULE-6464451546 [0,1,0,1,0,0|1,0,1]=4 2716 B7R1.2 O=C1C=CC(O1)O MCULE-7170809381 [0,1,0,1,0,0|1,0,1]=4 2717 B7R1.2 O=C1C=C[C@@H](C1)O MCULE-4535052390 [0,1,0,1,0,0|1,0,1]=4 2718 B7R1.2 O=C1C=C[C@H](C1)O MCULE-9347047598 [0,1,0,1,0,0|1,0,1]=4 2719 B7R1.2 O=C1CC(=CO1)O MCULE-3691688750 [0,1,0,1,0,0|2,0,0]=4 2720 B7R1.2 O=C1CC(CN1)O MCULE-8498039777 [0,1,0,1,0,0|2,0,0]=4 2721 B7R1.2 O=C1CC(CO1)O MCULE-3779919332 [0,1,0,1,0,0|2,0,0]=4 2722 B7R1.2 O=C1CC(CO1)O MCULE-5609071664 [0,1,0,1,0,0|2,0,0]=4 2723 B7R1.2 O=C1CCC(=O)C1 MCULE-6436831689 [0,1,0,1,0,0|1,0,1]=4 2724 B7R1.2 O=C1CCC(C1)F MCULE-9585894610 [0,1,0,1,0,0|2,0,0]=4 2725 B7R1.2 O=C1CCC(C1)I MCULE-5558007377 [0,1,0,1,0,0|2,0,0]=4 2726 B7R1.2 O=C1CCC(C1)O MCULE-8500536547 [0,1,0,1,0,0|1,0,0]=3 2727 B7R1.2 O=C1CCC(N1)O MCULE-1790956080 [0,1,0,1,0,0|1,0,0]=3 2728 B7R1.2 O=C1CCC(O1)F MCULE-6874239017 [0,1,0,1,0,0|2,0,0]=4 2729 B7R1.2 O=C1CCC(O1)O MCULE-5296344468 [0,1,0,1,0,0|1,0,0]=3 2730 B7R1.2 O=C1CNC(=O)C1 MCULE-6981924013 [0,1,0,1,0,0|1,0,1]=4 2731 B7R1.2 O=C1CNC(S1)S MCULE-9237115672 [0,1,0,1,0,0|1,1,0]=4 2732 B7R1.2 O=C1COC(=O)C1 MCULE-3258090872 [0,1,0,1,0,0|0,0,1]=3 2733 B7R1.2 O=C1COC(=O)N1 MCULE-3103815953 [0,1,0,1,0,0|0,0,2]=4 2734 B7R1.2 O=C1COC(=O)[N-]1 MCULE-2786348217 [0,1,0,1,0,0|0,0,2]=4 2735 B7R1.2 O=C1C[C@@H](CN1)O MCULE-2016792324 [0,1,0,1,0,0|2,0,0]=4 2736 B7R1.2 O=C1C[C@@H](CN1)O MCULE-9756194758 [0,1,0,1,0,0|2,0,0]=4 2737 B7R1.2 O=C1C[C@@H](CO1)O MCULE-1467506377 [0,1,0,1,0,0|2,0,0]=4 2738 B7R1.2 O=C1C[C@@H](CO1)O MCULE-3668466479 [0,1,0,1,0,0|2,0,0]=4 2739 B7R1.2 O=C1C[C@H](CN1)O MCULE-2017150152 [0,1,0,1,0,0|2,0,0]=4 2740 B7R1.2 O=C1C[C@H](CN1)O MCULE-5168961542 [0,1,0,1,0,0|2,0,0]=4 2741 B7R1.2 O=C1C[C@H](CO1)O MCULE-5756899897 [0,1,0,1,0,0|2,0,0]=4 2742 B7R1.2 O=C1C[C@H](CO1)O MCULE-6247095672 [0,1,0,1,0,0|2,0,0]=4 2743 B7R1.2 [C@H]1(CCC(=O)C1)C MCULE-3827565169 [0,1,0,1,0,0|2,0,0]=4 2744 B7R1.3 BrC1=CCOCC1 MCULE-7609274912 [0,1,0,1,0,0|2,0,0]=4 2745 B7R1.3 C=C1CCCOC1 MCULE-5236529273 [0,1,0,1,0,0|2,0,0]=4 2746 B7R1.3 C=C1CCOCC1 MCULE-2744722311 [0,1,0,1,0,0|2,0,0]=4 2747 B7R1.3 O=C1C=CCOC1 MCULE-4817981961 [0,1,0,1,0,0|1,0,1]=4 2748 B7R1.3 O=C1C=COCC1 MCULE-2954829305 [0,1,0,1,0,0|1,0,1]=4 2749 B7R1.3 O=C1C=COCN1 MCULE-7471476237 [0,1,0,1,0,0|1,0,1]=4 2750 B7R1.3 O=C1CC=CCN1 MCULE-7370958955 [0,1,0,1,0,0|2,0,0]=4 2751 B7R1.3 O=C1CC=COC1 MCULE-3434064170 [0,1,0,1,0,0|1,0,0]=3 2752 B7R1.3 O=C1CCCCC1 MCULE-5664385838 [0,1,0,1,0,0|2,0,0]=4 2753 B7R1.3 O=C1CCCCN1 MCULE-9168245534 [0,1,0,1,0,0|2,0,0]=4 2754 B7R1.3 O=C1CCCCO1 MCULE-4682307363 [0,1,0,1,0,0|2,0,0]=4 2755 B7R1.3 O=C1CCCCS1 MCULE-5383777119 [0,1,0,1,0,0|2,0,0]=4 2756 B7R1.3 O=C1CCCNC1 MCULE-2774326662 [0,1,0,1,0,0|2,0,0]=4 2757 B7R1.3 O=C1CCCNC1 MCULE-8149766009 [0,1,0,1,0,0|2,0,0]=4 2758 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [0,1,0,1,0,0|1,0,0]=3 2759 B7R1.3 O=C1CCCSC1 MCULE-1649390503 [0,1,0,1,0,0|1,1,0]=4 2760 B7R1.3 O=C1CCNCC1 MCULE-7526186270 [0,1,0,1,0,0|2,0,0]=4 2761 B7R1.3 O=C1CCNCC1 MCULE-9761063200 [0,1,0,1,0,0|2,0,0]=4 2762 B7R1.3 O=C1CCNCN1 MCULE-5793765281 [0,1,0,1,0,0|2,0,0]=4 2763 B7R1.3 O=C1CCOCC1 MCULE-6728095514 [0,1,0,1,0,0|1,0,0]=3 2764 B7R1.3 O=C1CCSCC1 MCULE-8638366518 [0,1,0,1,0,0|1,1,0]=4 2765 B7R1.3 O=C1CNCCN1 MCULE-5599978871 [0,1,0,1,0,0|2,0,0]=4 2766 B7R1.3 O=C1CNCCO1 MCULE-2634056082 [0,1,0,1,0,0|2,0,0]=4 2767 B7R1.3 O=C1CNCCO1 MCULE-6420255529 [0,1,0,1,0,0|2,0,0]=4 2768 B7R1.3 O=C1COCCN1 MCULE-8242898041 [0,1,0,1,0,0|1,0,0]=3 2769 B7R1.3 O=C1COCCO1 MCULE-5754504096 [0,1,0,1,0,0|1,0,0]=3 2770 B7R1.3 O=C1CSCCN1 MCULE-1492056440 [0,1,0,1,0,0|1,1,0]=4 2771 B7R1.3 O=C1CSCSC1 MCULE-8034252746 [0,1,0,1,0,0|0,2,0]=4 2772 B7R1.3 O=S1CCOCC1 MCULE-4979531002 [0,1,0,1,0,0|2,0,0]=4 2773 B7R1.3 OC1COCOC1 MCULE-1056094446 [0,1,0,1,0,0|0,0,2]=4 2774 B7R1.3 S=C1COCCN1 MCULE-1743172522 [0,1,0,1,0,0|1,1,0]=4 2775 B7R1.4 C1(CCNC1=O)N MCULE-4906952813 [0,1,0,1,0,0|2,0,0]=4 2776 B7R1.4 C1(CCNC1=O)N MCULE-9500853209 [0,1,0,1,0,0|2,0,0]=4 2777 B7R1.4 C=C1CCCC1O MCULE-3026250203 [0,1,0,1,0,0|2,0,0]=4 2778 B7R1.4 C=C1COCC1N MCULE-4632261286 [0,1,0,1,0,0|2,0,0]=4 2779 B7R1.4 C=C1COCC1N MCULE-7153575301 [0,1,0,1,0,0|2,0,0]=4 2780 B7R1.4 CC1CCCC1=O MCULE-3710290162 [0,1,0,1,0,0|2,0,0]=4 2781 B7R1.4 CC1CCNC1=O MCULE-7799644249 [0,1,0,1,0,0|2,0,0]=4 2782 B7R1.4 CC1CCOC1=O MCULE-2223078294 [0,1,0,1,0,0|2,0,0]=4 2783 B7R1.4 CC1CNCC1=O MCULE-2728909327 [0,1,0,1,0,0|2,0,0]=4 2784 B7R1.4 CC1CNCC1=O MCULE-9172381840 [0,1,0,1,0,0|2,0,0]=4 2785 B7R1.4 CC1COCC1=O MCULE-8115238635 [0,1,0,1,0,0|1,0,0]=3 2786 B7R1.4 CC1COCC1O MCULE-5925280081 [0,1,0,1,0,0|1,0,1]=4 2787 B7R1.4 CC1CSCC1=O MCULE-5611423322 [0,1,0,1,0,0|1,1,0]=4 2788 B7R1.4 CC1NCCC1=O MCULE-4206844406 [0,1,0,1,0,0|2,0,0]=4 2789 B7R1.4 CC1NCCC1=O MCULE-7025918222 [0,1,0,1,0,0|2,0,0]=4 2790 B7R1.4 CC1OCCC1=O MCULE-8278816952 [0,1,0,1,0,0|1,0,0]=3 2791 B7R1.4 CC1SCCC1=O MCULE-5264322365 [0,1,0,1,0,0|1,1,0]=4 2792 B7R1.4 C[C@@H]1CCNC1=O MCULE-1037883660 [0,1,0,1,0,0|2,0,0]=4 2793 B7R1.4 C[C@@H]1COC[C@@H]1O MCULE-3198029643 [0,1,0,1,0,0|1,0,1]=4 2794 B7R1.4 C[C@@H]1COC[C@H]1O MCULE-1967963278 [0,1,0,1,0,0|1,0,1]=4 2795 B7R1.4 C[C@H]1CCNC1=O MCULE-9500360544 [0,1,0,1,0,0|2,0,0]=4 2796 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-3765921602 [0,1,0,1,0,0|1,0,1]=4 2797 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-5201903195 [0,1,0,1,0,0|1,0,1]=4 2798 B7R1.4 C[C@H]1COC[C@H]1O MCULE-2974083166 [0,1,0,1,0,0|1,0,1]=4 2799 B7R1.4 C[C@H]1COC[C@H]1O MCULE-6725207001 [0,1,0,1,0,0|1,0,1]=4 2800 B7R1.4 NC1CCCC1=O MCULE-3654949473 [0,1,0,1,0,0|2,0,0]=4 2801 B7R1.4 NC1CCCC1=O MCULE-6579965788 [0,1,0,1,0,0|2,0,0]=4 2802 B7R1.4 NC1CCNC1=O MCULE-2061829370 [0,1,0,1,0,0|2,0,0]=4 2803 B7R1.4 NC1CCNC1=O MCULE-4272585488 [0,1,0,1,0,0|2,0,0]=4 2804 B7R1.4 NC1CCOC1=O MCULE-1011670330 [0,1,0,1,0,0|2,0,0]=4 2805 B7R1.4 NC1CCOC1=O MCULE-1366805966 [0,1,0,1,0,0|2,0,0]=4 2806 B7R1.4 NC1CCOC1=O MCULE-1874490478 [0,1,0,1,0,0|2,0,0]=4 2807 B7R1.4 NC1CCOC1=O MCULE-4434379753 [0,1,0,1,0,0|2,0,0]=4 2808 B7R1.4 NC1CCOC1=O MCULE-7302633352 [0,1,0,1,0,0|2,0,0]=4 2809 B7R1.4 NC1CCOC1=O MCULE-8009953591 [0,1,0,1,0,0|2,0,0]=4 2810 B7R1.4 NC1CCSC1=O MCULE-5181497015 [0,1,0,1,0,0|2,0,0]=4 2811 B7R1.4 NC1CCSC1=O MCULE-8775141567 [0,1,0,1,0,0|2,0,0]=4 2812 B7R1.4 NC1COCC1O MCULE-3115911209 [0,1,0,1,0,0|1,0,1]=4 2813 B7R1.4 NC1COCC1O MCULE-9837103399 [0,1,0,1,0,0|1,0,1]=4 2814 B7R1.4 NC1CONC1=O MCULE-3118867985 [0,1,0,1,0,0|2,0,0]=4 2815 B7R1.4 NC1CONC1=O MCULE-3159218372 [0,1,0,1,0,0|2,0,0]=4 2816 B7R1.4 N[C@@H]1CCNC1=O MCULE-2357766642 [0,1,0,1,0,0|2,0,0]=4 2817 B7R1.4 N[C@@H]1CCNC1=O MCULE-9089591546 [0,1,0,1,0,0|2,0,0]=4 2818 B7R1.4 N[C@@H]1CCNC1=O MCULE-9558758567 [0,1,0,1,0,0|2,0,0]=4 2819 B7R1.4 N[C@@H]1CCNC1=O MCULE-9668255740 [0,1,0,1,0,0|2,0,0]=4 2820 B7R1.4 N[C@@H]1CCOC1=O MCULE-1027751896 [0,1,0,1,0,0|2,0,0]=4 2821 B7R1.4 N[C@@H]1CCOC1=O MCULE-4034349263 [0,1,0,1,0,0|2,0,0]=4 2822 B7R1.4 N[C@@H]1CCOC1=O MCULE-8790782772 [0,1,0,1,0,0|2,0,0]=4 2823 B7R1.4 N[C@@H]1CCOC1=O MCULE-9300265861 [0,1,0,1,0,0|2,0,0]=4 2824 B7R1.4 N[C@@H]1CCSC1=O MCULE-1269968791 [0,1,0,1,0,0|2,0,0]=4 2825 B7R1.4 N[C@@H]1CCSC1=O MCULE-5374422420 [0,1,0,1,0,0|2,0,0]=4 2826 B7R1.4 N[C@@H]1CCSC1=O MCULE-8203732076 [0,1,0,1,0,0|2,0,0]=4 2827 B7R1.4 N[C@@H]1CCSC1=O MCULE-8418670804 [0,1,0,1,0,0|2,0,0]=4 2828 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-2891920420 [0,1,0,1,0,0|1,0,1]=4 2829 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-5764643856 [0,1,0,1,0,0|1,0,1]=4 2830 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-1399984261 [0,1,0,1,0,0|1,0,1]=4 2831 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-2321912677 [0,1,0,1,0,0|1,0,1]=4 2832 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-4422404071 [0,1,0,1,0,0|1,0,1]=4 2833 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-7801515292 [0,1,0,1,0,0|1,0,1]=4 2834 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9112718041 [0,1,0,1,0,0|1,0,1]=4 2835 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9447703783 [0,1,0,1,0,0|1,0,1]=4 2836 B7R1.4 N[C@@H]1CONC1=O MCULE-4212827696 [0,1,0,1,0,0|2,0,0]=4 2837 B7R1.4 N[C@@H]1CONC1=O MCULE-6014142329 [0,1,0,1,0,0|2,0,0]=4 2838 B7R1.4 N[C@H]1CCNC1=O MCULE-2327147408 [0,1,0,1,0,0|2,0,0]=4 2839 B7R1.4 N[C@H]1CCNC1=O MCULE-2923469662 [0,1,0,1,0,0|2,0,0]=4 2840 B7R1.4 N[C@H]1CCNC1=O MCULE-5882745021 [0,1,0,1,0,0|2,0,0]=4 2841 B7R1.4 N[C@H]1CCNC1=O MCULE-7846724738 [0,1,0,1,0,0|2,0,0]=4 2842 B7R1.4 N[C@H]1CCOC1=O MCULE-4393293388 [0,1,0,1,0,0|2,0,0]=4 2843 B7R1.4 N[C@H]1CCOC1=O MCULE-4751602783 [0,1,0,1,0,0|2,0,0]=4 2844 B7R1.4 N[C@H]1CCOC1=O MCULE-7924572479 [0,1,0,1,0,0|2,0,0]=4 2845 B7R1.4 N[C@H]1CCOC1=O MCULE-8545644747 [0,1,0,1,0,0|2,0,0]=4 2846 B7R1.4 N[C@H]1CCOC1=O MCULE-8634641228 [0,1,0,1,0,0|2,0,0]=4 2847 B7R1.4 N[C@H]1CCSC1=O MCULE-4497814170 [0,1,0,1,0,0|2,0,0]=4 2848 B7R1.4 N[C@H]1CCSC1=O MCULE-6209097230 [0,1,0,1,0,0|2,0,0]=4 2849 B7R1.4 N[C@H]1CCSC1=O MCULE-6419348515 [0,1,0,1,0,0|2,0,0]=4 2850 B7R1.4 N[C@H]1CCSC1=O MCULE-9091827364 [0,1,0,1,0,0|2,0,0]=4 2851 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-1604156911 [0,1,0,1,0,0|1,0,1]=4 2852 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-3157811195 [0,1,0,1,0,0|1,0,1]=4 2853 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-4377495223 [0,1,0,1,0,0|1,0,1]=4 2854 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-8412403655 [0,1,0,1,0,0|1,0,1]=4 2855 B7R1.4 N[C@H]1COC[C@H]1O MCULE-5907972681 [0,1,0,1,0,0|1,0,1]=4 2856 B7R1.4 N[C@H]1COC[C@H]1O MCULE-7502895716 [0,1,0,1,0,0|1,0,1]=4 2857 B7R1.4 N[C@H]1COC[C@H]1O MCULE-8985833831 [0,1,0,1,0,0|1,0,1]=4 2858 B7R1.4 N[C@H]1COC[C@H]1O MCULE-9971794275 [0,1,0,1,0,0|1,0,1]=4 2859 B7R1.4 N[C@H]1CONC1=O MCULE-4286940154 [0,1,0,1,0,0|2,0,0]=4 2860 B7R1.4 N[C@H]1CONC1=O MCULE-9925977120 [0,1,0,1,0,0|2,0,0]=4 2861 B7R1.4 O=C1CCC=C1O MCULE-8745661989 [0,1,0,1,0,0|1,0,1]=4 2862 B7R1.4 O=C1CCCC1Br MCULE-3651373380 [0,1,0,1,0,0|2,0,0]=4 2863 B7R1.4 O=C1CCCC1Cl MCULE-7745647260 [0,1,0,1,0,0|2,0,0]=4 2864 B7R1.4 O=C1CCCC1F MCULE-8001765295 [0,1,0,1,0,0|2,0,0]=4 2865 B7R1.4 O=C1CCCC1O MCULE-6795188798 [0,1,0,1,0,0|1,0,0]=3 2866 B7R1.4 O=C1NCCC1Br MCULE-5321265801 [0,1,0,1,0,0|2,0,0]=4 2867 B7R1.4 O=C1NCCC1Cl MCULE-1663035789 [0,1,0,1,0,0|2,0,0]=4 2868 B7R1.4 O=C1NCCC1F MCULE-2209899044 [0,1,0,1,0,0|2,0,0]=4 2869 B7R1.4 O=C1NCCC1O MCULE-8818841339 [0,1,0,1,0,0|1,0,0]=3 2870 B7R1.4 O=C1NCCC1O MCULE-9662824811 [0,1,0,1,0,0|1,0,0]=3 2871 B7R1.4 O=C1NCC[C@@H]1O MCULE-3212474164 [0,1,0,1,0,0|1,0,0]=3 2872 B7R1.4 O=C1NCC[C@@H]1O MCULE-7816291255 [0,1,0,1,0,0|1,0,0]=3 2873 B7R1.4 O=C1NCC[C@H]1O MCULE-1281835510 [0,1,0,1,0,0|1,0,0]=3 2874 B7R1.4 O=C1NCC[C@H]1O MCULE-6809356348 [0,1,0,1,0,0|1,0,0]=3 2875 B7R1.4 O=C1OCCC1Br MCULE-8316114331 [0,1,0,1,0,0|2,0,0]=4 2876 B7R1.4 O=C1OCCC1O MCULE-2144002601 [0,1,0,1,0,0|1,0,0]=3 2877 B7R1.4 O=C1OCCC1S MCULE-2130434062 [0,1,0,1,0,0|1,1,0]=4 2878 B7R1.4 O=C1OCC[C@@H]1O MCULE-7764011790 [0,1,0,1,0,0|1,0,0]=3 2879 B7R1.4 O=C1OCC[C@@H]1O MCULE-9001729998 [0,1,0,1,0,0|1,0,0]=3 2880 B7R1.4 O=C1OCC[C@H]1O MCULE-6949645282 [0,1,0,1,0,0|1,0,0]=3 2881 B7R1.4 O=C1OCC[C@H]1O MCULE-7110242636 [0,1,0,1,0,0|1,0,0]=3 2882 B7R1.4 OC1CCC=C1Br MCULE-2577502971 [0,1,0,1,0,0|2,0,0]=4 2883 B7R1.4 OC1COCC1Br MCULE-8642236751 [0,1,0,1,0,0|1,0,1]=4 2884 B7R1.4 OC1COCC1F MCULE-3255803142 [0,1,0,1,0,0|1,0,1]=4 2885 B7R1.4 OC1COCC1O MCULE-2982401803 [0,1,0,1,0,0|0,0,2]=4 2886 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-2460253154 [0,1,0,1,0,0|1,0,1]=4 2887 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-3624406213 [0,1,0,1,0,0|1,0,1]=4 2888 B7R1.4 O[C@@H]1COC[C@H]1O MCULE-5846282762 [0,1,0,1,0,0|0,0,2]=4 2889 B7R1.4 O[C@H]1COC[C@@H]1F MCULE-7724910066 [0,1,0,1,0,0|1,0,1]=4 2890 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-2140544466 [0,1,0,1,0,0|0,0,2]=4 2891 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-9526811966 [0,1,0,1,0,0|0,0,2]=4 2892 B7R1.4 O[C@H]1COC[C@H]1O MCULE-2862505352 [0,1,0,1,0,0|0,0,2]=4 2893 B7R1.4 [NH3+][C@H]1CCOC1=O MCULE-8903471982 [0,1,0,1,0,0|2,0,0]=4 2894 B7R1.6 COC=C1COC1 MCULE-5631176777 [0,1,0,1,0,0|1,0,1]=4 2895 B7R1.6 OCCC1COC1 MCULE-2515762048 [0,1,0,1,0,0|1,0,1]=4 2896 B7R1.8 CCC1CCC1=O MCULE-5109615435 [0,1,0,1,0,0|2,0,0]=4 2897 B7R1.8 COC1CCC1=O MCULE-6511996246 [0,1,0,1,0,0|1,0,0]=3 2898 B7R1.8 CSC1CCC1=O MCULE-3892720319 [0,1,0,1,0,0|1,1,0]=4 2899 B7R1.8 N#CC1CCC1=O MCULE-3371494435 [0,1,0,1,0,0|2,0,0]=4 2900 B7R1.8 O=C1CCC1CO MCULE-5501600764 [0,1,0,1,0,0|1,0,0]=3 2901 B7R1.8 O=C1CC[C@@H]1CO MCULE-9840363539 [0,1,0,1,0,0|1,0,0]=3 2902 B7R1.8 OCC1CCC1O MCULE-9764745395 [0,1,0,1,0,0|1,0,1]=4 2903 B7R1.8 OC[C@@H]1CC[C@H]1O MCULE-5043281368 [0,1,0,1,0,0|1,0,1]=4 2904 B7R1.8 OC[C@H]1CC[C@H]1O MCULE-1536326248 [0,1,0,1,0,0|1,0,1]=4 2905 B7R1.9 OCC1CC1CO MCULE-5153064657 [0,1,0,1,0,0|1,0,1]=4 2906 B7R1.9 OC[C@H]1C[C@H]1CO MCULE-9036138013 [0,1,0,1,0,0|1,0,1]=4 2907 B7R1.10 OCC1CC(C1)O MCULE-3885216336 [0,1,0,1,0,0|1,0,1]=4 2908 B7R1.10 OC[C@H]1C[C@H](C1)O MCULE-2350233032 [0,1,0,1,0,0|1,0,1]=4 2909 B7R1.15 CC1CC(=O)C1C MCULE-1068922218 [0,1,0,1,0,0|2,0,0]=4 2910 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2032555036 [0,1,0,1,0,0|2,0,0]=4 2911 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2738127555 [0,1,0,1,0,0|2,0,0]=4 2912 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-5044901082 [0,1,0,1,0,0|2,0,0]=4 2913 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-7632990759 [0,1,0,1,0,0|2,0,0]=4 2914 B7R1.21 COCC1(CO1)C MCULE-8694642597 [0,1,0,1,0,0|1,0,1]=4 2915 B7R1.22 C1(CO1)C(=O)OC MCULE-1350193594 [0,1,0,1,0,0|2,0,0]=4 2916 B7R1.22 CCC(=O)C1CC1 MCULE-6231785303 [0,1,0,1,0,0|2,0,0]=4 2917 B7R1.22 COC(=O)C1CO1 MCULE-1745412030 [0,1,0,1,0,0|2,0,0]=4 2918 B7R1.22 COC(=O)[C@@H]1CO1 MCULE-2259836812 [0,1,0,1,0,0|2,0,0]=4 2919 B7R1.22 COC(=O)[C@H]1CO1 MCULE-5568309714 [0,1,0,1,0,0|2,0,0]=4 2920 B7R1.22 COC(=O)[C@H]1CO1 MCULE-9432053348 [0,1,0,1,0,0|2,0,0]=4 2921 B7R1.22 NCC(=O)C1CC1 MCULE-1927654168 [0,1,0,1,0,0|2,0,0]=4 2922 B7R1.22 NCC(=O)C1CC1 MCULE-4415662894 [0,1,0,1,0,0|2,0,0]=4 2923 B7R1.22 O=C(CBr)C1CC1 MCULE-1037373080 [0,1,0,1,0,0|2,0,0]=4 2924 B7R1.22 O=C(CCl)C1CC1 MCULE-9791345328 [0,1,0,1,0,0|2,0,0]=4 2925 B7R1.22 O=C(CCl)N1CC1 MCULE-3092013537 [0,1,0,1,0,0|2,0,0]=4 2926 B7R1.22 O=C(CO)C1CC1 MCULE-4276266642 [0,1,0,1,0,0|1,0,0]=3 2927 B7R1.22 O=C(NO)C1CC1 MCULE-2299815322 [0,1,0,1,0,0|2,0,0]=4 2928 B7R1.22 [C@H]1(CO1)C(=O)OC MCULE-2114123664 [0,1,0,1,0,0|2,0,0]=4 2929 B7R1.25 CC1(CCO1)CO MCULE-6424264752 [0,1,0,1,0,0|1,0,1]=4 2930 B7R1.25 CC1(COC1)CO MCULE-5859568263 [0,1,0,1,0,0|1,0,1]=4 2931 B7R1.25 C[C@@]1(CCO1)CO MCULE-4685471926 [0,1,0,1,0,0|1,0,1]=4 2932 B7R1.25 C[C@@]1(CCO1)CO MCULE-5799098537 [0,1,0,1,0,0|1,0,1]=4 2933 B7R1.25 C[C@]1(CCO1)CO MCULE-5749345841 [0,1,0,1,0,0|1,0,1]=4 2934 B7R1.25 NC1(COC1)CO MCULE-5347414182 [0,1,0,1,0,0|1,0,1]=4 2935 B7R1.25 OCC1(COC1)F MCULE-9098723776 [0,1,0,1,0,0|1,0,1]=4 2936 B7R1.25 OCC1(COC1)O MCULE-4207928663 [0,1,0,1,0,0|0,0,2]=4 2937 B7R1.17 CC1(CCC1=O)C MCULE-3723871956 [0,1,0,1,0,0|2,0,0]=4 2938 B7R1.17 CC1(OCC1=O)C MCULE-5758313494 [0,1,0,1,0,0|1,0,0]=3 2939 B7R1.17 O=C1CCC1(Br)Br MCULE-8976658449 [0,1,0,1,0,0|2,0,0]=4 2940 B7R1.17 O=C1CCC1(F)F MCULE-4827224161 [0,1,0,1,0,0|2,0,0]=4 2941 B7R1.18 CC(O)C1COC1 MCULE-4981198639 [0,1,0,1,0,0|1,0,1]=4 2942 B7R1.18 C[C@@H](O)C1COC1 MCULE-5223611242 [0,1,0,1,0,0|1,0,1]=4 2943 B7R1.18 C[C@@H](O)C1COC1 MCULE-5819578881 [0,1,0,1,0,0|1,0,1]=4 2944 B7R1.18 C[C@H](O)C1COC1 MCULE-1396791034 [0,1,0,1,0,0|1,0,1]=4 2945 B7R1.18 C[C@H](O)C1COC1 MCULE-8805369596 [0,1,0,1,0,0|1,0,1]=4 2946 B7R1.29 OCC1(CC1)CO MCULE-9312932144 [0,1,0,1,0,0|1,0,1]=4 2947 B7R2.16 C1OCC12CO2 MCULE-4629544610 [0,0,0,2,0,0|1,0,1]=4