0 B5R0.1 C#CCC(=O)O MCULE-4680699666 [0,0,0,0,0,0|1,0,3]=4 1 B5R0.1 C(C)(N)CCC MCULE-4800297905 [0,0,0,0,0,0|1,0,3]=4 2 B5R0.1 C(C)(N)CCC MCULE-7674864567 [0,0,0,0,0,0|1,0,3]=4 3 B5R0.1 C/C(=C/C#N)/N MCULE-2195544039 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.1 C/C(=C/CI)/I MCULE-4907089043 [0,0,0,0,0,0|2,0,1]=3 5 B5R0.1 C/C(=C/CN)/Cl MCULE-1091573118 [0,0,0,0,0,0|2,0,1]=3 6 B5R0.1 C/C(=C/CN)/Cl MCULE-8112023611 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.1 C/C(=C\CCl)/Cl MCULE-6679259233 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.1 C/C=C/B(O)O MCULE-6649221952 [0,0,0,0,0,0|2,0,1]=3 9 B5R0.1 C/C=C/C(=O)C MCULE-2109656516 [0,0,0,0,0,0|0,0,0]=0 10 B5R0.1 C/C=C/C(=O)Cl MCULE-8378824386 [0,0,0,0,0,0|1,0,0]=1 11 B5R0.1 C/C=C/C(=O)N MCULE-2532228624 [0,0,0,0,0,0|1,0,0]=1 12 B5R0.1 C/C=C/C(=O)O MCULE-6937494852 [0,0,0,0,0,0|1,0,0]=1 13 B5R0.1 C/C=C/C(C)C MCULE-8705863155 [0,0,0,0,0,0|1,0,1]=2 14 B5R0.1 C/C=C/C(C)O MCULE-3191147789 [0,0,0,0,0,0|0,0,2]=2 15 B5R0.1 C/C=C\B(O)O MCULE-3000711987 [0,0,0,0,0,0|2,0,1]=3 16 B5R0.1 C=C(Br)COC MCULE-5349428431 [0,0,0,0,0,0|2,0,2]=4 17 B5R0.1 C=C(C)CCBr MCULE-3439794005 [0,0,0,0,0,0|2,0,2]=4 18 B5R0.1 C=C(C)CCC MCULE-8225129744 [0,0,0,0,0,0|1,0,2]=3 19 B5R0.1 C=C(C)CCCl MCULE-2816016781 [0,0,0,0,0,0|2,0,2]=4 20 B5R0.1 C=C(C)CCI MCULE-6317205481 [0,0,0,0,0,0|2,0,2]=4 21 B5R0.1 C=C(C)CCN MCULE-4037025602 [0,0,0,0,0,0|2,0,2]=4 22 B5R0.1 C=C(C)CCN MCULE-5001503744 [0,0,0,0,0,0|2,0,2]=4 23 B5R0.1 C=C(C)CCO MCULE-2689800711 [0,0,0,0,0,0|2,0,2]=4 24 B5R0.1 C=C(C)CNC MCULE-6783886553 [0,0,0,0,0,0|2,0,1]=3 25 B5R0.1 C=C(C)CNC MCULE-8292313282 [0,0,0,0,0,0|2,0,1]=3 26 B5R0.1 C=C(C)CNN MCULE-1117931770 [0,0,0,0,0,0|3,0,1]=4 27 B5R0.1 C=C(C)CON MCULE-2773974323 [0,0,0,0,0,0|3,0,1]=4 28 B5R0.1 C=C(C)CON MCULE-5978680243 [0,0,0,0,0,0|3,0,1]=4 29 B5R0.1 C=C(C)OCC MCULE-5303468686 [0,0,0,0,0,0|2,0,1]=3 30 B5R0.1 C=CC=C(C)C MCULE-7590870659 [0,0,0,0,0,0|1,0,1]=2 31 B5R0.1 C=CC=C(Cl)Cl MCULE-3787858961 [0,0,0,0,0,0|2,0,1]=3 32 B5R0.1 C=CCC(=C)C MCULE-6294070836 [0,0,0,0,0,0|1,0,2]=3 33 B5R0.1 C=CCC(=N)N MCULE-6305125234 [0,0,0,0,0,0|2,0,2]=4 34 B5R0.1 C=CCC(=O)Cl MCULE-6033189203 [0,0,0,0,0,0|1,0,2]=3 35 B5R0.1 C=CCC(=O)N MCULE-1205335257 [0,0,0,0,0,0|1,0,2]=3 36 B5R0.1 C=CCC(=O)O MCULE-6288979337 [0,0,0,0,0,0|1,0,2]=3 37 B5R0.1 C=CCC(C)Br MCULE-5638987302 [0,0,0,0,0,0|1,0,3]=4 38 B5R0.1 C=CCC(C)C MCULE-4586731422 [0,0,0,0,0,0|1,0,3]=4 39 B5R0.1 C=CCC(C)N MCULE-5354228552 [0,0,0,0,0,0|1,0,3]=4 40 B5R0.1 C=CCC(C)N MCULE-9454660067 [0,0,0,0,0,0|1,0,3]=4 41 B5R0.1 C=CCC(C)O MCULE-7724200334 [0,0,0,0,0,0|0,0,4]=4 42 B5R0.1 C=CCC(C)O MCULE-9910771503 [0,0,0,0,0,0|0,0,4]=4 43 B5R0.1 C=CCN(C)C MCULE-6958853335 [0,0,0,0,0,0|2,0,2]=4 44 B5R0.1 C=CC[C@@H](C)O MCULE-1663575568 [0,0,0,0,0,0|0,0,4]=4 45 B5R0.1 C=CC[C@@H](C)O MCULE-3971480179 [0,0,0,0,0,0|0,0,4]=4 46 B5R0.1 C=CC[C@H](C)N MCULE-2398654329 [0,0,0,0,0,0|1,0,3]=4 47 B5R0.1 C=CC[C@H](C)N MCULE-5817451810 [0,0,0,0,0,0|1,0,3]=4 48 B5R0.1 C=CC[C@H](C)O MCULE-5783959808 [0,0,0,0,0,0|0,0,4]=4 49 B5R0.1 C=CC[C@H](C)O MCULE-6146696600 [0,0,0,0,0,0|0,0,4]=4 50 B5R0.1 C=CNC(=O)C MCULE-1260296806 [0,0,0,0,0,0|1,0,1]=2 51 B5R0.1 C=CNC(=O)N MCULE-4235216182 [0,0,0,0,0,0|2,0,1]=3 52 B5R0.1 C=COC(=O)C MCULE-7626795765 [0,0,0,0,0,0|1,0,1]=2 53 B5R0.1 C=COC(=O)Cl MCULE-9915729615 [0,0,0,0,0,0|2,0,1]=3 54 B5R0.1 C=COC(C)C MCULE-6339383821 [0,0,0,0,0,0|2,0,2]=4 55 B5R0.1 C=C[CH+]C(=O)[O-] MCULE-7935071431 [0,0,0,0,0,0|1,0,2]=3 56 B5R0.1 C=NCC(=O)N MCULE-7609497329 [0,0,0,0,0,0|2,0,2]=4 57 B5R0.1 CC#CC(=O)C MCULE-4083248904 [0,0,0,0,0,0|0,0,2]=2 58 B5R0.1 CC#CC(=O)Cl MCULE-6807810093 [0,0,0,0,0,0|1,0,2]=3 59 B5R0.1 CC#CC(=O)O MCULE-9994142213 [0,0,0,0,0,0|1,0,2]=3 60 B5R0.1 CC#CC(C)C MCULE-9841369985 [0,0,0,0,0,0|1,0,3]=4 61 B5R0.1 CC#CC(C)O MCULE-5523814936 [0,0,0,0,0,0|0,0,4]=4 62 B5R0.1 CC(=CC#N)C MCULE-7179601066 [0,0,0,0,0,0|2,0,1]=3 63 B5R0.1 CC(=CC#N)N MCULE-7342293837 [0,0,0,0,0,0|2,0,1]=3 64 B5R0.1 CC(=CC=O)C MCULE-7002222435 [0,0,0,0,0,0|2,0,0]=2 65 B5R0.1 CC(=CC=O)Cl MCULE-2279693190 [0,0,0,0,0,0|2,0,0]=2 66 B5R0.1 CC(=CC=O)N MCULE-2659507627 [0,0,0,0,0,0|2,0,0]=2 67 B5R0.1 CC(=CCBr)C MCULE-7961276795 [0,0,0,0,0,0|2,0,1]=3 68 B5R0.1 CC(=CCCl)C MCULE-1110417103 [0,0,0,0,0,0|2,0,1]=3 69 B5R0.1 CC(=CCCl)Cl MCULE-9735045489 [0,0,0,0,0,0|2,0,1]=3 70 B5R0.1 CC(=CCI)I MCULE-4204968539 [0,0,0,0,0,0|2,0,1]=3 71 B5R0.1 CC(=CCN)C MCULE-7220252581 [0,0,0,0,0,0|2,0,1]=3 72 B5R0.1 CC(=CCN)C MCULE-8394581250 [0,0,0,0,0,0|2,0,1]=3 73 B5R0.1 CC(=CCN)Cl MCULE-1749173363 [0,0,0,0,0,0|2,0,1]=3 74 B5R0.1 CC(=CCN)Cl MCULE-5722512850 [0,0,0,0,0,0|2,0,1]=3 75 B5R0.1 CC(=CCO)C MCULE-3984123588 [0,0,0,0,0,0|2,0,1]=3 76 B5R0.1 CC(=CCO)Cl MCULE-6459066496 [0,0,0,0,0,0|2,0,1]=3 77 B5R0.1 CC(=CCO)I MCULE-4600854759 [0,0,0,0,0,0|2,0,1]=3 78 B5R0.1 CC(=CCS)C MCULE-4180446913 [0,0,0,0,0,0|2,0,1]=3 79 B5R0.1 CC(=N)NC#N MCULE-7065360421 [0,0,0,0,0,0|3,0,1]=4 80 B5R0.1 CC(=O)/C=N/O MCULE-5424156575 [0,0,0,0,0,0|2,0,0]=2 81 B5R0.1 CC(=O)/C=N\O MCULE-9083768531 [0,0,0,0,0,0|2,0,0]=2 82 B5R0.1 CC(=O)C=C=O MCULE-4335598177 [0,0,0,0,0,0|1,0,1]=2 83 B5R0.1 CC(=O)C=NO MCULE-5513006918 [0,0,0,0,0,0|2,0,0]=2 84 B5R0.1 CC(=O)CC#N MCULE-7203242552 [0,0,0,0,0,0|1,0,2]=3 85 B5R0.1 CC(=O)CCBr MCULE-2615300206 [0,0,0,0,0,0|1,0,2]=3 86 B5R0.1 CC(=O)CCCl MCULE-8019748964 [0,0,0,0,0,0|1,0,2]=3 87 B5R0.1 CC(=O)CCN MCULE-7550348751 [0,0,0,0,0,0|1,0,2]=3 88 B5R0.1 CC(=O)CCN MCULE-9519063810 [0,0,0,0,0,0|1,0,2]=3 89 B5R0.1 CC(=O)CCO MCULE-6328537335 [0,0,0,0,0,0|1,0,2]=3 90 B5R0.1 CC(=O)N=C=S MCULE-7540453687 [0,0,0,0,0,0|2,0,1]=3 91 B5R0.1 CC(=O)N=S=O MCULE-1420371815 [0,0,0,0,0,0|3,0,0]=3 92 B5R0.1 CC(=O)NC#N MCULE-8444599659 [0,0,0,0,0,0|2,0,1]=3 93 B5R0.1 CC(=O)NCO MCULE-4563335540 [0,0,0,0,0,0|2,0,1]=3 94 B5R0.1 CC(=O)OCBr MCULE-9842804945 [0,0,0,0,0,0|2,0,1]=3 95 B5R0.1 CC(=O)OCCl MCULE-6822222026 [0,0,0,0,0,0|2,0,1]=3 96 B5R0.1 CC(=O)SCBr MCULE-9794607323 [0,0,0,0,0,0|2,0,1]=3 97 B5R0.1 CC(C)/C=N/O MCULE-3201457095 [0,0,0,0,0,0|3,0,1]=4 98 B5R0.1 CC(C)C=NO MCULE-9842574696 [0,0,0,0,0,0|3,0,1]=4 99 B5R0.1 CC(C)CC=O MCULE-2939497534 [0,0,0,0,0,0|2,0,2]=4 100 B5R0.1 CC(C)NC=O MCULE-1764010394 [0,0,0,0,0,0|3,0,1]=4 101 B5R0.1 CC(C)OC=O MCULE-8263698122 [0,0,0,0,0,0|3,0,1]=4 102 B5R0.1 CC=CB(O)O MCULE-7417903348 [0,0,0,0,0,0|2,0,1]=3 103 B5R0.1 CC=CC(=O)C MCULE-4826977340 [0,0,0,0,0,0|0,0,0]=0 104 B5R0.1 CC=CC(=O)Cl MCULE-2747622237 [0,0,0,0,0,0|1,0,0]=1 105 B5R0.1 CC=CC(=O)N MCULE-9693879476 [0,0,0,0,0,0|1,0,0]=1 106 B5R0.1 CC=CC(=O)O MCULE-7970410217 [0,0,0,0,0,0|1,0,0]=1 107 B5R0.1 CC=CC(C)C MCULE-9898453837 [0,0,0,0,0,0|1,0,1]=2 108 B5R0.1 CC=CC(C)O MCULE-4806592836 [0,0,0,0,0,0|0,0,2]=2 109 B5R0.1 CC=C[N+](=O)[O-] MCULE-2987135481 [0,0,0,0,0,0|2,0,0]=2 110 B5R0.1 CC=NN(C)C MCULE-7039280578 [0,0,0,0,0,0|3,0,0]=3 111 B5R0.1 CCC=C(C)C MCULE-2405063894 [0,0,0,0,0,0|1,0,1]=2 112 B5R0.1 CCC=C(F)F MCULE-5180612061 [0,0,0,0,0,0|2,0,1]=3 113 B5R0.1 CCCC(=N)N MCULE-5974105638 [0,0,0,0,0,0|2,0,2]=4 114 B5R0.1 CCCC(=N)N MCULE-9230704591 [0,0,0,0,0,0|2,0,2]=4 115 B5R0.1 CCCC(=O)C MCULE-7174095676 [0,0,0,0,0,0|0,0,2]=2 116 B5R0.1 CCCC(=O)Cl MCULE-3288175193 [0,0,0,0,0,0|1,0,2]=3 117 B5R0.1 CCCC(=O)N MCULE-2712067671 [0,0,0,0,0,0|1,0,2]=3 118 B5R0.1 CCCC(=O)O MCULE-4116382006 [0,0,0,0,0,0|1,0,2]=3 119 B5R0.1 CCCC(=O)[O-] MCULE-8706538802 [0,0,0,0,0,0|1,0,2]=3 120 B5R0.1 CCCC(=O)[O-] MCULE-9764702574 [0,0,0,0,0,0|1,0,2]=3 121 B5R0.1 CCCC(=S)N MCULE-3529335988 [0,0,0,0,0,0|1,1,2]=4 122 B5R0.1 CCCC(=S)O MCULE-3382199964 [0,0,0,0,0,0|1,0,3]=4 123 B5R0.1 CCCC(C)Br MCULE-3178073667 [0,0,0,0,0,0|1,0,3]=4 124 B5R0.1 CCCC(C)C MCULE-9604552974 [0,0,0,0,0,0|1,0,3]=4 125 B5R0.1 CCCC(C)N MCULE-2640298430 [0,0,0,0,0,0|1,0,3]=4 126 B5R0.1 CCCC(C)N MCULE-7225905167 [0,0,0,0,0,0|1,0,3]=4 127 B5R0.1 CCCC(C)O MCULE-8205906299 [0,0,0,0,0,0|0,0,4]=4 128 B5R0.1 CCCC(C)S MCULE-1649095713 [0,0,0,0,0,0|0,1,3]=4 129 B5R0.1 CCCN(=O)=O MCULE-5615753372 [0,0,0,0,0,0|2,0,2]=4 130 B5R0.1 CCCN(C)C MCULE-8702643596 [0,0,0,0,0,0|2,0,2]=4 131 B5R0.1 CCCS(=O)[O-] MCULE-4306915022 [0,0,0,0,0,0|2,0,2]=4 132 B5R0.1 CCCS(=O)[O-] MCULE-9775151913 [0,0,0,0,0,0|2,0,2]=4 133 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [0,0,0,0,0,0|1,0,3]=4 134 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [0,0,0,0,0,0|1,0,3]=4 135 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [0,0,0,0,0,0|1,0,3]=4 136 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [0,0,0,0,0,0|1,0,3]=4 137 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [0,0,0,0,0,0|0,0,4]=4 138 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [0,0,0,0,0,0|1,0,3]=4 139 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [0,0,0,0,0,0|1,0,3]=4 140 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [0,0,0,0,0,0|1,0,3]=4 141 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [0,0,0,0,0,0|1,0,3]=4 142 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [0,0,0,0,0,0|0,0,4]=4 143 B5R0.1 CCNC(=N)N MCULE-4729418155 [0,0,0,0,0,0|3,0,1]=4 144 B5R0.1 CCNC(=N)N MCULE-5123343071 [0,0,0,0,0,0|3,0,1]=4 145 B5R0.1 CCNC(=O)C MCULE-7543656350 [0,0,0,0,0,0|1,0,1]=2 146 B5R0.1 CCNC(=O)Cl MCULE-5831262934 [0,0,0,0,0,0|2,0,1]=3 147 B5R0.1 CCNC(=O)N MCULE-1913599861 [0,0,0,0,0,0|2,0,1]=3 148 B5R0.1 CCNC(=S)N MCULE-3849517146 [0,0,0,0,0,0|2,1,1]=4 149 B5R0.1 CCNC(C)C MCULE-8064118469 [0,0,0,0,0,0|2,0,2]=4 150 B5R0.1 CCOC(=N)C MCULE-3060267072 [0,0,0,0,0,0|2,0,1]=3 151 B5R0.1 CCOC(=N)C MCULE-3943786182 [0,0,0,0,0,0|2,0,1]=3 152 B5R0.1 CCOC(=N)N MCULE-3570858508 [0,0,0,0,0,0|3,0,1]=4 153 B5R0.1 CCOC(=N)N MCULE-6061063856 [0,0,0,0,0,0|3,0,1]=4 154 B5R0.1 CCOC(=O)C MCULE-6628539781 [0,0,0,0,0,0|1,0,1]=2 155 B5R0.1 CCOC(=O)Cl MCULE-4167904934 [0,0,0,0,0,0|2,0,1]=3 156 B5R0.1 CCOC(=O)N MCULE-1776877276 [0,0,0,0,0,0|2,0,1]=3 157 B5R0.1 CCOC(=S)C MCULE-3358897597 [0,0,0,0,0,0|1,1,1]=3 158 B5R0.1 CCOC(=S)N MCULE-4649285010 [0,0,0,0,0,0|2,1,1]=4 159 B5R0.1 CCOC(=S)[S-] MCULE-6247969567 [0,0,0,0,0,0|2,1,1]=4 160 B5R0.1 CCOC(=S)[S-] MCULE-6902289618 [0,0,0,0,0,0|2,1,1]=4 161 B5R0.1 CCOC(=S)[S-] MCULE-9105300958 [0,0,0,0,0,0|2,1,1]=4 162 B5R0.1 CCOC(C)C MCULE-1934548340 [0,0,0,0,0,0|2,0,2]=4 163 B5R0.1 CCOC(C)Cl MCULE-8486994638 [0,0,0,0,0,0|2,0,2]=4 164 B5R0.1 CCSC(=N)N MCULE-2161729152 [0,0,0,0,0,0|3,0,1]=4 165 B5R0.1 CCSC(=N)N MCULE-2547252984 [0,0,0,0,0,0|3,0,1]=4 166 B5R0.1 CCSC(=O)C MCULE-8015440229 [0,0,0,0,0,0|1,0,1]=2 167 B5R0.1 CCSC(=S)C MCULE-1502137460 [0,0,0,0,0,0|1,1,1]=3 168 B5R0.1 CCSC(=S)[S-] MCULE-2573650807 [0,0,0,0,0,0|2,1,1]=4 169 B5R0.1 CCSC(=S)[S-] MCULE-6172057982 [0,0,0,0,0,0|2,1,1]=4 170 B5R0.1 CCSC(C)C MCULE-3738251898 [0,0,0,0,0,0|2,0,2]=4 171 B5R0.1 CC[NH2+]C(=N)N MCULE-1701852752 [0,0,0,0,0,0|3,0,1]=4 172 B5R0.1 CC[O+]=C(N)N MCULE-2484225131 [0,0,0,0,0,0|3,0,1]=4 173 B5R0.1 CC[O+]=C(N)N MCULE-6688774534 [0,0,0,0,0,0|3,0,1]=4 174 B5R0.1 CN(C)CC=O MCULE-1229218563 [0,0,0,0,0,0|3,0,1]=4 175 B5R0.1 CN(C)CC=O MCULE-3577561950 [0,0,0,0,0,0|3,0,1]=4 176 B5R0.1 CN(C)CC=O MCULE-4493766862 [0,0,0,0,0,0|3,0,1]=4 177 B5R0.1 CN(C)CC=O MCULE-8123455398 [0,0,0,0,0,0|3,0,1]=4 178 B5R0.1 CN(C)NC=O MCULE-1557896286 [0,0,0,0,0,0|4,0,0]=4 179 B5R0.1 CN=CN(C)C MCULE-2522407175 [0,0,0,0,0,0|3,0,0]=3 180 B5R0.1 CNCC(=O)C MCULE-3695443024 [0,0,0,0,0,0|1,0,1]=2 181 B5R0.1 CNCC(=O)C MCULE-7402723072 [0,0,0,0,0,0|1,0,1]=2 182 B5R0.1 CNCC(=O)N MCULE-2328887394 [0,0,0,0,0,0|2,0,1]=3 183 B5R0.1 CNCC(=O)N MCULE-3031605853 [0,0,0,0,0,0|2,0,1]=3 184 B5R0.1 CNCC(=O)N MCULE-7300977677 [0,0,0,0,0,0|2,0,1]=3 185 B5R0.1 CNCC(=O)O MCULE-3448356048 [0,0,0,0,0,0|2,0,1]=3 186 B5R0.1 CNCC(=O)O MCULE-4484444573 [0,0,0,0,0,0|2,0,1]=3 187 B5R0.1 CNCC(=O)[O-] MCULE-7993701866 [0,0,0,0,0,0|2,0,1]=3 188 B5R0.1 CNCC(C)C MCULE-6582386339 [0,0,0,0,0,0|2,0,2]=4 189 B5R0.1 CNCC(C)C MCULE-6856717783 [0,0,0,0,0,0|2,0,2]=4 190 B5R0.1 CNCC(C)F MCULE-4381138647 [0,0,0,0,0,0|2,0,2]=4 191 B5R0.1 CNCC(C)F MCULE-9018181183 [0,0,0,0,0,0|2,0,2]=4 192 B5R0.1 CNCC(C)O MCULE-3671071529 [0,0,0,0,0,0|1,0,3]=4 193 B5R0.1 CNCC(C)O MCULE-4171705304 [0,0,0,0,0,0|1,0,3]=4 194 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [0,0,0,0,0,0|1,0,3]=4 195 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [0,0,0,0,0,0|1,0,3]=4 196 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [0,0,0,0,0,0|1,0,3]=4 197 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [0,0,0,0,0,0|1,0,3]=4 198 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [0,0,0,0,0,0|1,0,3]=4 199 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [0,0,0,0,0,0|1,0,3]=4 200 B5R0.1 CNN=C(C)C MCULE-6307375856 [0,0,0,0,0,0|3,0,0]=3 201 B5R0.1 CNNC(=S)N MCULE-5838387497 [0,0,0,0,0,0|3,1,0]=4 202 B5R0.1 CNOC(=O)C MCULE-1464426541 [0,0,0,0,0,0|2,0,0]=2 203 B5R0.1 CNOC(=O)C MCULE-2976282666 [0,0,0,0,0,0|2,0,0]=2 204 B5R0.1 COC=C(C)C MCULE-6348538911 [0,0,0,0,0,0|2,0,0]=2 205 B5R0.1 COCC(=N)N MCULE-4711728356 [0,0,0,0,0,0|3,0,1]=4 206 B5R0.1 COCC(=N)N MCULE-7163250467 [0,0,0,0,0,0|3,0,1]=4 207 B5R0.1 COCC(=O)C MCULE-7262197587 [0,0,0,0,0,0|1,0,1]=2 208 B5R0.1 COCC(=O)Cl MCULE-5449267495 [0,0,0,0,0,0|2,0,1]=3 209 B5R0.1 COCC(=O)N MCULE-6674958132 [0,0,0,0,0,0|2,0,1]=3 210 B5R0.1 COCC(=O)O MCULE-3945589151 [0,0,0,0,0,0|2,0,1]=3 211 B5R0.1 COCC(=S)N MCULE-2046809269 [0,0,0,0,0,0|2,1,1]=4 212 B5R0.1 COCC(C)Br MCULE-6850689931 [0,0,0,0,0,0|2,0,2]=4 213 B5R0.1 COCC(C)I MCULE-8608265714 [0,0,0,0,0,0|2,0,2]=4 214 B5R0.1 COCC(C)N MCULE-1896873634 [0,0,0,0,0,0|2,0,2]=4 215 B5R0.1 COCC(C)N MCULE-2549420211 [0,0,0,0,0,0|2,0,2]=4 216 B5R0.1 COCC(C)N MCULE-3490410444 [0,0,0,0,0,0|2,0,2]=4 217 B5R0.1 COCC(C)N MCULE-7089888882 [0,0,0,0,0,0|2,0,2]=4 218 B5R0.1 COCC(C)O MCULE-4022733014 [0,0,0,0,0,0|1,0,3]=4 219 B5R0.1 COCC(C)O MCULE-7513310960 [0,0,0,0,0,0|1,0,3]=4 220 B5R0.1 COCN(C)C MCULE-1963225930 [0,0,0,0,0,0|3,0,1]=4 221 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [0,0,0,0,0,0|2,0,2]=4 222 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [0,0,0,0,0,0|2,0,2]=4 223 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [0,0,0,0,0,0|2,0,2]=4 224 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [0,0,0,0,0,0|2,0,2]=4 225 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [0,0,0,0,0,0|1,0,3]=4 226 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [0,0,0,0,0,0|1,0,3]=4 227 B5R0.1 COC[C@H](C)N MCULE-2465679418 [0,0,0,0,0,0|2,0,2]=4 228 B5R0.1 COC[C@H](C)N MCULE-2998593539 [0,0,0,0,0,0|2,0,2]=4 229 B5R0.1 COC[C@H](C)N MCULE-3161045661 [0,0,0,0,0,0|2,0,2]=4 230 B5R0.1 COC[C@H](C)N MCULE-9550165578 [0,0,0,0,0,0|2,0,2]=4 231 B5R0.1 COC[C@H](C)O MCULE-5908531683 [0,0,0,0,0,0|1,0,3]=4 232 B5R0.1 COC[C@H](C)O MCULE-8619138238 [0,0,0,0,0,0|1,0,3]=4 233 B5R0.1 CONC(=O)C MCULE-6601866630 [0,0,0,0,0,0|2,0,0]=2 234 B5R0.1 CONC(=O)N MCULE-3063713861 [0,0,0,0,0,0|3,0,0]=3 235 B5R0.1 CONC(=S)C MCULE-1876042939 [0,0,0,0,0,0|2,1,0]=3 236 B5R0.1 CS(=O)CC#N MCULE-1246621507 [0,0,0,0,0,0|2,0,2]=4 237 B5R0.1 CS(=O)CCBr MCULE-7846126230 [0,0,0,0,0,0|2,0,2]=4 238 B5R0.1 CS(=O)CCCl MCULE-7012781505 [0,0,0,0,0,0|2,0,2]=4 239 B5R0.1 CS(=O)CCN MCULE-6497874560 [0,0,0,0,0,0|2,0,2]=4 240 B5R0.1 CS(=O)CCN MCULE-8275663766 [0,0,0,0,0,0|2,0,2]=4 241 B5R0.1 CS(=O)CCN MCULE-8330490290 [0,0,0,0,0,0|2,0,2]=4 242 B5R0.1 CS(=O)CCO MCULE-8331553582 [0,0,0,0,0,0|2,0,2]=4 243 B5R0.1 CSC=[N+](C)C MCULE-3818988576 [0,0,0,0,0,0|3,0,0]=3 244 B5R0.1 CSC=[N+](C)C MCULE-8015580251 [0,0,0,0,0,0|3,0,0]=3 245 B5R0.1 CSCC(=N)N MCULE-7800929509 [0,0,0,0,0,0|3,0,1]=4 246 B5R0.1 CSCC(=N)N MCULE-8499985777 [0,0,0,0,0,0|3,0,1]=4 247 B5R0.1 CSCC(=O)C MCULE-4131794172 [0,0,0,0,0,0|1,0,1]=2 248 B5R0.1 CSCC(=O)Cl MCULE-9750052685 [0,0,0,0,0,0|2,0,1]=3 249 B5R0.1 CSCC(=O)N MCULE-4865579476 [0,0,0,0,0,0|2,0,1]=3 250 B5R0.1 CSCC(=O)O MCULE-7003418159 [0,0,0,0,0,0|2,0,1]=3 251 B5R0.1 CSCC(=S)N MCULE-5029100305 [0,0,0,0,0,0|2,1,1]=4 252 B5R0.1 CSCC(C)N MCULE-7985946030 [0,0,0,0,0,0|2,0,2]=4 253 B5R0.1 CSCC(C)O MCULE-2227652351 [0,0,0,0,0,0|1,0,3]=4 254 B5R0.1 CSCN(C)C MCULE-2931143051 [0,0,0,0,0,0|3,0,1]=4 255 B5R0.1 CSCS(=O)C MCULE-3167702486 [0,0,0,0,0,0|2,0,1]=3 256 B5R0.1 CSNC(=O)C MCULE-7350061514 [0,0,0,0,0,0|2,0,0]=2 257 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [0,0,0,0,0,0|2,0,2]=4 258 B5R0.1 ClC(=CCBr)Cl MCULE-5947456231 [0,0,0,0,0,0|3,0,1]=4 259 B5R0.1 ClCC=C(Cl)Cl MCULE-8294724084 [0,0,0,0,0,0|3,0,1]=4 260 B5R0.1 FC(=CCBr)F MCULE-1770710917 [0,0,0,0,0,0|3,0,1]=4 261 B5R0.1 N#CCC(=O)Cl MCULE-7971055738 [0,0,0,0,0,0|2,0,2]=4 262 B5R0.1 N#CCC(=O)N MCULE-8538286230 [0,0,0,0,0,0|2,0,2]=4 263 B5R0.1 N#CCC(=O)O MCULE-3440765061 [0,0,0,0,0,0|2,0,2]=4 264 B5R0.1 N#CCC(=O)[O-] MCULE-2598625909 [0,0,0,0,0,0|2,0,2]=4 265 B5R0.1 N#CCC(=O)[O-] MCULE-3532110520 [0,0,0,0,0,0|2,0,2]=4 266 B5R0.1 N=C(N)NC=O MCULE-2702198735 [0,0,0,0,0,0|4,0,0]=4 267 B5R0.1 NC(=O)C=CCl MCULE-3595468874 [0,0,0,0,0,0|2,0,0]=2 268 B5R0.1 NC(=O)C=NO MCULE-6447662753 [0,0,0,0,0,0|3,0,0]=3 269 B5R0.1 NC(=O)CCBr MCULE-3930714776 [0,0,0,0,0,0|2,0,2]=4 270 B5R0.1 NC(=O)CCCl MCULE-8300320959 [0,0,0,0,0,0|2,0,2]=4 271 B5R0.1 NC(=O)CCO MCULE-4026170350 [0,0,0,0,0,0|2,0,2]=4 272 B5R0.1 NC(=O)CCS MCULE-7451827717 [0,0,0,0,0,0|2,0,2]=4 273 B5R0.1 NC(=O)NCO MCULE-7403641101 [0,0,0,0,0,0|3,0,1]=4 274 B5R0.1 NC(=O)NN=O MCULE-2820469915 [0,0,0,0,0,0|4,0,0]=4 275 B5R0.1 NCC=C(Cl)Cl MCULE-6555955942 [0,0,0,0,0,0|3,0,1]=4 276 B5R0.1 NCC=C(Cl)Cl MCULE-9019653665 [0,0,0,0,0,0|3,0,1]=4 277 B5R0.1 NCCC(=O)Cl MCULE-1298355499 [0,0,0,0,0,0|2,0,2]=4 278 B5R0.1 NCCC(=O)N MCULE-2899414135 [0,0,0,0,0,0|2,0,2]=4 279 B5R0.1 NCCC(=O)N MCULE-6993286668 [0,0,0,0,0,0|2,0,2]=4 280 B5R0.1 NCCC(=O)O MCULE-1344289084 [0,0,0,0,0,0|2,0,2]=4 281 B5R0.1 NCCC(=O)O MCULE-2298605337 [0,0,0,0,0,0|2,0,2]=4 282 B5R0.1 NCCC(=O)O MCULE-9375577631 [0,0,0,0,0,0|2,0,2]=4 283 B5R0.1 NCCC(=O)[O-] MCULE-2492250086 [0,0,0,0,0,0|2,0,2]=4 284 B5R0.1 NNCC(=O)N MCULE-2794619708 [0,0,0,0,0,0|3,0,1]=4 285 B5R0.1 NNCC(=O)N MCULE-6773156087 [0,0,0,0,0,0|3,0,1]=4 286 B5R0.1 NNCC(=O)O MCULE-4908184724 [0,0,0,0,0,0|3,0,1]=4 287 B5R0.1 NNCC(=O)O MCULE-6315598774 [0,0,0,0,0,0|3,0,1]=4 288 B5R0.1 NOCC(=O)O MCULE-4566186819 [0,0,0,0,0,0|3,0,1]=4 289 B5R0.1 NOCC(=O)O MCULE-4824237418 [0,0,0,0,0,0|3,0,1]=4 290 B5R0.1 NOCC(=O)O MCULE-8132180423 [0,0,0,0,0,0|3,0,1]=4 291 B5R0.1 O=C(Cl)C=CCl MCULE-7984379237 [0,0,0,0,0,0|2,0,0]=2 292 B5R0.1 O=C(Cl)CCBr MCULE-4659506608 [0,0,0,0,0,0|2,0,2]=4 293 B5R0.1 O=C(Cl)CCCl MCULE-3313924878 [0,0,0,0,0,0|2,0,2]=4 294 B5R0.1 O=C(Cl)CCF MCULE-3316397790 [0,0,0,0,0,0|2,0,2]=4 295 B5R0.1 O=C(Cl)OCCl MCULE-2130588147 [0,0,0,0,0,0|3,0,1]=4 296 B5R0.1 O=C(O)/C=C/Br MCULE-7284519266 [0,0,0,0,0,0|2,0,0]=2 297 B5R0.1 O=C(O)/C=C/Cl MCULE-1625781671 [0,0,0,0,0,0|2,0,0]=2 298 B5R0.1 O=C(O)/C=C/I MCULE-3339607379 [0,0,0,0,0,0|2,0,0]=2 299 B5R0.1 O=C(O)/C=C\Br MCULE-6149049313 [0,0,0,0,0,0|2,0,0]=2 300 B5R0.1 O=C(O)/C=C\Cl MCULE-1221996674 [0,0,0,0,0,0|2,0,0]=2 301 B5R0.1 O=C(O)/C=C\I MCULE-3065405012 [0,0,0,0,0,0|2,0,0]=2 302 B5R0.1 O=C(O)/C=N/O MCULE-2471349844 [0,0,0,0,0,0|3,0,0]=3 303 B5R0.1 O=C(O)C#CBr MCULE-1997285471 [0,0,0,0,0,0|2,0,2]=4 304 B5R0.1 O=C(O)C=CBr MCULE-2956464856 [0,0,0,0,0,0|2,0,0]=2 305 B5R0.1 O=C(O)C=CCl MCULE-6369812151 [0,0,0,0,0,0|2,0,0]=2 306 B5R0.1 O=C(O)C=CI MCULE-7162332129 [0,0,0,0,0,0|2,0,0]=2 307 B5R0.1 O=C(O)C=NO MCULE-2039309679 [0,0,0,0,0,0|3,0,0]=3 308 B5R0.1 O=C(O)CCBr MCULE-2816055853 [0,0,0,0,0,0|2,0,2]=4 309 B5R0.1 O=C(O)CCCl MCULE-8511144183 [0,0,0,0,0,0|2,0,2]=4 310 B5R0.1 O=C(O)CCF MCULE-4382025684 [0,0,0,0,0,0|2,0,2]=4 311 B5R0.1 O=C(O)CCI MCULE-3371354708 [0,0,0,0,0,0|2,0,2]=4 312 B5R0.1 O=C(O)CCO MCULE-3428604829 [0,0,0,0,0,0|2,0,2]=4 313 B5R0.1 O=C(O)CCS MCULE-3211932163 [0,0,0,0,0,0|2,0,2]=4 314 B5R0.1 O=C(O)CNO MCULE-4437067339 [0,0,0,0,0,0|3,0,1]=4 315 B5R0.1 O=C([O-])C#CO MCULE-3725047218 [0,0,0,0,0,0|2,0,2]=4 316 B5R0.1 O=C([O-])C#CO MCULE-9125153565 [0,0,0,0,0,0|2,0,2]=4 317 B5R0.1 O=C([O-])C=CCl MCULE-4750072789 [0,0,0,0,0,0|2,0,0]=2 318 B5R0.1 O=C([O-])CCO MCULE-4429611588 [0,0,0,0,0,0|2,0,2]=4 319 B5R0.1 OCC=C(Cl)Cl MCULE-6473037027 [0,0,0,0,0,0|3,0,1]=4 320 B5R0.1 P(=O)(O)C=C=C MCULE-4922910477 [0,0,0,0,0,0|2,0,2]=4 321 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [0,0,0,0,0,0|0,0,4]=4 322 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [0,0,0,0,0,0|1,0,3]=4 323 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [0,0,0,0,0,0|0,0,4]=4 324 B5R0.1 [NH+](=CN(C)C)C MCULE-8771175095 [0,0,0,0,0,0|3,0,0]=3 325 B4R0.1 BrC=C(Br)Br MCULE-9536958233 [1,0,0,0,0,0|3,0,0]=4 326 B4R0.1 C#CC(=C)C MCULE-6826835331 [1,0,0,0,0,0|1,0,2]=4 327 B4R0.1 C#CC(=O)C MCULE-1296030711 [1,0,0,0,0,0|0,0,2]=3 328 B4R0.1 C#CC(=O)N MCULE-1832868146 [1,0,0,0,0,0|1,0,2]=4 329 B4R0.1 C#CC(=O)O MCULE-8764256624 [1,0,0,0,0,0|1,0,2]=4 330 B4R0.1 C#CC(=O)[O-] MCULE-3356498679 [1,0,0,0,0,0|1,0,2]=4 331 B4R0.1 C#CC(=O)[O-] MCULE-3490087346 [1,0,0,0,0,0|1,0,2]=4 332 B4R0.1 C/C(=N/O)/N MCULE-5595239824 [1,0,0,0,0,0|3,0,0]=4 333 B4R0.1 C/C(=N\O)/N MCULE-8004142092 [1,0,0,0,0,0|3,0,0]=4 334 B4R0.1 C/C=C(/C)\Cl MCULE-6841426098 [1,0,0,0,0,0|1,0,0]=2 335 B4R0.1 C/C=C(\C)/Br MCULE-3045523462 [1,0,0,0,0,0|1,0,0]=2 336 B4R0.1 C/C=C(\C)/Cl MCULE-4683862502 [1,0,0,0,0,0|1,0,0]=2 337 B4R0.1 C=C(Br)C=O MCULE-9500973388 [1,0,0,0,0,0|2,0,1]=4 338 B4R0.1 C=C(Br)CC MCULE-6271946451 [1,0,0,0,0,0|1,0,2]=4 339 B4R0.1 C=C(C)C#N MCULE-9177849910 [1,0,0,0,0,0|2,0,1]=4 340 B4R0.1 C=C(C)C=O MCULE-3758355501 [1,0,0,0,0,0|2,0,0]=3 341 B4R0.1 C=C(C)CBr MCULE-1361893863 [1,0,0,0,0,0|2,0,1]=4 342 B4R0.1 C=C(C)CCl MCULE-5586406339 [1,0,0,0,0,0|2,0,1]=4 343 B4R0.1 C=C(C)CI MCULE-3678124406 [1,0,0,0,0,0|2,0,1]=4 344 B4R0.1 C=C(C)CN MCULE-1033495975 [1,0,0,0,0,0|2,0,1]=4 345 B4R0.1 C=C(C)CN MCULE-8730181300 [1,0,0,0,0,0|2,0,1]=4 346 B4R0.1 C=C(C)CO MCULE-8641288398 [1,0,0,0,0,0|2,0,1]=4 347 B4R0.1 C=C(C)CS MCULE-5174170431 [1,0,0,0,0,0|2,0,1]=4 348 B4R0.1 C=C(C)OC MCULE-7344104255 [1,0,0,0,0,0|2,0,0]=3 349 B4R0.1 C=C=C(C)C MCULE-8705186354 [1,0,0,0,0,0|1,0,1]=3 350 B4R0.1 C=CB(O)O MCULE-2531600001 [1,0,0,0,0,0|2,0,1]=4 351 B4R0.1 C=CC(=C)C MCULE-1668999564 [1,0,0,0,0,0|1,0,0]=2 352 B4R0.1 C=CC(=O)C MCULE-4924646293 [1,0,0,0,0,0|0,0,0]=1 353 B4R0.1 C=CC(=O)Cl MCULE-3579233798 [1,0,0,0,0,0|1,0,0]=2 354 B4R0.1 C=CC(=O)N MCULE-4309430654 [1,0,0,0,0,0|1,0,0]=2 355 B4R0.1 C=CC(=O)O MCULE-9352227082 [1,0,0,0,0,0|1,0,0]=2 356 B4R0.1 C=CC(=O)[O-] MCULE-3928960314 [1,0,0,0,0,0|1,0,0]=2 357 B4R0.1 C=CC(=O)[O-] MCULE-4331301308 [1,0,0,0,0,0|1,0,0]=2 358 B4R0.1 C=CC(=O)[O-] MCULE-5516854555 [1,0,0,0,0,0|1,0,0]=2 359 B4R0.1 C=CC(C)Cl MCULE-1756172983 [1,0,0,0,0,0|1,0,1]=3 360 B4R0.1 C=CC(C)N MCULE-5748048106 [1,0,0,0,0,0|1,0,1]=3 361 B4R0.1 C=CC(C)N MCULE-6786590923 [1,0,0,0,0,0|1,0,1]=3 362 B4R0.1 C=CC(C)O MCULE-4525368256 [1,0,0,0,0,0|0,0,2]=3 363 B4R0.1 C=CN(=O)=O MCULE-1988475489 [1,0,0,0,0,0|2,0,0]=3 364 B4R0.1 C=C[C@@H](C)N MCULE-4388444035 [1,0,0,0,0,0|1,0,1]=3 365 B4R0.1 C=C[C@@H](C)N MCULE-6107415849 [1,0,0,0,0,0|1,0,1]=3 366 B4R0.1 C=C[C@@H](C)N MCULE-6707490046 [1,0,0,0,0,0|1,0,1]=3 367 B4R0.1 C=C[C@@H](C)N MCULE-9654995108 [1,0,0,0,0,0|1,0,1]=3 368 B4R0.1 C=C[C@H](C)N MCULE-1396113041 [1,0,0,0,0,0|1,0,1]=3 369 B4R0.1 C=C[C@H](C)N MCULE-2197513722 [1,0,0,0,0,0|1,0,1]=3 370 B4R0.1 C=C[C@H](C)N MCULE-4698235480 [1,0,0,0,0,0|1,0,1]=3 371 B4R0.1 C=C[C@H](C)N MCULE-8745929233 [1,0,0,0,0,0|1,0,1]=3 372 B4R0.1 C=C[C@H](C)O MCULE-2251589245 [1,0,0,0,0,0|0,0,2]=3 373 B4R0.1 C=NN(C)C MCULE-4915917395 [1,0,0,0,0,0|3,0,0]=4 374 B4R0.1 CC(=CBr)C MCULE-9508381610 [1,0,0,0,0,0|2,0,0]=3 375 B4R0.1 CC(=CCl)C MCULE-4321554138 [1,0,0,0,0,0|2,0,0]=3 376 B4R0.1 CC(=CCl)Cl MCULE-3528888685 [1,0,0,0,0,0|2,0,0]=3 377 B4R0.1 CC(=N)NN MCULE-2302306720 [1,0,0,0,0,0|3,0,0]=4 378 B4R0.1 CC(=N)NN MCULE-5362481009 [1,0,0,0,0,0|3,0,0]=4 379 B4R0.1 CC(=NN)C MCULE-8828852790 [1,0,0,0,0,0|3,0,0]=4 380 B4R0.1 CC(=NO)C MCULE-3243100216 [1,0,0,0,0,0|3,0,0]=4 381 B4R0.1 CC(=O)C#N MCULE-6317771757 [1,0,0,0,0,0|1,0,1]=3 382 B4R0.1 CC(=O)C=O MCULE-2718961814 [1,0,0,0,0,0|1,0,0]=2 383 B4R0.1 CC(=O)CBr MCULE-7812920675 [1,0,0,0,0,0|1,0,1]=3 384 B4R0.1 CC(=O)CCl MCULE-2501365933 [1,0,0,0,0,0|1,0,1]=3 385 B4R0.1 CC(=O)CF MCULE-7417279999 [1,0,0,0,0,0|1,0,1]=3 386 B4R0.1 CC(=O)CN MCULE-2715277783 [1,0,0,0,0,0|1,0,1]=3 387 B4R0.1 CC(=O)CN MCULE-6004541862 [1,0,0,0,0,0|1,0,1]=3 388 B4R0.1 CC(=O)CO MCULE-2989526028 [1,0,0,0,0,0|1,0,1]=3 389 B4R0.1 CC(=O)CS MCULE-9736174016 [1,0,0,0,0,0|1,0,1]=3 390 B4R0.1 CC(=O)NBr MCULE-6502070876 [1,0,0,0,0,0|2,0,0]=3 391 B4R0.1 CC(=O)NN MCULE-9183467120 [1,0,0,0,0,0|2,0,0]=3 392 B4R0.1 CC(=O)NO MCULE-2682231025 [1,0,0,0,0,0|2,0,0]=3 393 B4R0.1 CC(=O)OO MCULE-6028338742 [1,0,0,0,0,0|2,0,0]=3 394 B4R0.1 CC(Br)C=O MCULE-6060704330 [1,0,0,0,0,0|2,0,1]=4 395 B4R0.1 CC(C)C=O MCULE-3575731904 [1,0,0,0,0,0|2,0,1]=4 396 B4R0.1 CC(N)C=O MCULE-3421118418 [1,0,0,0,0,0|2,0,1]=4 397 B4R0.1 CC=C(C)Br MCULE-1371905211 [1,0,0,0,0,0|1,0,0]=2 398 B4R0.1 CC=C(C)C MCULE-4230157245 [1,0,0,0,0,0|1,0,0]=2 399 B4R0.1 CC=C(C)Cl MCULE-3844314543 [1,0,0,0,0,0|1,0,0]=2 400 B4R0.1 CC=C(Cl)Cl MCULE-3741261135 [1,0,0,0,0,0|2,0,0]=3 401 B4R0.1 CC=C(F)F MCULE-5544510852 [1,0,0,0,0,0|2,0,0]=3 402 B4R0.1 CCC(=N)N MCULE-1856575742 [1,0,0,0,0,0|2,0,1]=4 403 B4R0.1 CCC(=N)N MCULE-2534386807 [1,0,0,0,0,0|2,0,1]=4 404 B4R0.1 CCC(=O)Br MCULE-7870678619 [1,0,0,0,0,0|1,0,1]=3 405 B4R0.1 CCC(=O)C MCULE-8276670748 [1,0,0,0,0,0|0,0,1]=2 406 B4R0.1 CCC(=O)Cl MCULE-3081874391 [1,0,0,0,0,0|1,0,1]=3 407 B4R0.1 CCC(=O)F MCULE-8783887670 [1,0,0,0,0,0|1,0,1]=3 408 B4R0.1 CCC(=O)N MCULE-3730796130 [1,0,0,0,0,0|1,0,1]=3 409 B4R0.1 CCC(=O)O MCULE-2199051150 [1,0,0,0,0,0|1,0,1]=3 410 B4R0.1 CCC(=O)O MCULE-9800054040 [1,0,0,0,0,0|1,0,1]=3 411 B4R0.1 CCC(=O)S MCULE-3392119766 [1,0,0,0,0,0|1,0,1]=3 412 B4R0.1 CCC(=O)[O-] MCULE-6321502767 [1,0,0,0,0,0|1,0,1]=3 413 B4R0.1 CCC(=S)N MCULE-3921479699 [1,0,0,0,0,0|1,1,1]=4 414 B4R0.1 CCC(C)Br MCULE-9661620259 [1,0,0,0,0,0|1,0,2]=4 415 B4R0.1 CCC(C)C MCULE-5376105936 [1,0,0,0,0,0|1,0,2]=4 416 B4R0.1 CCC(C)Cl MCULE-2954418486 [1,0,0,0,0,0|1,0,2]=4 417 B4R0.1 CCC(C)I MCULE-5239699587 [1,0,0,0,0,0|1,0,2]=4 418 B4R0.1 CCC(C)N MCULE-5041676035 [1,0,0,0,0,0|1,0,2]=4 419 B4R0.1 CCC(C)N MCULE-5835091553 [1,0,0,0,0,0|1,0,2]=4 420 B4R0.1 CCC(C)N MCULE-6631606230 [1,0,0,0,0,0|1,0,2]=4 421 B4R0.1 CCC(C)N MCULE-8165681721 [1,0,0,0,0,0|1,0,2]=4 422 B4R0.1 CCC(C)O MCULE-4099350806 [1,0,0,0,0,0|0,0,3]=4 423 B4R0.1 CCC(C)O MCULE-5005120003 [1,0,0,0,0,0|0,0,3]=4 424 B4R0.1 CCC(C)S MCULE-4988033753 [1,0,0,0,0,0|0,1,2]=4 425 B4R0.1 CCN(=O)=O MCULE-6603591614 [1,0,0,0,0,0|2,0,1]=4 426 B4R0.1 CCN(C)C MCULE-5825033552 [1,0,0,0,0,0|2,0,1]=4 427 B4R0.1 CCN(C)N MCULE-2279492356 [1,0,0,0,0,0|2,0,1]=4 428 B4R0.1 CCN(C)N MCULE-5660338703 [1,0,0,0,0,0|2,0,1]=4 429 B4R0.1 CCN(C)N MCULE-9839987578 [1,0,0,0,0,0|2,0,1]=4 430 B4R0.1 CCS(=O)C MCULE-4400935745 [1,0,0,0,0,0|1,0,1]=3 431 B4R0.1 CCS(=O)O MCULE-9872932319 [1,0,0,0,0,0|2,0,1]=4 432 B4R0.1 CCS(=O)[O-] MCULE-4386198822 [1,0,0,0,0,0|2,0,1]=4 433 B4R0.1 CC[C@@H](C)N MCULE-2017255826 [1,0,0,0,0,0|1,0,2]=4 434 B4R0.1 CC[C@@H](C)N MCULE-3555707512 [1,0,0,0,0,0|1,0,2]=4 435 B4R0.1 CC[C@@H](C)N MCULE-6783735598 [1,0,0,0,0,0|1,0,2]=4 436 B4R0.1 CC[C@@H](C)N MCULE-7004219201 [1,0,0,0,0,0|1,0,2]=4 437 B4R0.1 CC[C@@H](C)O MCULE-2661481448 [1,0,0,0,0,0|0,0,3]=4 438 B4R0.1 CC[C@@H](C)O MCULE-6785232833 [1,0,0,0,0,0|0,0,3]=4 439 B4R0.1 CC[C@H](C)N MCULE-2450201533 [1,0,0,0,0,0|1,0,2]=4 440 B4R0.1 CC[C@H](C)N MCULE-2998961427 [1,0,0,0,0,0|1,0,2]=4 441 B4R0.1 CC[C@H](C)N MCULE-6692190471 [1,0,0,0,0,0|1,0,2]=4 442 B4R0.1 CC[C@H](C)N MCULE-6904795465 [1,0,0,0,0,0|1,0,2]=4 443 B4R0.1 CC[C@H](C)O MCULE-3700911573 [1,0,0,0,0,0|0,0,3]=4 444 B4R0.1 CC[C@H](C)O MCULE-6063716138 [1,0,0,0,0,0|0,0,3]=4 445 B4R0.1 CN(C)C=O MCULE-6290117712 [1,0,0,0,0,0|3,0,0]=4 446 B4R0.1 CN(C)C=S MCULE-3571847382 [1,0,0,0,0,0|3,0,0]=4 447 B4R0.1 CN(N)C=O MCULE-6353057165 [1,0,0,0,0,0|3,0,0]=4 448 B4R0.1 CNC(=N)N MCULE-1074994749 [1,0,0,0,0,0|3,0,0]=4 449 B4R0.1 CNC(=N)N MCULE-6149731862 [1,0,0,0,0,0|3,0,0]=4 450 B4R0.1 CNC(=N)N MCULE-7667364021 [1,0,0,0,0,0|3,0,0]=4 451 B4R0.1 CNC(=N)N MCULE-7854448694 [1,0,0,0,0,0|3,0,0]=4 452 B4R0.1 CNC(=O)C MCULE-2612997941 [1,0,0,0,0,0|1,0,0]=2 453 B4R0.1 CNC(=O)Cl MCULE-7743744606 [1,0,0,0,0,0|2,0,0]=3 454 B4R0.1 CNC(=O)N MCULE-6422331704 [1,0,0,0,0,0|2,0,0]=3 455 B4R0.1 CNC(=S)C MCULE-8699171591 [1,0,0,0,0,0|1,1,0]=3 456 B4R0.1 CNC(=S)N MCULE-7103250725 [1,0,0,0,0,0|2,1,0]=4 457 B4R0.1 CNC(=S)[S-] MCULE-4072880135 [1,0,0,0,0,0|2,1,0]=4 458 B4R0.1 CNC(=S)[S-] MCULE-4924829934 [1,0,0,0,0,0|2,1,0]=4 459 B4R0.1 CNC(C)C MCULE-3849513543 [1,0,0,0,0,0|2,0,1]=4 460 B4R0.1 CNN(C)C MCULE-7120869955 [1,0,0,0,0,0|3,0,0]=4 461 B4R0.1 CNN(C)C MCULE-8318926099 [1,0,0,0,0,0|3,0,0]=4 462 B4R0.1 COC(=N)C MCULE-2752794913 [1,0,0,0,0,0|2,0,0]=3 463 B4R0.1 COC(=N)C MCULE-2904991083 [1,0,0,0,0,0|2,0,0]=3 464 B4R0.1 COC(=N)N MCULE-1611076737 [1,0,0,0,0,0|3,0,0]=4 465 B4R0.1 COC(=N)N MCULE-4923904579 [1,0,0,0,0,0|3,0,0]=4 466 B4R0.1 COC(=N)N MCULE-6696789855 [1,0,0,0,0,0|3,0,0]=4 467 B4R0.1 COC(=N)N MCULE-9171600210 [1,0,0,0,0,0|3,0,0]=4 468 B4R0.1 COC(=O)C MCULE-7368066093 [1,0,0,0,0,0|1,0,0]=2 469 B4R0.1 COC(=O)Cl MCULE-8022274771 [1,0,0,0,0,0|2,0,0]=3 470 B4R0.1 COC(=O)N MCULE-4070607369 [1,0,0,0,0,0|2,0,0]=3 471 B4R0.1 COC(=S)N MCULE-9414558443 [1,0,0,0,0,0|2,1,0]=4 472 B4R0.1 COC(=S)[S-] MCULE-4829872223 [1,0,0,0,0,0|2,1,0]=4 473 B4R0.1 COC(=S)[S-] MCULE-6509496630 [1,0,0,0,0,0|2,1,0]=4 474 B4R0.1 COC(C)Cl MCULE-9043930044 [1,0,0,0,0,0|2,0,1]=4 475 B4R0.1 CSC(=N)N MCULE-1471368384 [1,0,0,0,0,0|3,0,0]=4 476 B4R0.1 CSC(=N)N MCULE-3394284504 [1,0,0,0,0,0|3,0,0]=4 477 B4R0.1 CSC(=N)N MCULE-3752198299 [1,0,0,0,0,0|3,0,0]=4 478 B4R0.1 CSC(=N)N MCULE-5672446896 [1,0,0,0,0,0|3,0,0]=4 479 B4R0.1 CSC(=N)N MCULE-8409992127 [1,0,0,0,0,0|3,0,0]=4 480 B4R0.1 CSC(=O)C MCULE-7061634598 [1,0,0,0,0,0|1,0,0]=2 481 B4R0.1 CSC(=S)C MCULE-4836153374 [1,0,0,0,0,0|1,1,0]=3 482 B4R0.1 CSC(C)C MCULE-5932565699 [1,0,0,0,0,0|2,0,1]=4 483 B4R0.1 CSS(=O)C MCULE-6515592458 [1,0,0,0,0,0|2,0,0]=3 484 B4R0.1 CS[S+](C)C MCULE-1869043585 [1,0,0,0,0,0|3,0,0]=4 485 B4R0.1 CS[S+](C)C MCULE-4164877790 [1,0,0,0,0,0|3,0,0]=4 486 B4R0.1 C[C@@H](O)C=O MCULE-5921136435 [1,0,0,0,0,0|1,0,2]=4 487 B4R0.1 C[N+](=CBr)C MCULE-4078543172 [1,0,0,0,0,0|3,0,0]=4 488 B4R0.1 C[N+](=CBr)C MCULE-9146783444 [1,0,0,0,0,0|3,0,0]=4 489 B4R0.1 C[N+](=CCl)C MCULE-5768539789 [1,0,0,0,0,0|3,0,0]=4 490 B4R0.1 C[N+](=CCl)C MCULE-6936774679 [1,0,0,0,0,0|3,0,0]=4 491 B4R0.1 ClC=C(Cl)Cl MCULE-3945953656 [1,0,0,0,0,0|3,0,0]=4 492 B4R0.1 FC(=CBr)F MCULE-5114290777 [1,0,0,0,0,0|3,0,0]=4 493 B4R0.1 FC=C(Br)Br MCULE-3150710627 [1,0,0,0,0,0|3,0,0]=4 494 B4R0.1 FC=C(F)F MCULE-2449532887 [1,0,0,0,0,0|3,0,0]=4 495 B4R0.1 NC(=O)CBr MCULE-9306090536 [1,0,0,0,0,0|2,0,1]=4 496 B4R0.1 NC(=O)CCl MCULE-3241549842 [1,0,0,0,0,0|2,0,1]=4 497 B4R0.1 NC(=O)CF MCULE-3344212657 [1,0,0,0,0,0|2,0,1]=4 498 B4R0.1 NC(=O)CI MCULE-4217973413 [1,0,0,0,0,0|2,0,1]=4 499 B4R0.1 NC(=O)CO MCULE-2739878376 [1,0,0,0,0,0|2,0,1]=4 500 B4R0.1 NC(=O)CS MCULE-2639305532 [1,0,0,0,0,0|2,0,1]=4 501 B4R0.1 NC(=O)NO MCULE-9465284053 [1,0,0,0,0,0|3,0,0]=4 502 B4R0.1 NCC(=O)N MCULE-1048848056 [1,0,0,0,0,0|2,0,1]=4 503 B4R0.1 NCC(=O)N MCULE-2174395809 [1,0,0,0,0,0|2,0,1]=4 504 B4R0.1 NCC(=O)N MCULE-6113166250 [1,0,0,0,0,0|2,0,1]=4 505 B4R0.1 NCC(=O)O MCULE-2415764032 [1,0,0,0,0,0|2,0,1]=4 506 B4R0.1 NCC(=O)O MCULE-3643110755 [1,0,0,0,0,0|2,0,1]=4 507 B4R0.1 NCC(=O)O MCULE-4349255299 [1,0,0,0,0,0|2,0,1]=4 508 B4R0.1 NCC(=O)O MCULE-9146223615 [1,0,0,0,0,0|2,0,1]=4 509 B4R0.1 NCC(=O)O MCULE-9701991737 [1,0,0,0,0,0|2,0,1]=4 510 B4R0.1 NCC(=O)S MCULE-9837799864 [1,0,0,0,0,0|2,0,1]=4 511 B4R0.1 NCC(=O)[O-] MCULE-5975202378 [1,0,0,0,0,0|2,0,1]=4 512 B4R0.1 NNC(=O)N MCULE-3392559370 [1,0,0,0,0,0|3,0,0]=4 513 B4R0.1 NNC(=O)N MCULE-8490374775 [1,0,0,0,0,0|3,0,0]=4 514 B4R0.1 O=C(Br)CBr MCULE-6031858200 [1,0,0,0,0,0|2,0,1]=4 515 B4R0.1 O=C(Cl)CBr MCULE-7684029984 [1,0,0,0,0,0|2,0,1]=4 516 B4R0.1 O=C(Cl)CCl MCULE-7076914635 [1,0,0,0,0,0|2,0,1]=4 517 B4R0.1 O=C(Cl)CF MCULE-7182087882 [1,0,0,0,0,0|2,0,1]=4 518 B4R0.1 O=C(Cl)CI MCULE-5719121455 [1,0,0,0,0,0|2,0,1]=4 519 B4R0.1 O=C(Cl)SCl MCULE-5008011265 [1,0,0,0,0,0|3,0,0]=4 520 B4R0.1 O=C(O)CBr MCULE-1503716137 [1,0,0,0,0,0|2,0,1]=4 521 B4R0.1 O=C(O)CCl MCULE-9228754880 [1,0,0,0,0,0|2,0,1]=4 522 B4R0.1 O=C(O)CF MCULE-6584094437 [1,0,0,0,0,0|2,0,1]=4 523 B4R0.1 O=C(O)CI MCULE-3146792857 [1,0,0,0,0,0|2,0,1]=4 524 B4R0.1 O=C(O)CO MCULE-9792551388 [1,0,0,0,0,0|2,0,1]=4 525 B4R0.1 O=C(O)CS MCULE-8097997001 [1,0,0,0,0,0|2,0,1]=4 526 B4R0.1 O=C([O-])CF MCULE-8428965857 [1,0,0,0,0,0|2,0,1]=4 527 B4R0.1 O=C([O-])CO MCULE-2780567509 [1,0,0,0,0,0|2,0,1]=4 528 B4R0.1 O=C([O-])CS MCULE-3314809220 [1,0,0,0,0,0|2,0,1]=4 529 B4R0.1 O=C([O-])CS MCULE-5989133747 [1,0,0,0,0,0|2,0,1]=4 530 B4R0.1 O=CC(=O)O MCULE-5307898766 [1,0,0,0,0,0|2,0,0]=3 531 B4R0.1 [NH3+]C(C)CC MCULE-3066898055 [1,0,0,0,0,0|1,0,2]=4 532 B4R0.2 BrC=CCBr MCULE-1480697982 [1,0,0,0,0,0|2,0,1]=4 533 B4R0.2 C#CC=CC MCULE-9741359131 [1,0,0,0,0,0|0,0,2]=3 534 B4R0.2 C/C=C/C#N MCULE-2754343103 [1,0,0,0,0,0|1,0,1]=3 535 B4R0.2 C/C=C/C=O MCULE-9924705308 [1,0,0,0,0,0|0,0,0]=1 536 B4R0.2 C/C=C/CCl MCULE-9977493525 [1,0,0,0,0,0|1,0,1]=3 537 B4R0.2 C/C=C/CO MCULE-2383161163 [1,0,0,0,0,0|0,0,2]=3 538 B4R0.2 C/C=C/OC MCULE-3906920304 [1,0,0,0,0,0|1,0,0]=2 539 B4R0.2 C/C=C\CO MCULE-5924662327 [1,0,0,0,0,0|0,0,2]=3 540 B4R0.2 C=C=CCC MCULE-6123315571 [1,0,0,0,0,0|0,0,3]=4 541 B4R0.2 C=CC=CC MCULE-4452516287 [1,0,0,0,0,0|0,0,1]=2 542 B4R0.2 C=CCCC MCULE-8386546337 [1,0,0,0,0,0|0,0,3]=4 543 B4R0.2 C=CCNC MCULE-3335720336 [1,0,0,0,0,0|1,0,2]=4 544 B4R0.2 C=CCOC MCULE-3321225771 [1,0,0,0,0,0|1,0,2]=4 545 B4R0.2 C=CCSC MCULE-4452023915 [1,0,0,0,0,0|1,0,2]=4 546 B4R0.2 C=CNC=O MCULE-8403928899 [1,0,0,0,0,0|1,0,1]=3 547 B4R0.2 C=COCC MCULE-2569047033 [1,0,0,0,0,0|1,0,2]=4 548 B4R0.2 C=CSCC MCULE-8927374165 [1,0,0,0,0,0|1,0,2]=4 549 B4R0.2 C=C[Te]C=C MCULE-9095868234 [1,0,0,0,0,0|1,0,2]=4 550 B4R0.2 CC#CC=O MCULE-9270622693 [1,0,0,0,0,0|0,0,2]=3 551 B4R0.2 CC#CCC MCULE-8848779220 [1,0,0,0,0,0|0,0,3]=4 552 B4R0.2 CC=CC#N MCULE-5062019142 [1,0,0,0,0,0|1,0,1]=3 553 B4R0.2 CC=CC=O MCULE-2497362981 [1,0,0,0,0,0|0,0,0]=1 554 B4R0.2 CC=CCBr MCULE-7855581866 [1,0,0,0,0,0|1,0,1]=3 555 B4R0.2 CC=CCC MCULE-5931905453 [1,0,0,0,0,0|0,0,1]=2 556 B4R0.2 CC=CCCl MCULE-3941962217 [1,0,0,0,0,0|1,0,1]=3 557 B4R0.2 CC=CCO MCULE-7490725844 [1,0,0,0,0,0|0,0,2]=3 558 B4R0.2 CC=COC MCULE-6712403535 [1,0,0,0,0,0|1,0,0]=2 559 B4R0.2 CC=CSC MCULE-5921906156 [1,0,0,0,0,0|1,0,0]=2 560 B4R0.2 CCC=CBr MCULE-4471551501 [1,0,0,0,0,0|1,0,1]=3 561 B4R0.2 CCC=NO MCULE-9457280654 [1,0,0,0,0,0|1,0,2]=4 562 B4R0.2 CCCC=O MCULE-8530391347 [1,0,0,0,0,0|0,0,2]=3 563 B4R0.2 CCCCC MCULE-4643148765 [1,0,0,0,0,0|0,0,3]=4 564 B4R0.2 CCCNC MCULE-2266616259 [1,0,0,0,0,0|1,0,2]=4 565 B4R0.2 CCCNC MCULE-7722796872 [1,0,0,0,0,0|1,0,2]=4 566 B4R0.2 CCCOC MCULE-5854067718 [1,0,0,0,0,0|1,0,2]=4 567 B4R0.2 CCCSC MCULE-8387041737 [1,0,0,0,0,0|1,0,2]=4 568 B4R0.2 CCN=C=O MCULE-6522145601 [1,0,0,0,0,0|1,0,2]=4 569 B4R0.2 CCNC=O MCULE-9309926274 [1,0,0,0,0,0|1,0,1]=3 570 B4R0.2 CCNCC MCULE-3395060353 [1,0,0,0,0,0|1,0,2]=4 571 B4R0.2 CCNCC MCULE-4374609736 [1,0,0,0,0,0|1,0,2]=4 572 B4R0.2 CCNCC MCULE-4555901025 [1,0,0,0,0,0|1,0,2]=4 573 B4R0.2 CCNCC MCULE-6895602113 [1,0,0,0,0,0|1,0,2]=4 574 B4R0.2 CCNOC MCULE-4797714235 [1,0,0,0,0,0|2,0,1]=4 575 B4R0.2 CCNOC MCULE-6486167423 [1,0,0,0,0,0|2,0,1]=4 576 B4R0.2 CCOC=N MCULE-5321655909 [1,0,0,0,0,0|2,0,1]=4 577 B4R0.2 CCOC=N MCULE-8158357614 [1,0,0,0,0,0|2,0,1]=4 578 B4R0.2 CCOC=O MCULE-6245072161 [1,0,0,0,0,0|1,0,1]=3 579 B4R0.2 CCOCC MCULE-5665709021 [1,0,0,0,0,0|1,0,2]=4 580 B4R0.2 CCONC MCULE-5446312516 [1,0,0,0,0,0|2,0,1]=4 581 B4R0.2 CCONC MCULE-7976027802 [1,0,0,0,0,0|2,0,1]=4 582 B4R0.2 CCSCC MCULE-6480710239 [1,0,0,0,0,0|1,0,2]=4 583 B4R0.2 CCSSC MCULE-9430585714 [1,0,0,0,0,0|2,0,1]=4 584 B4R0.2 CC[NH2+]CC MCULE-9899430356 [1,0,0,0,0,0|1,0,2]=4 585 B4R0.2 COCC=O MCULE-9427361019 [1,0,0,0,0,0|1,0,1]=3 586 B4R0.2 COCOC MCULE-8559076702 [1,0,0,0,0,0|2,0,1]=4 587 B4R0.2 CSCSC MCULE-5603964020 [1,0,0,0,0,0|2,0,1]=4 588 B4R0.2 CSSSC MCULE-4175573612 [1,0,0,0,0,0|3,0,0]=4 589 B4R0.2 Cl/C=C/CCl MCULE-4516188972 [1,0,0,0,0,0|2,0,1]=4 590 B4R0.2 ClC/C=C/Br MCULE-1061414929 [1,0,0,0,0,0|2,0,1]=4 591 B4R0.2 ClC=CCCl MCULE-4655672652 [1,0,0,0,0,0|2,0,1]=4 592 B4R0.2 N/C=C/C=O MCULE-2444951625 [1,0,0,0,0,0|1,0,0]=2 593 B4R0.2 NC=CC=O MCULE-4070918342 [1,0,0,0,0,0|1,0,0]=2 594 B4R0.2 O=CCCBr MCULE-4107157458 [1,0,0,0,0,0|1,0,2]=4 595 B4R0.2 O=CCCCl MCULE-5863929313 [1,0,0,0,0,0|1,0,2]=4 596 B4R0.2 O=CCCI MCULE-9771140462 [1,0,0,0,0,0|1,0,2]=4 597 B4R0.2 O=CCCO MCULE-1685289763 [1,0,0,0,0,0|1,0,2]=4 598 B4R0.2 O=CNC=O MCULE-3098379420 [1,0,0,0,0,0|2,0,0]=3 599 B4R0.2 O=COC=O MCULE-6311384332 [1,0,0,0,0,0|2,0,0]=3 600 B4R0.2 O=C[N-]C=O MCULE-4923470284 [1,0,0,0,0,0|2,0,0]=3 601 B4R0.2 OC=CCCl MCULE-4750991393 [1,0,0,0,0,0|1,0,2]=4 602 B4R0.2 OCC=CBr MCULE-4636104289 [1,0,0,0,0,0|1,0,2]=4 603 B4R0.2 OCC=CCl MCULE-2110127594 [1,0,0,0,0,0|1,0,2]=4 604 B4R0.2 [NH2+](CC)CC MCULE-1192179232 [1,0,0,0,0,0|1,0,2]=4 605 B6R0.1 C#C/C(=C\CO)/C MCULE-5643545939 [0,1,0,0,0,0|2,0,1]=4 606 B6R0.1 C#CC(=CCO)C MCULE-7063837718 [0,1,0,0,0,0|2,0,1]=4 607 B6R0.1 C#CC(=O)CCC MCULE-8990254228 [0,1,0,0,0,0|0,0,3]=4 608 B6R0.1 C#CC(=O)NCC MCULE-3703208943 [0,1,0,0,0,0|1,0,2]=4 609 B6R0.1 C#CC(=O)OCC MCULE-3783424133 [0,1,0,0,0,0|1,0,2]=4 610 B6R0.1 C#CCC(=O)OC MCULE-8097491486 [0,1,0,0,0,0|0,0,3]=4 611 B6R0.1 C(=C/C(=O)CC)\C MCULE-9250312874 [0,1,0,0,0,0|0,0,0]=1 612 B6R0.1 C/C(=N\O)/C=N/O MCULE-3049929204 [0,1,0,0,0,0|2,0,1]=4 613 B6R0.1 C/C=C/C(=O)OC MCULE-8935178488 [0,1,0,0,0,0|0,0,0]=1 614 B6R0.1 C=C=CC(=O)OC MCULE-7885631451 [0,1,0,0,0,0|0,0,2]=3 615 B6R0.1 C=CC(=O)CCC MCULE-9373104880 [0,1,0,0,0,0|0,0,3]=4 616 B6R0.1 C=CC(=O)COC MCULE-1933195578 [0,1,0,0,0,0|1,0,2]=4 617 B6R0.1 C=CC(=O)NCC MCULE-3515057147 [0,1,0,0,0,0|1,0,2]=4 618 B6R0.1 C=CC(=O)OCC MCULE-9281713240 [0,1,0,0,0,0|1,0,2]=4 619 B6R0.1 C=CCC(=O)CN MCULE-3960819679 [0,1,0,0,0,0|0,0,2]=3 620 B6R0.1 C=CCC(=O)CN MCULE-8089375331 [0,1,0,0,0,0|0,0,2]=3 621 B6R0.1 C=CCC(=O)NC MCULE-4823208577 [0,1,0,0,0,0|0,0,2]=3 622 B6R0.1 C=CCC(=O)OC MCULE-5546680906 [0,1,0,0,0,0|0,0,2]=3 623 B6R0.1 C=CCC(C)C=O MCULE-3981206051 [0,1,0,0,0,0|0,0,3]=4 624 B6R0.1 C=CC[C@H](C)C=O MCULE-6968117309 [0,1,0,0,0,0|0,0,3]=4 625 B6R0.1 C=COC(=O)CC MCULE-7662621547 [0,1,0,0,0,0|1,0,1]=3 626 B6R0.1 C=COC(=O)CCl MCULE-7675766105 [0,1,0,0,0,0|1,0,1]=3 627 B6R0.1 CC#CC(=O)NN MCULE-2475728417 [0,1,0,0,0,0|1,0,2]=4 628 B6R0.1 CC#CC(=O)OC MCULE-6108678475 [0,1,0,0,0,0|0,0,2]=3 629 B6R0.1 CC(=CCBr)CBr MCULE-6875050264 [0,1,0,0,0,0|2,0,1]=4 630 B6R0.1 CC(=CCBr)CCl MCULE-3390489656 [0,1,0,0,0,0|2,0,1]=4 631 B6R0.1 CC(=CCN)C#N MCULE-1319014311 [0,1,0,0,0,0|2,0,1]=4 632 B6R0.1 CC(=CCN)C#N MCULE-4924794215 [0,1,0,0,0,0|2,0,1]=4 633 B6R0.1 CC(=CN=O)NO MCULE-1780424821 [0,1,0,0,0,0|2,0,1]=4 634 B6R0.1 CC(=NO)C=NO MCULE-9711224051 [0,1,0,0,0,0|2,0,1]=4 635 B6R0.1 CC/C(=C\C#N)/[O-] MCULE-6169735980 [0,1,0,0,0,0|1,0,2]=4 636 B6R0.1 CC/C(=C\C#N)/[O-] MCULE-7276617737 [0,1,0,0,0,0|1,0,2]=4 637 B6R0.1 CC/C=C(\C)/C=O MCULE-6692882718 [0,1,0,0,0,0|0,0,1]=2 638 B6R0.1 CC=CC(=O)CC MCULE-5948495959 [0,1,0,0,0,0|0,0,0]=1 639 B6R0.1 CC=CC(=O)OC MCULE-1093700917 [0,1,0,0,0,0|0,0,0]=1 640 B6R0.1 CC=C[C@@H](N)CO MCULE-4690559736 [0,1,0,0,0,0|1,0,1]=3 641 B6R0.1 CC=C[C@@H](N)CO MCULE-5852475953 [0,1,0,0,0,0|1,0,1]=3 642 B6R0.1 CC=C[C@H](N)CO MCULE-6168992245 [0,1,0,0,0,0|1,0,1]=3 643 B6R0.1 CC=C[C@H](N)CO MCULE-6971252398 [0,1,0,0,0,0|1,0,1]=3 644 B6R0.1 CCC(=CCO)C MCULE-5264054153 [0,1,0,0,0,0|2,0,1]=4 645 B6R0.1 CCC(=O)CC#N MCULE-6150629588 [0,1,0,0,0,0|1,0,2]=4 646 B6R0.1 CCC(=O)CNC MCULE-3030105640 [0,1,0,0,0,0|1,0,1]=3 647 B6R0.1 CCC(=O)CNC MCULE-6945295017 [0,1,0,0,0,0|1,0,1]=3 648 B6R0.1 CCC(=O)COC MCULE-1087802011 [0,1,0,0,0,0|1,0,1]=3 649 B6R0.1 CCC(=O)CSC MCULE-3230433182 [0,1,0,0,0,0|1,0,1]=3 650 B6R0.1 CCC(=O)NOC MCULE-4440074406 [0,1,0,0,0,0|2,0,0]=3 651 B6R0.1 CCC(=O)OCCl MCULE-6975707373 [0,1,0,0,0,0|2,0,1]=4 652 B6R0.1 CCC=C(C)C=O MCULE-1636090264 [0,1,0,0,0,0|0,0,1]=2 653 B6R0.1 CCCC(=NO)C MCULE-6437787263 [0,1,0,0,0,0|0,0,3]=4 654 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [0,1,0,0,0,0|0,0,2]=3 655 B6R0.1 CCCC(=O)CC MCULE-7121523805 [0,1,0,0,0,0|0,0,2]=3 656 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [0,1,0,0,0,0|0,0,2]=3 657 B6R0.1 CCCC(=O)CN MCULE-4663263123 [0,1,0,0,0,0|0,0,2]=3 658 B6R0.1 CCCC(=O)CN MCULE-6326368932 [0,1,0,0,0,0|0,0,2]=3 659 B6R0.1 CCCC(=O)CO MCULE-6518249412 [0,1,0,0,0,0|0,0,2]=3 660 B6R0.1 CCCC(=O)NC MCULE-5770149071 [0,1,0,0,0,0|0,0,2]=3 661 B6R0.1 CCCC(=O)NN MCULE-3660167295 [0,1,0,0,0,0|1,0,2]=4 662 B6R0.1 CCCC(=O)NO MCULE-8710375368 [0,1,0,0,0,0|1,0,2]=4 663 B6R0.1 CCCC(=O)OC MCULE-1092030267 [0,1,0,0,0,0|0,0,2]=3 664 B6R0.1 CCCC(=O)SC MCULE-1490654381 [0,1,0,0,0,0|0,0,2]=3 665 B6R0.1 CCCC(=S)OC MCULE-8125476093 [0,1,0,0,0,0|0,1,2]=4 666 B6R0.1 CCCC(C)C=O MCULE-9756444218 [0,1,0,0,0,0|0,0,3]=4 667 B6R0.1 CCNC(=O)CBr MCULE-5393521747 [0,1,0,0,0,0|1,0,1]=3 668 B6R0.1 CCNC(=O)CC MCULE-8820594723 [0,1,0,0,0,0|1,0,1]=3 669 B6R0.1 CCNC(=O)CCl MCULE-7288703153 [0,1,0,0,0,0|1,0,1]=3 670 B6R0.1 CCNC(=O)CN MCULE-1913543460 [0,1,0,0,0,0|1,0,1]=3 671 B6R0.1 CCNC(=O)CN MCULE-5473845751 [0,1,0,0,0,0|1,0,1]=3 672 B6R0.1 CCNC(=O)CO MCULE-1386307800 [0,1,0,0,0,0|1,0,1]=3 673 B6R0.1 CCNC(=O)NC MCULE-7197803115 [0,1,0,0,0,0|1,0,1]=3 674 B6R0.1 CCNC(=O)NN MCULE-9055200574 [0,1,0,0,0,0|2,0,1]=4 675 B6R0.1 CCNC(=O)NO MCULE-3264850022 [0,1,0,0,0,0|2,0,1]=4 676 B6R0.1 CCNC(=O)OC MCULE-7110705188 [0,1,0,0,0,0|1,0,1]=3 677 B6R0.1 CCO/C(=N/O)/C MCULE-2336241507 [0,1,0,0,0,0|1,0,2]=4 678 B6R0.1 CCO/C(=N\O)/C MCULE-7101376522 [0,1,0,0,0,0|1,0,2]=4 679 B6R0.1 CCOC(=N)CC MCULE-4645506860 [0,1,0,0,0,0|2,0,1]=4 680 B6R0.1 CCOC(=N)CC MCULE-9526837631 [0,1,0,0,0,0|2,0,1]=4 681 B6R0.1 CCOC(=N)CCl MCULE-6291047852 [0,1,0,0,0,0|2,0,1]=4 682 B6R0.1 CCOC(=N)CCl MCULE-9207251975 [0,1,0,0,0,0|2,0,1]=4 683 B6R0.1 CCOC(=NO)C MCULE-6964305821 [0,1,0,0,0,0|1,0,2]=4 684 B6R0.1 CCOC(=O)C#N MCULE-4506452376 [0,1,0,0,0,0|1,0,2]=4 685 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [0,1,0,0,0,0|1,0,2]=4 686 B6R0.1 CCOC(=O)CBr MCULE-1369687761 [0,1,0,0,0,0|1,0,1]=3 687 B6R0.1 CCOC(=O)CC MCULE-1639864693 [0,1,0,0,0,0|1,0,1]=3 688 B6R0.1 CCOC(=O)CCl MCULE-2200524105 [0,1,0,0,0,0|1,0,1]=3 689 B6R0.1 CCOC(=O)CF MCULE-1926097423 [0,1,0,0,0,0|1,0,1]=3 690 B6R0.1 CCOC(=O)CI MCULE-9898762324 [0,1,0,0,0,0|1,0,1]=3 691 B6R0.1 CCOC(=O)CN MCULE-2185173056 [0,1,0,0,0,0|1,0,1]=3 692 B6R0.1 CCOC(=O)CN MCULE-2628607025 [0,1,0,0,0,0|1,0,1]=3 693 B6R0.1 CCOC(=O)CO MCULE-8121340151 [0,1,0,0,0,0|1,0,1]=3 694 B6R0.1 CCOC(=O)CS MCULE-3354026239 [0,1,0,0,0,0|1,0,1]=3 695 B6R0.1 CCOC(=O)NC MCULE-5506841198 [0,1,0,0,0,0|1,0,1]=3 696 B6R0.1 CCOC(=O)NN MCULE-9872948119 [0,1,0,0,0,0|2,0,1]=4 697 B6R0.1 CCOC(=O)NO MCULE-4701193610 [0,1,0,0,0,0|2,0,1]=4 698 B6R0.1 CCOC(=O)OC MCULE-1185162684 [0,1,0,0,0,0|1,0,1]=3 699 B6R0.1 CCOC(=S)SC MCULE-6959447720 [0,1,0,0,0,0|1,1,1]=4 700 B6R0.1 CCOS(=O)CC MCULE-4858180441 [0,1,0,0,0,0|2,0,1]=4 701 B6R0.1 CCSC(=O)CC MCULE-6361738004 [0,1,0,0,0,0|1,0,1]=3 702 B6R0.1 CNC(=O)CC#N MCULE-2970000161 [0,1,0,0,0,0|1,0,2]=4 703 B6R0.1 CNC(=O)CCBr MCULE-9239224841 [0,1,0,0,0,0|1,0,2]=4 704 B6R0.1 CNC(=O)CCCl MCULE-7130866366 [0,1,0,0,0,0|1,0,2]=4 705 B6R0.1 CNC(=O)CCN MCULE-1374127264 [0,1,0,0,0,0|1,0,2]=4 706 B6R0.1 CNC(=O)CCN MCULE-3948893656 [0,1,0,0,0,0|1,0,2]=4 707 B6R0.1 CNC(=O)CCO MCULE-3222339741 [0,1,0,0,0,0|1,0,2]=4 708 B6R0.1 CNC(=O)CCS MCULE-2385806944 [0,1,0,0,0,0|1,0,2]=4 709 B6R0.1 CNC(=O)CON MCULE-6451598359 [0,1,0,0,0,0|2,0,1]=4 710 B6R0.1 CNC(=O)CON MCULE-8743298594 [0,1,0,0,0,0|2,0,1]=4 711 B6R0.1 CNCC(=O)NC MCULE-4579550577 [0,1,0,0,0,0|1,0,1]=3 712 B6R0.1 CNCC(=O)NC MCULE-7833395637 [0,1,0,0,0,0|1,0,1]=3 713 B6R0.1 CNCC(=O)NN MCULE-8639164023 [0,1,0,0,0,0|2,0,1]=4 714 B6R0.1 CNCC(=O)OC MCULE-1667683926 [0,1,0,0,0,0|1,0,1]=3 715 B6R0.1 CNCC(=O)OC MCULE-5530863658 [0,1,0,0,0,0|1,0,1]=3 716 B6R0.1 CNNC(=O)OC MCULE-4763095719 [0,1,0,0,0,0|2,0,0]=3 717 B6R0.1 COC(=O)/C=C/Br MCULE-8282646495 [0,1,0,0,0,0|1,0,0]=2 718 B6R0.1 COC(=O)/C=C/I MCULE-2652779390 [0,1,0,0,0,0|1,0,0]=2 719 B6R0.1 COC(=O)/C=C\Br MCULE-8147758029 [0,1,0,0,0,0|1,0,0]=2 720 B6R0.1 COC(=O)/C=C\I MCULE-9091408550 [0,1,0,0,0,0|1,0,0]=2 721 B6R0.1 COC(=O)C#CBr MCULE-2452280844 [0,1,0,0,0,0|1,0,2]=4 722 B6R0.1 COC(=O)C#CI MCULE-2688506741 [0,1,0,0,0,0|1,0,2]=4 723 B6R0.1 COC(=O)C=CBr MCULE-6878439912 [0,1,0,0,0,0|1,0,0]=2 724 B6R0.1 COC(=O)C=CCl MCULE-6895925134 [0,1,0,0,0,0|1,0,0]=2 725 B6R0.1 COC(=O)C=CI MCULE-1616048599 [0,1,0,0,0,0|1,0,0]=2 726 B6R0.1 COC(=O)C=CN MCULE-4685220707 [0,1,0,0,0,0|1,0,0]=2 727 B6R0.1 COC(=O)CC#N MCULE-2699345092 [0,1,0,0,0,0|1,0,2]=4 728 B6R0.1 COC(=O)CC=O MCULE-6624474559 [0,1,0,0,0,0|1,0,1]=3 729 B6R0.1 COC(=O)CCBr MCULE-3565567444 [0,1,0,0,0,0|1,0,2]=4 730 B6R0.1 COC(=O)CCCl MCULE-5034007224 [0,1,0,0,0,0|1,0,2]=4 731 B6R0.1 COC(=O)CCI MCULE-5984806612 [0,1,0,0,0,0|1,0,2]=4 732 B6R0.1 COC(=O)CCN MCULE-2306060188 [0,1,0,0,0,0|1,0,2]=4 733 B6R0.1 COC(=O)CCN MCULE-8245275833 [0,1,0,0,0,0|1,0,2]=4 734 B6R0.1 COC(=O)CCO MCULE-8538834260 [0,1,0,0,0,0|1,0,2]=4 735 B6R0.1 COC(=O)CCS MCULE-1695345183 [0,1,0,0,0,0|1,0,2]=4 736 B6R0.1 COC(=O)CNN MCULE-3287579794 [0,1,0,0,0,0|2,0,1]=4 737 B6R0.1 COC(=O)CNN MCULE-3838874166 [0,1,0,0,0,0|2,0,1]=4 738 B6R0.1 COC(=O)CON MCULE-4799038238 [0,1,0,0,0,0|2,0,1]=4 739 B6R0.1 COC(=O)CSC MCULE-6735536033 [0,1,0,0,0,0|1,0,1]=3 740 B6R0.1 COC(=O)N=C=S MCULE-2981767233 [0,1,0,0,0,0|2,0,1]=4 741 B6R0.1 COC(=O)NC=O MCULE-9852632340 [0,1,0,0,0,0|2,0,0]=3 742 B6R0.1 COC(=O)OCCl MCULE-7856529986 [0,1,0,0,0,0|2,0,1]=4 743 B6R0.1 COC(=O)OCF MCULE-4705008675 [0,1,0,0,0,0|2,0,1]=4 744 B6R0.1 COC(=O)OCI MCULE-8692720175 [0,1,0,0,0,0|2,0,1]=4 745 B6R0.1 COCC(=N)OC MCULE-2350779439 [0,1,0,0,0,0|2,0,1]=4 746 B6R0.1 COCC(=N)OC MCULE-7810421458 [0,1,0,0,0,0|2,0,1]=4 747 B6R0.1 COCC(=O)CCl MCULE-7542636020 [0,1,0,0,0,0|1,0,1]=3 748 B6R0.1 COCC(=O)NN MCULE-4127487886 [0,1,0,0,0,0|2,0,1]=4 749 B6R0.1 COCC(=O)OC MCULE-8337685268 [0,1,0,0,0,0|1,0,1]=3 750 B6R0.1 COCC(C)C=O MCULE-7679332713 [0,1,0,0,0,0|1,0,2]=4 751 B6R0.1 CONC(=O)OC MCULE-9304532248 [0,1,0,0,0,0|2,0,0]=3 752 B6R0.1 CSCC(=O)NN MCULE-8151954663 [0,1,0,0,0,0|2,0,1]=4 753 B6R0.1 NCCC(=O)CN MCULE-3906468943 [0,1,0,0,0,0|1,0,2]=4 754 B6R0.1 NCCC(=O)CN MCULE-9593243702 [0,1,0,0,0,0|1,0,2]=4 755 B6R0.1 O=C(C=CCl)CCl MCULE-6121304267 [0,1,0,0,0,0|1,0,0]=2 756 B6R0.1 O=C(CCl)CCCl MCULE-6460902474 [0,1,0,0,0,0|1,0,2]=4 757 B6R0.1 O=C(CCl)NCO MCULE-9960585064 [0,1,0,0,0,0|2,0,1]=4 758 B6R0.1 O=C=NC(=O)CCl MCULE-8927897165 [0,1,0,0,0,0|2,0,1]=4 759 B6R0.2 C/C(=C\C(=S)N)/N MCULE-9311101194 [0,1,0,0,0,0|1,1,0]=3 760 B6R0.2 C=C(C)C=C(C)C MCULE-1842732141 [0,1,0,0,0,0|1,0,0]=2 761 B6R0.2 C=C(C)CC(=O)C MCULE-3534735279 [0,1,0,0,0,0|0,0,1]=2 762 B6R0.2 C=C(C)CC(=O)O MCULE-5404023928 [0,1,0,0,0,0|1,0,1]=3 763 B6R0.2 C=C(C)CC(C)C MCULE-5553118538 [0,1,0,0,0,0|1,0,2]=4 764 B6R0.2 C=C(C)C[C@@H](C)O MCULE-8518319636 [0,1,0,0,0,0|0,0,3]=4 765 B6R0.2 C=C(C)C[C@H](C)O MCULE-7139115019 [0,1,0,0,0,0|0,0,3]=4 766 B6R0.2 C=C(C)OC(=O)C MCULE-9345377025 [0,1,0,0,0,0|1,0,0]=2 767 B6R0.2 C=C(I)CC(=O)O MCULE-3849925169 [0,1,0,0,0,0|1,0,2]=4 768 B6R0.2 CC(=CB(O)O)C MCULE-5305023524 [0,1,0,0,0,0|2,0,1]=4 769 B6R0.2 CC(=CC(=O)Cl)C MCULE-7644585609 [0,1,0,0,0,0|1,0,0]=2 770 B6R0.2 CC(=CC(=O)N)C MCULE-6264319579 [0,1,0,0,0,0|1,0,0]=2 771 B6R0.2 CC(=CC(=O)O)C MCULE-4772426340 [0,1,0,0,0,0|1,0,0]=2 772 B6R0.2 CC(=CC(=O)O)Cl MCULE-7503760292 [0,1,0,0,0,0|1,0,0]=2 773 B6R0.2 CC(=CC(=O)O)I MCULE-2652373771 [0,1,0,0,0,0|1,0,0]=2 774 B6R0.2 CC(=CC(=O)O)N MCULE-5894724848 [0,1,0,0,0,0|1,0,0]=2 775 B6R0.2 CC(=CC(=S)N)N MCULE-2731073832 [0,1,0,0,0,0|1,1,0]=3 776 B6R0.2 CC(=CC(C)C)C MCULE-5460531772 [0,1,0,0,0,0|1,0,1]=3 777 B6R0.2 CC(=CC(C)O)C MCULE-5270694894 [0,1,0,0,0,0|0,0,2]=3 778 B6R0.2 CC(=CN(=O)=O)C MCULE-7745125648 [0,1,0,0,0,0|2,0,0]=3 779 B6R0.2 CC(=C[N+](=O)[O-])[O-] MCULE-1079281493 [0,1,0,0,0,0|2,0,0]=3 780 B6R0.2 CC(=C[N+](=O)[O-])[O-] MCULE-4355961794 [0,1,0,0,0,0|2,0,0]=3 781 B6R0.2 CC(=N)CC(=O)C MCULE-4678643052 [0,1,0,0,0,0|0,0,1]=2 782 B6R0.2 CC(=NC(C)C)C MCULE-4174313497 [0,1,0,0,0,0|2,0,1]=4 783 B6R0.2 CC(=NN(C)C)C MCULE-6010928278 [0,1,0,0,0,0|3,0,0]=4 784 B6R0.2 CC(=O)/C=C(/C)\N MCULE-1235186190 [0,1,0,0,0,0|0,0,0]=1 785 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-3445340105 [0,1,0,0,0,0|0,0,0]=1 786 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-7833799417 [0,1,0,0,0,0|0,0,0]=1 787 B6R0.2 CC(=O)/C=C(\C)/N MCULE-6412393370 [0,1,0,0,0,0|0,0,0]=1 788 B6R0.2 CC(=O)C=C(C)C MCULE-4922478422 [0,1,0,0,0,0|0,0,0]=1 789 B6R0.2 CC(=O)C=C(C)N MCULE-2247743178 [0,1,0,0,0,0|0,0,0]=1 790 B6R0.2 CC(=O)C=C(C)O MCULE-7345258397 [0,1,0,0,0,0|0,0,0]=1 791 B6R0.2 CC(=O)C=C(C)[O-] MCULE-7733093724 [0,1,0,0,0,0|0,0,0]=1 792 B6R0.2 CC(=O)CC(=O)C MCULE-6481204381 [0,1,0,0,0,0|0,0,1]=2 793 B6R0.2 CC(=O)CC(=O)N MCULE-1618058771 [0,1,0,0,0,0|1,0,1]=3 794 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [0,1,0,0,0,0|1,0,1]=3 795 B6R0.2 CC(=O)CC(=O)[O-] MCULE-6317885864 [0,1,0,0,0,0|1,0,1]=3 796 B6R0.2 CC(=O)CC(=O)[O-] MCULE-8448177875 [0,1,0,0,0,0|1,0,1]=3 797 B6R0.2 CC(=O)CC(C)C MCULE-2172909634 [0,1,0,0,0,0|0,0,2]=3 798 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [0,1,0,0,0,0|0,0,2]=3 799 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [0,1,0,0,0,0|0,0,2]=3 800 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [0,1,0,0,0,0|0,0,2]=3 801 B6R0.2 CC(=O)CN(=O)=O MCULE-3153232896 [0,1,0,0,0,0|2,0,1]=4 802 B6R0.2 CC(=O)CN(C)C MCULE-8561521241 [0,1,0,0,0,0|1,0,1]=3 803 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [0,1,0,0,0,0|0,0,2]=3 804 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [0,1,0,0,0,0|0,0,2]=3 805 B6R0.2 CC(=O)NC(=N)N MCULE-9300028018 [0,1,0,0,0,0|2,0,0]=3 806 B6R0.2 CC(=O)NC(=O)C MCULE-3040534108 [0,1,0,0,0,0|1,0,0]=2 807 B6R0.2 CC(=O)NC(=O)N MCULE-8999775359 [0,1,0,0,0,0|2,0,0]=3 808 B6R0.2 CC(=O)NC(=S)N MCULE-8448117000 [0,1,0,0,0,0|2,0,0]=3 809 B6R0.2 CC(=O)NC(C)C MCULE-2095134698 [0,1,0,0,0,0|1,0,1]=3 810 B6R0.2 CC(=O)NN(C)C MCULE-3444969121 [0,1,0,0,0,0|2,0,0]=3 811 B6R0.2 CC(=O)NN(C)C MCULE-5383938091 [0,1,0,0,0,0|2,0,0]=3 812 B6R0.2 CC(=O)OC(=O)C MCULE-9184217748 [0,1,0,0,0,0|1,0,0]=2 813 B6R0.2 CC(=O)OC(C)Br MCULE-6494616843 [0,1,0,0,0,0|1,0,1]=3 814 B6R0.2 CC(=O)OC(C)C MCULE-6152257819 [0,1,0,0,0,0|1,0,1]=3 815 B6R0.2 CC(=O)OC(C)Cl MCULE-3738479003 [0,1,0,0,0,0|1,0,1]=3 816 B6R0.2 CC(=O)SC(=O)C MCULE-5749449964 [0,1,0,0,0,0|1,0,0]=2 817 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-4855074933 [0,1,0,0,0,0|0,0,1]=2 818 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-6905854247 [0,1,0,0,0,0|0,0,1]=2 819 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [0,1,0,0,0,0|1,0,2]=4 820 B6R0.2 CC(C)CC(=O)Cl MCULE-8821231794 [0,1,0,0,0,0|1,0,2]=4 821 B6R0.2 CC(C)CC(=O)N MCULE-7790849976 [0,1,0,0,0,0|1,0,2]=4 822 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [0,1,0,0,0,0|1,0,2]=4 823 B6R0.2 CC(C)NC(=O)N MCULE-2725741897 [0,1,0,0,0,0|2,0,1]=4 824 B6R0.2 CC(C)OC(=O)Cl MCULE-3303340398 [0,1,0,0,0,0|2,0,1]=4 825 B6R0.2 CC(C)OC(=O)N MCULE-9996500963 [0,1,0,0,0,0|2,0,1]=4 826 B6R0.2 CC(C)SC(=O)Cl MCULE-9803882280 [0,1,0,0,0,0|2,0,1]=4 827 B6R0.2 CC(Cl)CC(=O)Cl MCULE-3323045052 [0,1,0,0,0,0|1,0,2]=4 828 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [0,1,0,0,0,0|1,0,2]=4 829 B6R0.2 CC(Cl)OC(=O)Cl MCULE-8020850544 [0,1,0,0,0,0|2,0,1]=4 830 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [0,1,0,0,0,0|1,0,2]=4 831 B6R0.2 CC(N)CC(=O)N MCULE-8604112274 [0,1,0,0,0,0|1,0,2]=4 832 B6R0.2 CC(N)CC(=O)N MCULE-8651032460 [0,1,0,0,0,0|1,0,2]=4 833 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [0,1,0,0,0,0|1,0,2]=4 834 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [0,1,0,0,0,0|1,0,2]=4 835 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [0,1,0,0,0,0|1,0,2]=4 836 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [0,1,0,0,0,0|1,0,2]=4 837 B6R0.2 CC(N)CS(=O)C MCULE-1278482312 [0,1,0,0,0,0|1,0,2]=4 838 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [0,1,0,0,0,0|1,0,2]=4 839 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [0,1,0,0,0,0|1,0,2]=4 840 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [0,1,0,0,0,0|1,0,2]=4 841 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [0,1,0,0,0,0|1,0,2]=4 842 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [0,1,0,0,0,0|1,0,2]=4 843 B6R0.2 CC(O)CS(=O)C MCULE-2365161952 [0,1,0,0,0,0|1,0,2]=4 844 B6R0.2 CN(C)CC(=O)Cl MCULE-2168217529 [0,1,0,0,0,0|2,0,1]=4 845 B6R0.2 CN(C)CC(=O)Cl MCULE-6810056185 [0,1,0,0,0,0|2,0,1]=4 846 B6R0.2 CN(C)CC(=O)N MCULE-3894706713 [0,1,0,0,0,0|2,0,1]=4 847 B6R0.2 CN(C)CC(=O)O MCULE-2303978039 [0,1,0,0,0,0|2,0,1]=4 848 B6R0.2 CN(C)CC(=O)O MCULE-3368936600 [0,1,0,0,0,0|2,0,1]=4 849 B6R0.2 CN(C)CC(=O)[O-] MCULE-3077067854 [0,1,0,0,0,0|2,0,1]=4 850 B6R0.2 CN(C)NC(=O)N MCULE-4462686977 [0,1,0,0,0,0|3,0,0]=4 851 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [0,1,0,0,0,0|1,0,2]=4 852 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [0,1,0,0,0,0|1,0,2]=4 853 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [0,1,0,0,0,0|1,0,2]=4 854 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [0,1,0,0,0,0|1,0,2]=4 855 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [0,1,0,0,0,0|1,0,2]=4 856 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [0,1,0,0,0,0|1,0,2]=4 857 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [0,1,0,0,0,0|1,0,2]=4 858 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [0,1,0,0,0,0|1,0,2]=4 859 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [0,1,0,0,0,0|1,0,2]=4 860 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [0,1,0,0,0,0|1,0,2]=4 861 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [0,1,0,0,0,0|1,0,2]=4 862 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [0,1,0,0,0,0|1,0,2]=4 863 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [0,1,0,0,0,0|1,0,2]=4 864 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [0,1,0,0,0,0|1,0,2]=4 865 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [0,1,0,0,0,0|1,0,2]=4 866 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [0,1,0,0,0,0|1,0,2]=4 867 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [0,1,0,0,0,0|1,0,2]=4 868 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [0,1,0,0,0,0|1,0,2]=4 869 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-1975585935 [0,1,0,0,0,0|2,0,1]=4 870 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-7679949306 [0,1,0,0,0,0|2,0,1]=4 871 B6R0.2 N=C(N)CC(=O)N MCULE-9200673939 [0,1,0,0,0,0|2,0,1]=4 872 B6R0.2 N=C(N)NC(=O)N MCULE-1919966850 [0,1,0,0,0,0|3,0,0]=4 873 B6R0.2 N=C(N)NC(=O)N MCULE-3428379172 [0,1,0,0,0,0|3,0,0]=4 874 B6R0.2 N=C(N)NC(=O)N MCULE-6044803486 [0,1,0,0,0,0|3,0,0]=4 875 B6R0.2 N=C(N)NC(=O)N MCULE-8893931961 [0,1,0,0,0,0|3,0,0]=4 876 B6R0.2 N=C([NH3+])CC(=O)N MCULE-7769639649 [0,1,0,0,0,0|2,0,1]=4 877 B6R0.2 NC(=CN(=O)=O)N MCULE-9629386307 [0,1,0,0,0,0|3,0,0]=4 878 B6R0.2 NC(=O)CC(=O)N MCULE-7675159766 [0,1,0,0,0,0|2,0,1]=4 879 B6R0.2 NC(=O)CC(=O)O MCULE-1168254626 [0,1,0,0,0,0|2,0,1]=4 880 B6R0.2 NC(=O)CC(=S)N MCULE-9383188328 [0,1,0,0,0,0|2,0,1]=4 881 B6R0.2 NC(=O)NC(=O)N MCULE-4571627886 [0,1,0,0,0,0|3,0,0]=4 882 B6R0.2 O=C(Cl)CC(=O)Cl MCULE-8779098368 [0,1,0,0,0,0|2,0,1]=4 883 B6R0.2 O=C(O)C=C(Br)Br MCULE-4379078717 [0,1,0,0,0,0|2,0,0]=3 884 B6R0.2 O=C(O)C=C(Cl)Cl MCULE-5096440659 [0,1,0,0,0,0|2,0,0]=3 885 B6R0.2 O=C(O)CC(=O)O MCULE-5893043131 [0,1,0,0,0,0|2,0,1]=4 886 B6R0.2 O=C([O-])CC(=O)[O-] MCULE-2327820884 [0,1,0,0,0,0|2,0,1]=4 887 B6R0.2 O=C([O-])CC(=O)[O-] MCULE-6849635529 [0,1,0,0,0,0|2,0,1]=4 888 B6R0.2 O=N(=O)C=C(Cl)Cl MCULE-9907270101 [0,1,0,0,0,0|3,0,0]=4 889 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [0,1,0,0,0,0|2,0,1]=4 890 B6R0.3 C/C=C(/C)\C(=O)O MCULE-2116066534 [0,1,0,0,0,0|1,0,0]=2 891 B6R0.3 C/C=C(\Br)/C(=O)O MCULE-5940308548 [0,1,0,0,0,0|1,0,0]=2 892 B6R0.3 C/C=C(\C)/C(=O)O MCULE-4890719796 [0,1,0,0,0,0|1,0,0]=2 893 B6R0.3 C/C=C(\O)/C(=O)O MCULE-9596699660 [0,1,0,0,0,0|1,0,0]=2 894 B6R0.3 C=C(Br)C(=O)OC MCULE-6192595524 [0,1,0,0,0,0|2,0,1]=4 895 B6R0.3 C=C(C#N)C(=O)O MCULE-1746285232 [0,1,0,0,0,0|2,0,1]=4 896 B6R0.3 C=C(C)C(=O)NC MCULE-9515227181 [0,1,0,0,0,0|2,0,0]=3 897 B6R0.3 C=C(C)C(=O)NN MCULE-5114453960 [0,1,0,0,0,0|3,0,0]=4 898 B6R0.3 C=C(C)C(=O)OC MCULE-9286083206 [0,1,0,0,0,0|2,0,0]=3 899 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [0,1,0,0,0,0|1,0,2]=4 900 B6R0.3 C=C(CBr)C(=O)O MCULE-7257367588 [0,1,0,0,0,0|2,0,1]=4 901 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [0,1,0,0,0,0|1,0,1]=3 902 B6R0.3 C=C(CO)C(=O)O MCULE-9731648602 [0,1,0,0,0,0|2,0,1]=4 903 B6R0.3 C=C(Cl)C(=O)OC MCULE-6494333767 [0,1,0,0,0,0|2,0,1]=4 904 B6R0.3 C=C(F)C(=O)OC MCULE-8485282148 [0,1,0,0,0,0|2,0,1]=4 905 B6R0.3 C=C(OC)C(=O)O MCULE-9965334560 [0,1,0,0,0,0|2,0,0]=3 906 B6R0.3 C=CC(=O)C(=O)O MCULE-9816982424 [0,1,0,0,0,0|1,0,1]=3 907 B6R0.3 C=CC(=O)C(C)C MCULE-8577593172 [0,1,0,0,0,0|1,0,2]=4 908 B6R0.3 C=CC(=O)N(C)C MCULE-3105693382 [0,1,0,0,0,0|2,0,1]=4 909 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [0,1,0,0,0,0|1,0,2]=4 910 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [0,1,0,0,0,0|1,0,2]=4 911 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [0,1,0,0,0,0|1,0,2]=4 912 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [0,1,0,0,0,0|1,0,2]=4 913 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [0,1,0,0,0,0|1,0,2]=4 914 B6R0.3 C=CC(O)C(=O)O MCULE-3847595710 [0,1,0,0,0,0|1,0,2]=4 915 B6R0.3 C=CN(C)C(=O)C MCULE-2418332000 [0,1,0,0,0,0|1,0,1]=3 916 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [0,1,0,0,0,0|1,0,2]=4 917 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [0,1,0,0,0,0|1,0,2]=4 918 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [0,1,0,0,0,0|1,0,2]=4 919 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [0,1,0,0,0,0|1,0,2]=4 920 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [0,1,0,0,0,0|1,0,2]=4 921 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [0,1,0,0,0,0|1,0,2]=4 922 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [0,1,0,0,0,0|1,0,2]=4 923 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [0,1,0,0,0,0|1,0,2]=4 924 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [0,1,0,0,0,0|1,0,2]=4 925 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [0,1,0,0,0,0|1,0,2]=4 926 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [0,1,0,0,0,0|1,0,2]=4 927 B6R0.3 CC(=C(Br)CBr)C MCULE-2575044530 [0,1,0,0,0,0|2,0,1]=4 928 B6R0.3 CC(=C(Br)CN)C MCULE-2433306744 [0,1,0,0,0,0|2,0,1]=4 929 B6R0.3 CC(=C(C)CO)C MCULE-2852322197 [0,1,0,0,0,0|2,0,1]=4 930 B6R0.3 CC(=C(F)CN)C MCULE-8503104664 [0,1,0,0,0,0|2,0,1]=4 931 B6R0.3 CC(=C(F)CN)C MCULE-8932417146 [0,1,0,0,0,0|2,0,1]=4 932 B6R0.3 CC(=C(F)CO)C MCULE-3552996593 [0,1,0,0,0,0|2,0,1]=4 933 B6R0.3 CC(=CBr)C(=O)O MCULE-3682516046 [0,1,0,0,0,0|2,0,0]=3 934 B6R0.3 CC(=NO)C(=O)O MCULE-8264934008 [0,1,0,0,0,0|3,0,0]=4 935 B6R0.3 CC(=O)/C(=N/O)/C MCULE-2017881701 [0,1,0,0,0,0|2,0,0]=3 936 B6R0.3 CC(=O)/C(=N\O)/C MCULE-6814264333 [0,1,0,0,0,0|2,0,0]=3 937 B6R0.3 CC(=O)C(=NO)C MCULE-3626428375 [0,1,0,0,0,0|2,0,0]=3 938 B6R0.3 CC(=O)C(=NO)Cl MCULE-9930401042 [0,1,0,0,0,0|2,0,0]=3 939 B6R0.3 CC(=O)C(=O)CBr MCULE-8560925164 [0,1,0,0,0,0|1,0,1]=3 940 B6R0.3 CC(=O)C(=O)CCl MCULE-2778551811 [0,1,0,0,0,0|1,0,1]=3 941 B6R0.3 CC(=O)C(Br)C=O MCULE-6904531970 [0,1,0,0,0,0|1,0,1]=3 942 B6R0.3 CC(=O)C(C)C#N MCULE-3849364002 [0,1,0,0,0,0|1,0,2]=4 943 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [0,1,0,0,0,0|1,0,1]=3 944 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [0,1,0,0,0,0|1,0,2]=4 945 B6R0.3 CC(=O)C(Cl)C#N MCULE-7984925847 [0,1,0,0,0,0|1,0,2]=4 946 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [0,1,0,0,0,0|1,0,2]=4 947 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [0,1,0,0,0,0|1,0,2]=4 948 B6R0.3 CC=C(Br)C(=O)O MCULE-5368794596 [0,1,0,0,0,0|1,0,0]=2 949 B6R0.3 CC=C(C)B(O)O MCULE-7915552360 [0,1,0,0,0,0|2,0,1]=4 950 B6R0.3 CC=C(C)C(=O)C MCULE-8950290711 [0,1,0,0,0,0|0,0,0]=1 951 B6R0.3 CC=C(C)C(=O)Cl MCULE-2974704783 [0,1,0,0,0,0|1,0,0]=2 952 B6R0.3 CC=C(C)C(=O)O MCULE-2390677360 [0,1,0,0,0,0|1,0,0]=2 953 B6R0.3 CC=C(C)C(C)C MCULE-4070109813 [0,1,0,0,0,0|1,0,1]=3 954 B6R0.3 CC=C(Cl)C(=O)O MCULE-5827690088 [0,1,0,0,0,0|1,0,0]=2 955 B6R0.3 CC=C(F)C(=O)O MCULE-5053310707 [0,1,0,0,0,0|1,0,0]=2 956 B6R0.3 CC=C(O)C(=O)O MCULE-7886990963 [0,1,0,0,0,0|1,0,0]=2 957 B6R0.3 CCC(=C(C)C)C MCULE-7258057243 [0,1,0,0,0,0|1,0,1]=3 958 B6R0.3 CCC(=O)C(=O)C MCULE-3065014067 [0,1,0,0,0,0|0,0,1]=2 959 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [0,1,0,0,0,0|1,0,1]=3 960 B6R0.3 CCC(=O)C(=O)[O-] MCULE-7571698792 [0,1,0,0,0,0|1,0,1]=3 961 B6R0.3 CCC(=O)C(C)Br MCULE-2803556971 [0,1,0,0,0,0|1,0,2]=4 962 B6R0.3 CCC(=O)C(C)C MCULE-9576230007 [0,1,0,0,0,0|1,0,2]=4 963 B6R0.3 CCC(=O)C(C)Cl MCULE-8346980404 [0,1,0,0,0,0|1,0,2]=4 964 B6R0.3 CCC(=O)C(C)N MCULE-5434634349 [0,1,0,0,0,0|1,0,2]=4 965 B6R0.3 CCC(=O)C(C)N MCULE-8408562669 [0,1,0,0,0,0|1,0,2]=4 966 B6R0.3 CCC(=O)C(C)O MCULE-4144791660 [0,1,0,0,0,0|0,0,3]=4 967 B6R0.3 CCC(=O)C(C)S MCULE-3934356624 [0,1,0,0,0,0|0,1,2]=4 968 B6R0.3 CCC(=O)N(C)C MCULE-1734001200 [0,1,0,0,0,0|2,0,1]=4 969 B6R0.3 CCC(=S)N(C)C MCULE-7026282622 [0,1,0,0,0,0|2,0,1]=4 970 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [0,1,0,0,0,0|1,0,2]=4 971 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [0,1,0,0,0,0|0,0,2]=3 972 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [0,1,0,0,0,0|1,0,2]=4 973 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [0,1,0,0,0,0|1,0,2]=4 974 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [0,1,0,0,0,0|1,0,2]=4 975 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [0,1,0,0,0,0|0,0,2]=3 976 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [0,1,0,0,0,0|1,0,2]=4 977 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [0,1,0,0,0,0|1,0,2]=4 978 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [0,1,0,0,0,0|1,0,2]=4 979 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [0,1,0,0,0,0|1,0,2]=4 980 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [0,1,0,0,0,0|1,0,2]=4 981 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [0,1,0,0,0,0|1,0,2]=4 982 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [0,1,0,0,0,0|1,0,2]=4 983 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [0,1,0,0,0,0|1,0,2]=4 984 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [0,1,0,0,0,0|1,0,2]=4 985 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [0,1,0,0,0,0|1,0,2]=4 986 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [0,1,0,0,0,0|1,0,2]=4 987 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [0,1,0,0,0,0|1,0,2]=4 988 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [0,1,0,0,0,0|1,0,2]=4 989 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [0,1,0,0,0,0|1,0,2]=4 990 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [0,1,0,0,0,0|1,0,2]=4 991 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [0,1,0,0,0,0|1,0,2]=4 992 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [0,1,0,0,0,0|1,0,2]=4 993 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [0,1,0,0,0,0|1,0,2]=4 994 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [0,1,0,0,0,0|1,0,2]=4 995 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [0,1,0,0,0,0|1,0,2]=4 996 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [0,1,0,0,0,0|1,0,2]=4 997 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [0,1,0,0,0,0|0,0,2]=3 998 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [0,1,0,0,0,0|1,0,2]=4 999 B6R0.3 CCN(C)C(=O)C MCULE-6881823095 [0,1,0,0,0,0|1,0,1]=3 1000 B6R0.3 CCN(C)C(=O)Cl MCULE-3697487267 [0,1,0,0,0,0|2,0,1]=4 1001 B6R0.3 CCN(N)C(=O)N MCULE-8674876262 [0,1,0,0,0,0|2,0,1]=4 1002 B6R0.3 CCN(O)C(=O)C MCULE-8547381969 [0,1,0,0,0,0|1,0,1]=3 1003 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [0,1,0,0,0,0|1,0,2]=4 1004 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [0,1,0,0,0,0|1,0,2]=4 1005 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [0,1,0,0,0,0|1,0,2]=4 1006 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [0,1,0,0,0,0|1,0,2]=4 1007 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [0,1,0,0,0,0|1,0,2]=4 1008 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [0,1,0,0,0,0|1,0,2]=4 1009 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [0,1,0,0,0,0|1,0,2]=4 1010 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [0,1,0,0,0,0|1,0,2]=4 1011 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [0,1,0,0,0,0|1,0,2]=4 1012 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [0,1,0,0,0,0|1,0,2]=4 1013 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [0,1,0,0,0,0|1,0,2]=4 1014 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [0,1,0,0,0,0|1,0,2]=4 1015 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [0,1,0,0,0,0|1,0,2]=4 1016 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [0,1,0,0,0,0|1,0,2]=4 1017 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [0,1,0,0,0,0|1,0,2]=4 1018 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [0,1,0,0,0,0|1,0,2]=4 1019 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [0,1,0,0,0,0|1,0,2]=4 1020 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [0,1,0,0,0,0|1,0,2]=4 1021 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [0,1,0,0,0,0|1,0,2]=4 1022 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [0,1,0,0,0,0|1,0,2]=4 1023 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [0,1,0,0,0,0|1,0,2]=4 1024 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [0,1,0,0,0,0|1,0,2]=4 1025 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [0,1,0,0,0,0|1,0,2]=4 1026 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [0,1,0,0,0,0|1,0,2]=4 1027 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [0,1,0,0,0,0|1,0,2]=4 1028 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [0,1,0,0,0,0|1,0,2]=4 1029 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [0,1,0,0,0,0|1,0,2]=4 1030 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [0,1,0,0,0,0|1,0,2]=4 1031 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [0,1,0,0,0,0|1,0,2]=4 1032 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [0,1,0,0,0,0|1,0,2]=4 1033 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [0,1,0,0,0,0|1,0,2]=4 1034 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [0,1,0,0,0,0|1,0,2]=4 1035 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [0,1,0,0,0,0|1,0,2]=4 1036 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [0,1,0,0,0,0|1,0,2]=4 1037 B6R0.3 CNC(=O)C(=O)O MCULE-5436132271 [0,1,0,0,0,0|2,0,0]=3 1038 B6R0.3 CNC(=O)C(C)Br MCULE-8111267694 [0,1,0,0,0,0|2,0,1]=4 1039 B6R0.3 CNC(=O)C(C)C MCULE-9646758802 [0,1,0,0,0,0|2,0,1]=4 1040 B6R0.3 CNC(=O)C(C)Cl MCULE-6524637023 [0,1,0,0,0,0|2,0,1]=4 1041 B6R0.3 CNC(=O)C(C)N MCULE-2283707986 [0,1,0,0,0,0|2,0,1]=4 1042 B6R0.3 CNC(=O)C(C)N MCULE-2976078375 [0,1,0,0,0,0|2,0,1]=4 1043 B6R0.3 CNC(=O)C(C)N MCULE-5544490576 [0,1,0,0,0,0|2,0,1]=4 1044 B6R0.3 CNC(=O)C(C)N MCULE-8815196909 [0,1,0,0,0,0|2,0,1]=4 1045 B6R0.3 CNC(=O)C(C)O MCULE-4714977257 [0,1,0,0,0,0|1,0,2]=4 1046 B6R0.3 CNC(=O)N(C)C MCULE-3799320827 [0,1,0,0,0,0|3,0,0]=4 1047 B6R0.3 CNC(=O)[C@@H](C)N MCULE-4498032248 [0,1,0,0,0,0|2,0,1]=4 1048 B6R0.3 CNC(=O)[C@@H](C)N MCULE-6909082129 [0,1,0,0,0,0|2,0,1]=4 1049 B6R0.3 CNC(=O)[C@@H](C)N MCULE-7642558844 [0,1,0,0,0,0|2,0,1]=4 1050 B6R0.3 CNC(=O)[C@@H](C)N MCULE-8543898121 [0,1,0,0,0,0|2,0,1]=4 1051 B6R0.3 CNC(=O)[C@@H](C)O MCULE-8955033466 [0,1,0,0,0,0|1,0,2]=4 1052 B6R0.3 CNC(=O)[C@H](C)N MCULE-5297375743 [0,1,0,0,0,0|2,0,1]=4 1053 B6R0.3 CNC(=O)[C@H](C)N MCULE-6807150828 [0,1,0,0,0,0|2,0,1]=4 1054 B6R0.3 CNC(=O)[C@H](C)N MCULE-8365508630 [0,1,0,0,0,0|2,0,1]=4 1055 B6R0.3 CNC(=O)[C@H](C)N MCULE-9773818316 [0,1,0,0,0,0|2,0,1]=4 1056 B6R0.3 CNC(=O)[C@H](C)O MCULE-8015727044 [0,1,0,0,0,0|1,0,2]=4 1057 B6R0.3 CNC(=S)N(C)C MCULE-5004489808 [0,1,0,0,0,0|3,0,0]=4 1058 B6R0.3 CNC(=S)N(C)N MCULE-5065441902 [0,1,0,0,0,0|3,0,0]=4 1059 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [0,1,0,0,0,0|2,0,1]=4 1060 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [0,1,0,0,0,0|2,0,1]=4 1061 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [0,1,0,0,0,0|2,0,1]=4 1062 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [0,1,0,0,0,0|2,0,1]=4 1063 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [0,1,0,0,0,0|2,0,1]=4 1064 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [0,1,0,0,0,0|2,0,1]=4 1065 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [0,1,0,0,0,0|2,0,1]=4 1066 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [0,1,0,0,0,0|2,0,1]=4 1067 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [0,1,0,0,0,0|2,0,1]=4 1068 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [0,1,0,0,0,0|2,0,1]=4 1069 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [0,1,0,0,0,0|2,0,1]=4 1070 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [0,1,0,0,0,0|2,0,1]=4 1071 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [0,1,0,0,0,0|2,0,1]=4 1072 B6R0.3 COC(=N)C(C)C MCULE-2061399513 [0,1,0,0,0,0|2,0,1]=4 1073 B6R0.3 COC(=N)C(C)C MCULE-9270611186 [0,1,0,0,0,0|2,0,1]=4 1074 B6R0.3 COC(=O)C(=N)N MCULE-3129647301 [0,1,0,0,0,0|3,0,0]=4 1075 B6R0.3 COC(=O)C(=N)N MCULE-4942451868 [0,1,0,0,0,0|3,0,0]=4 1076 B6R0.3 COC(=O)C(=O)C MCULE-5423483210 [0,1,0,0,0,0|1,0,0]=2 1077 B6R0.3 COC(=O)C(=O)Cl MCULE-1380456689 [0,1,0,0,0,0|2,0,0]=3 1078 B6R0.3 COC(=O)C(=O)O MCULE-8527842270 [0,1,0,0,0,0|2,0,0]=3 1079 B6R0.3 COC(=O)C(=O)[O-] MCULE-5187907456 [0,1,0,0,0,0|2,0,0]=3 1080 B6R0.3 COC(=O)C(=S)N MCULE-8900860523 [0,1,0,0,0,0|2,1,0]=4 1081 B6R0.3 COC(=O)C(C)Br MCULE-8218697195 [0,1,0,0,0,0|2,0,1]=4 1082 B6R0.3 COC(=O)C(C)C MCULE-8740211817 [0,1,0,0,0,0|2,0,1]=4 1083 B6R0.3 COC(=O)C(C)Cl MCULE-5874523100 [0,1,0,0,0,0|2,0,1]=4 1084 B6R0.3 COC(=O)C(C)Cl MCULE-7725109837 [0,1,0,0,0,0|2,0,1]=4 1085 B6R0.3 COC(=O)C(C)F MCULE-2381396302 [0,1,0,0,0,0|2,0,1]=4 1086 B6R0.3 COC(=O)C(C)N MCULE-6823731158 [0,1,0,0,0,0|2,0,1]=4 1087 B6R0.3 COC(=O)C(C)N MCULE-7003387212 [0,1,0,0,0,0|2,0,1]=4 1088 B6R0.3 COC(=O)C(C)N MCULE-8331503444 [0,1,0,0,0,0|2,0,1]=4 1089 B6R0.3 COC(=O)C(C)N MCULE-8860467123 [0,1,0,0,0,0|2,0,1]=4 1090 B6R0.3 COC(=O)C(C)O MCULE-7040827393 [0,1,0,0,0,0|1,0,2]=4 1091 B6R0.3 COC(=O)C(C)O MCULE-7872489483 [0,1,0,0,0,0|1,0,2]=4 1092 B6R0.3 COC(=O)C(C)S MCULE-8499044680 [0,1,0,0,0,0|1,1,1]=4 1093 B6R0.3 COC(=O)N(C)C MCULE-7772743169 [0,1,0,0,0,0|3,0,0]=4 1094 B6R0.3 COC(=O)N(C)N MCULE-4131925989 [0,1,0,0,0,0|3,0,0]=4 1095 B6R0.3 COC(=O)[C@@H](C)Br MCULE-8118895575 [0,1,0,0,0,0|2,0,1]=4 1096 B6R0.3 COC(=O)[C@@H](C)Cl MCULE-1037727130 [0,1,0,0,0,0|2,0,1]=4 1097 B6R0.3 COC(=O)[C@@H](C)F MCULE-4776326501 [0,1,0,0,0,0|2,0,1]=4 1098 B6R0.3 COC(=O)[C@@H](C)F MCULE-8049982812 [0,1,0,0,0,0|2,0,1]=4 1099 B6R0.3 COC(=O)[C@@H](C)N MCULE-6142127864 [0,1,0,0,0,0|2,0,1]=4 1100 B6R0.3 COC(=O)[C@@H](C)N MCULE-6606835410 [0,1,0,0,0,0|2,0,1]=4 1101 B6R0.3 COC(=O)[C@@H](C)N MCULE-7979979694 [0,1,0,0,0,0|2,0,1]=4 1102 B6R0.3 COC(=O)[C@@H](C)N MCULE-9290287586 [0,1,0,0,0,0|2,0,1]=4 1103 B6R0.3 COC(=O)[C@@H](C)O MCULE-5441095431 [0,1,0,0,0,0|1,0,2]=4 1104 B6R0.3 COC(=O)[C@@H](C)O MCULE-6924152779 [0,1,0,0,0,0|1,0,2]=4 1105 B6R0.3 COC(=O)[C@H](C)Cl MCULE-1009662992 [0,1,0,0,0,0|2,0,1]=4 1106 B6R0.3 COC(=O)[C@H](C)Cl MCULE-7624485295 [0,1,0,0,0,0|2,0,1]=4 1107 B6R0.3 COC(=O)[C@H](C)N MCULE-1665306037 [0,1,0,0,0,0|2,0,1]=4 1108 B6R0.3 COC(=O)[C@H](C)N MCULE-2941352505 [0,1,0,0,0,0|2,0,1]=4 1109 B6R0.3 COC(=O)[C@H](C)N MCULE-5314047552 [0,1,0,0,0,0|2,0,1]=4 1110 B6R0.3 COC(=O)[C@H](C)N MCULE-7930428859 [0,1,0,0,0,0|2,0,1]=4 1111 B6R0.3 COC(=O)[C@H](C)O MCULE-2590929895 [0,1,0,0,0,0|1,0,2]=4 1112 B6R0.3 COC(=O)[C@H](C)O MCULE-3292709954 [0,1,0,0,0,0|1,0,2]=4 1113 B6R0.3 COC(Br)C(=O)C MCULE-1220922171 [0,1,0,0,0,0|1,0,1]=3 1114 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [0,1,0,0,0,0|2,0,1]=4 1115 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [0,1,0,0,0,0|1,0,1]=3 1116 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [0,1,0,0,0,0|2,0,1]=4 1117 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [0,1,0,0,0,0|2,0,1]=4 1118 B6R0.3 CON(C)C(=O)C MCULE-8559238750 [0,1,0,0,0,0|2,0,0]=3 1119 B6R0.3 CON(C)C(=O)Cl MCULE-7217619495 [0,1,0,0,0,0|3,0,0]=4 1120 B6R0.3 CO[C@@H](C)C(=O)Cl MCULE-9335923061 [0,1,0,0,0,0|2,0,1]=4 1121 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [0,1,0,0,0,0|2,0,1]=4 1122 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [0,1,0,0,0,0|2,0,1]=4 1123 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [0,1,0,0,0,0|2,0,1]=4 1124 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [0,1,0,0,0,0|2,0,1]=4 1125 B6R0.3 CSC(=O)C(C)C MCULE-3533547228 [0,1,0,0,0,0|2,0,1]=4 1126 B6R0.3 CSC(=S)N(C)C MCULE-5137103210 [0,1,0,0,0,0|3,0,0]=4 1127 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [0,1,0,0,0,0|1,0,1]=3 1128 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [0,1,0,0,0,0|2,0,1]=4 1129 B6R0.3 NC(=O)/C(=N/O)/N MCULE-6909019905 [0,1,0,0,0,0|3,0,0]=4 1130 B6R0.3 NNC(=O)C(=O)N MCULE-5080628360 [0,1,0,0,0,0|3,0,0]=4 1131 B6R0.3 O=C(Cl)/C(=C/Cl)/Cl MCULE-1765210878 [0,1,0,0,0,0|2,0,0]=3 1132 B6R0.3 O=C(Cl)C(=O)CBr MCULE-1637788630 [0,1,0,0,0,0|2,0,1]=4 1133 B6R0.3 O=C(O)/C(=C/Cl)/Cl MCULE-4317518344 [0,1,0,0,0,0|2,0,0]=3 1134 B6R0.3 O=C(O)C(=CCl)Cl MCULE-2693859334 [0,1,0,0,0,0|2,0,0]=3 1135 B6R0.3 O=C(O)C(=O)CBr MCULE-4768170572 [0,1,0,0,0,0|2,0,1]=4 1136 B6R0.3 O=C(O)C(=O)CCl MCULE-7853426045 [0,1,0,0,0,0|2,0,1]=4 1137 B6R0.3 O=C(O)C(=O)CF MCULE-5884987827 [0,1,0,0,0,0|2,0,1]=4 1138 B6R0.3 O=C(O)C(=O)CO MCULE-2263002631 [0,1,0,0,0,0|2,0,1]=4 1139 B6R0.3 O=C(O)C(=O)CS MCULE-7466669113 [0,1,0,0,0,0|2,0,1]=4 1140 B6R0.3 O=C([O-])C(=O)CF MCULE-9109967389 [0,1,0,0,0,0|2,0,1]=4 1141 B6R0.3 O=C([O-])C(=O)CS MCULE-4375165973 [0,1,0,0,0,0|2,0,1]=4 1142 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [0,1,0,0,0,0|1,0,2]=4 1143 B6R0.3 [C@H](C)(Cl)C(=O)OC MCULE-7212330759 [0,1,0,0,0,0|2,0,1]=4 1144 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [0,1,0,0,0,0|2,0,1]=4 1145 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [0,1,0,0,0,0|1,0,2]=4 1146 B6R0.4 C#CC=CC(C)C MCULE-6714802798 [0,1,0,0,0,0|1,0,2]=4 1147 B6R0.4 C#CCCC(=O)C MCULE-8723638688 [0,1,0,0,0,0|0,0,3]=4 1148 B6R0.4 C#CCNC(=O)C MCULE-1159984782 [0,1,0,0,0,0|0,0,3]=4 1149 B6R0.4 C#CCOC(=O)C MCULE-5002994323 [0,1,0,0,0,0|0,0,3]=4 1150 B6R0.4 C/C=C/CC(=O)Cl MCULE-5377125313 [0,1,0,0,0,0|1,0,0]=2 1151 B6R0.4 C/C=C/CC(=O)N MCULE-1942934157 [0,1,0,0,0,0|1,0,0]=2 1152 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [0,1,0,0,0,0|1,0,0]=2 1153 B6R0.4 C/C=N/NC(=O)N MCULE-5855402964 [0,1,0,0,0,0|2,0,0]=3 1154 B6R0.4 C=C(C)CCCBr MCULE-5063918467 [0,1,0,0,0,0|1,0,2]=4 1155 B6R0.4 C=C(C)CCCC MCULE-1010177756 [0,1,0,0,0,0|1,0,2]=4 1156 B6R0.4 C=C(C)CCCO MCULE-4629274490 [0,1,0,0,0,0|1,0,2]=4 1157 B6R0.4 C=C(C)CNCC MCULE-2237759977 [0,1,0,0,0,0|1,0,2]=4 1158 B6R0.4 C=C/C=C/C(=O)O MCULE-7975593411 [0,1,0,0,0,0|1,0,1]=3 1159 B6R0.4 C=C=CCC(=O)O MCULE-2611659307 [0,1,0,0,0,0|1,0,2]=4 1160 B6R0.4 C=CC=CC(=O)Cl MCULE-6383997047 [0,1,0,0,0,0|1,0,1]=3 1161 B6R0.4 C=CC=CC(=O)O MCULE-5189540617 [0,1,0,0,0,0|1,0,1]=3 1162 B6R0.4 C=CCCC(=C)C MCULE-2323382963 [0,1,0,0,0,0|1,0,2]=4 1163 B6R0.4 C=CCCC(=O)C MCULE-9598399930 [0,1,0,0,0,0|0,0,2]=3 1164 B6R0.4 C=CCCC(=O)Cl MCULE-7378353157 [0,1,0,0,0,0|1,0,2]=4 1165 B6R0.4 C=CCCC(=O)N MCULE-7202462484 [0,1,0,0,0,0|1,0,2]=4 1166 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [0,1,0,0,0,0|1,0,2]=4 1167 B6R0.4 C=CCNC(=O)C MCULE-7903624915 [0,1,0,0,0,0|0,0,2]=3 1168 B6R0.4 C=CCNC(=O)N MCULE-1210131291 [0,1,0,0,0,0|1,0,2]=4 1169 B6R0.4 C=CCOC(=O)C MCULE-9991130828 [0,1,0,0,0,0|0,0,2]=3 1170 B6R0.4 C=CCOC(=O)Cl MCULE-3513251417 [0,1,0,0,0,0|1,0,2]=4 1171 B6R0.4 C=CCOC(=O)N MCULE-4119124558 [0,1,0,0,0,0|1,0,2]=4 1172 B6R0.4 C=CNCC(=O)O MCULE-5142273921 [0,1,0,0,0,0|1,0,2]=4 1173 B6R0.4 C=CON=C(C)C MCULE-5340817509 [0,1,0,0,0,0|2,0,1]=4 1174 B6R0.4 CC#CCC(=O)O MCULE-8576178825 [0,1,0,0,0,0|1,0,2]=4 1175 B6R0.4 CC(=CCC#N)C MCULE-1406666578 [0,1,0,0,0,0|1,0,2]=4 1176 B6R0.4 CC(=CCCBr)C MCULE-9403575147 [0,1,0,0,0,0|1,0,1]=3 1177 B6R0.4 CC(=CCCN)C MCULE-9185531904 [0,1,0,0,0,0|1,0,1]=3 1178 B6R0.4 CC(=CCCO)C MCULE-2493404466 [0,1,0,0,0,0|1,0,1]=3 1179 B6R0.4 CC(=CCCO)C MCULE-8497528596 [0,1,0,0,0,0|1,0,1]=3 1180 B6R0.4 CC(=NNC=O)C MCULE-6194074981 [0,1,0,0,0,0|3,0,0]=4 1181 B6R0.4 CC(=O)CCC#N MCULE-6810756363 [0,1,0,0,0,0|0,0,3]=4 1182 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [0,1,0,0,0,0|1,0,1]=3 1183 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [0,1,0,0,0,0|0,0,2]=3 1184 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [0,1,0,0,0,0|0,0,2]=3 1185 B6R0.4 CC(=O)CCCO MCULE-1335342150 [0,1,0,0,0,0|0,0,2]=3 1186 B6R0.4 CC(=O)CSC#N MCULE-5774397655 [0,1,0,0,0,0|1,0,2]=4 1187 B6R0.4 CC(=O)NCC#N MCULE-2345227602 [0,1,0,0,0,0|1,0,2]=4 1188 B6R0.4 CC(=O)NCCCl MCULE-7865062188 [0,1,0,0,0,0|1,0,1]=3 1189 B6R0.4 CC(=O)NCCN MCULE-2230084818 [0,1,0,0,0,0|1,0,1]=3 1190 B6R0.4 CC(=O)NCCO MCULE-5968518415 [0,1,0,0,0,0|1,0,1]=3 1191 B6R0.4 CC(=O)NCCS MCULE-3345813615 [0,1,0,0,0,0|1,0,1]=3 1192 B6R0.4 CC(=O)OCC#N MCULE-4866082576 [0,1,0,0,0,0|1,0,2]=4 1193 B6R0.4 CC(=O)OCCBr MCULE-3760449773 [0,1,0,0,0,0|1,0,1]=3 1194 B6R0.4 CC(=O)OCCCl MCULE-4570139017 [0,1,0,0,0,0|1,0,1]=3 1195 B6R0.4 CC(=O)OCCN MCULE-4530529900 [0,1,0,0,0,0|1,0,1]=3 1196 B6R0.4 CC(=O)OCCN MCULE-6854340494 [0,1,0,0,0,0|1,0,1]=3 1197 B6R0.4 CC(=O)OCCO MCULE-1251660436 [0,1,0,0,0,0|1,0,1]=3 1198 B6R0.4 CC(=O)SCC#N MCULE-5864559051 [0,1,0,0,0,0|1,0,2]=4 1199 B6R0.4 CC(=O)SCCBr MCULE-1786480878 [0,1,0,0,0,0|1,0,1]=3 1200 B6R0.4 CC(=O)SCCN MCULE-3819903256 [0,1,0,0,0,0|1,0,1]=3 1201 B6R0.4 CC(=O)SCCN MCULE-4872130470 [0,1,0,0,0,0|1,0,1]=3 1202 B6R0.4 CC(=O)SCCN MCULE-7084821345 [0,1,0,0,0,0|1,0,1]=3 1203 B6R0.4 CC(C)C=CC=O MCULE-5034551905 [0,1,0,0,0,0|1,0,2]=4 1204 B6R0.4 CC(C)C=CCBr MCULE-9812152361 [0,1,0,0,0,0|1,0,1]=3 1205 B6R0.4 CC/C=C/C(=N)N MCULE-7871697378 [0,1,0,0,0,0|2,0,0]=3 1206 B6R0.4 CC/C=C/C(=N)N MCULE-9276291098 [0,1,0,0,0,0|2,0,0]=3 1207 B6R0.4 CC/C=C/C(=O)Cl MCULE-8929214872 [0,1,0,0,0,0|1,0,0]=2 1208 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [0,1,0,0,0,0|1,0,0]=2 1209 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [0,1,0,0,0,0|1,0,0]=2 1210 B6R0.4 CC=CCC(C)C MCULE-7145682250 [0,1,0,0,0,0|1,0,1]=3 1211 B6R0.4 CC=NNC(=O)N MCULE-3878774235 [0,1,0,0,0,0|2,0,0]=3 1212 B6R0.4 CC=NNC(=S)N MCULE-3128372277 [0,1,0,0,0,0|2,1,0]=4 1213 B6R0.4 CCC#CC(=O)C MCULE-7788224704 [0,1,0,0,0,0|0,0,2]=3 1214 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [0,1,0,0,0,0|1,0,2]=4 1215 B6R0.4 CCC=CB(O)O MCULE-6166989227 [0,1,0,0,0,0|2,0,1]=4 1216 B6R0.4 CCC=CC(=O)C MCULE-2986269826 [0,1,0,0,0,0|0,0,0]=1 1217 B6R0.4 CCC=CC(=O)Cl MCULE-5159865849 [0,1,0,0,0,0|1,0,0]=2 1218 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [0,1,0,0,0,0|1,0,0]=2 1219 B6R0.4 CCCC=C(C)C MCULE-2110588796 [0,1,0,0,0,0|1,0,1]=3 1220 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [0,1,0,0,0,0|1,0,2]=4 1221 B6R0.4 CCCCC(=O)C MCULE-3554390184 [0,1,0,0,0,0|0,0,2]=3 1222 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [0,1,0,0,0,0|1,0,2]=4 1223 B6R0.4 CCCCC(=O)N MCULE-6419483436 [0,1,0,0,0,0|1,0,2]=4 1224 B6R0.4 CCCCC(=O)O MCULE-2333640078 [0,1,0,0,0,0|1,0,2]=4 1225 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [0,1,0,0,0,0|1,0,2]=4 1226 B6R0.4 CCCNC(=O)C MCULE-5899703886 [0,1,0,0,0,0|0,0,2]=3 1227 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [0,1,0,0,0,0|1,0,2]=4 1228 B6R0.4 CCCNC(=O)N MCULE-8528844765 [0,1,0,0,0,0|1,0,2]=4 1229 B6R0.4 CCCOC(=O)C MCULE-7327042566 [0,1,0,0,0,0|0,0,2]=3 1230 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [0,1,0,0,0,0|1,0,2]=4 1231 B6R0.4 CCCOC(=O)N MCULE-2760622567 [0,1,0,0,0,0|1,0,2]=4 1232 B6R0.4 CCCSC(=O)C MCULE-4329646671 [0,1,0,0,0,0|0,0,2]=3 1233 B6R0.4 CCCSC(=O)Cl MCULE-5971141999 [0,1,0,0,0,0|1,0,2]=4 1234 B6R0.4 CCN=CC(C)C MCULE-7306741362 [0,1,0,0,0,0|1,0,2]=4 1235 B6R0.4 CCNCC(=O)C MCULE-5799315547 [0,1,0,0,0,0|0,0,2]=3 1236 B6R0.4 CCNCC(=O)C MCULE-9258294157 [0,1,0,0,0,0|0,0,2]=3 1237 B6R0.4 CCNCC(=O)N MCULE-1787248899 [0,1,0,0,0,0|1,0,2]=4 1238 B6R0.4 CCNCC(=O)N MCULE-3821700273 [0,1,0,0,0,0|1,0,2]=4 1239 B6R0.4 CCNCC(=O)O MCULE-5989480216 [0,1,0,0,0,0|1,0,2]=4 1240 B6R0.4 CCNCC(=O)O MCULE-8087863397 [0,1,0,0,0,0|1,0,2]=4 1241 B6R0.4 CCOCC(=O)C MCULE-2825677443 [0,1,0,0,0,0|0,0,2]=3 1242 B6R0.4 CCOCC(=O)Cl MCULE-2172268229 [0,1,0,0,0,0|1,0,2]=4 1243 B6R0.4 CCOCC(=O)O MCULE-1726530898 [0,1,0,0,0,0|1,0,2]=4 1244 B6R0.4 CCSCC(=O)C MCULE-9872082780 [0,1,0,0,0,0|0,0,2]=3 1245 B6R0.4 CCSCC(=O)O MCULE-7471335718 [0,1,0,0,0,0|1,0,2]=4 1246 B6R0.4 CN(C)/C=C/C#N MCULE-6362841128 [0,1,0,0,0,0|2,0,1]=4 1247 B6R0.4 CN(C)/C=C/C=O MCULE-2048385164 [0,1,0,0,0,0|2,0,1]=4 1248 B6R0.4 CN(C)C=CC#N MCULE-7232815292 [0,1,0,0,0,0|2,0,1]=4 1249 B6R0.4 CN(C)C=CC=O MCULE-3308636651 [0,1,0,0,0,0|2,0,1]=4 1250 B6R0.4 CNCCC(=O)N MCULE-1118876220 [0,1,0,0,0,0|1,0,2]=4 1251 B6R0.4 CNCCC(=O)N MCULE-6679713144 [0,1,0,0,0,0|1,0,2]=4 1252 B6R0.4 CNCCC(=O)O MCULE-3627988097 [0,1,0,0,0,0|1,0,2]=4 1253 B6R0.4 CNCCC(=O)O MCULE-9858204248 [0,1,0,0,0,0|1,0,2]=4 1254 B6R0.4 CO/C=C/C(=O)C MCULE-1215649803 [0,1,0,0,0,0|0,0,0]=1 1255 B6R0.4 CO/C=C/C(=O)O MCULE-3681049176 [0,1,0,0,0,0|1,0,0]=2 1256 B6R0.4 COC=CC(=O)C MCULE-4868833764 [0,1,0,0,0,0|0,0,0]=1 1257 B6R0.4 COC=CC(=O)Cl MCULE-4966577139 [0,1,0,0,0,0|1,0,0]=2 1258 B6R0.4 COC=CC(=O)O MCULE-4252899122 [0,1,0,0,0,0|1,0,0]=2 1259 B6R0.4 COCCC(=O)C MCULE-5939812376 [0,1,0,0,0,0|0,0,2]=3 1260 B6R0.4 COCCC(=O)Cl MCULE-9454266286 [0,1,0,0,0,0|1,0,2]=4 1261 B6R0.4 COCCC(=O)N MCULE-7556483675 [0,1,0,0,0,0|1,0,2]=4 1262 B6R0.4 COCCC(=O)O MCULE-3436347115 [0,1,0,0,0,0|1,0,2]=4 1263 B6R0.4 COCNC(=O)N MCULE-8367032240 [0,1,0,0,0,0|2,0,1]=4 1264 B6R0.4 COCOC(=O)C MCULE-8876091916 [0,1,0,0,0,0|1,0,1]=3 1265 B6R0.4 CON=CC(=O)O MCULE-6800819509 [0,1,0,0,0,0|2,0,0]=3 1266 B6R0.4 CON=CC(C)C MCULE-1606683545 [0,1,0,0,0,0|2,0,1]=4 1267 B6R0.4 CS(=O)CCCN MCULE-1124989526 [0,1,0,0,0,0|1,0,2]=4 1268 B6R0.4 CS(=O)CCCN MCULE-8758903495 [0,1,0,0,0,0|1,0,2]=4 1269 B6R0.4 CSCCC(=O)C MCULE-6178663156 [0,1,0,0,0,0|0,0,2]=3 1270 B6R0.4 CSCCC(=O)Cl MCULE-9732512141 [0,1,0,0,0,0|1,0,2]=4 1271 B6R0.4 CSCCC(=O)N MCULE-7105035733 [0,1,0,0,0,0|1,0,2]=4 1272 B6R0.4 CSCCC(=O)O MCULE-9550032941 [0,1,0,0,0,0|1,0,2]=4 1273 B6R0.4 CSCOC(=O)C MCULE-1498769347 [0,1,0,0,0,0|1,0,1]=3 1274 B6R0.4 CSSCC(=O)O MCULE-5829510166 [0,1,0,0,0,0|2,0,1]=4 1275 B6R0.4 FC(=CCCBr)F MCULE-2616028843 [0,1,0,0,0,0|2,0,1]=4 1276 B6R0.4 FC(=CCCCl)F MCULE-2193644602 [0,1,0,0,0,0|2,0,1]=4 1277 B6R0.4 N#CC=CC(=O)O MCULE-9790502930 [0,1,0,0,0,0|1,0,1]=3 1278 B6R0.4 N/N=C/NC(=O)N MCULE-6272806279 [0,1,0,0,0,0|3,0,0]=4 1279 B6R0.4 N/N=C/NC(=O)N MCULE-7518775080 [0,1,0,0,0,0|3,0,0]=4 1280 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [0,1,0,0,0,0|1,0,2]=4 1281 B6R0.4 NC(=O)CCCO MCULE-3779341561 [0,1,0,0,0,0|1,0,2]=4 1282 B6R0.4 NC(=O)NCCCl MCULE-6117142945 [0,1,0,0,0,0|2,0,1]=4 1283 B6R0.4 NC(=O)NCCF MCULE-9526714989 [0,1,0,0,0,0|2,0,1]=4 1284 B6R0.4 NC(=O)NCCO MCULE-2353513655 [0,1,0,0,0,0|2,0,1]=4 1285 B6R0.4 NC(=O)OCCCl MCULE-4259077420 [0,1,0,0,0,0|2,0,1]=4 1286 B6R0.4 NC(=O)OCCO MCULE-7565460845 [0,1,0,0,0,0|2,0,1]=4 1287 B6R0.4 NC/C=C/C(=O)O MCULE-1249244912 [0,1,0,0,0,0|1,0,0]=2 1288 B6R0.4 NCC#CC(=O)O MCULE-8511125702 [0,1,0,0,0,0|1,0,2]=4 1289 B6R0.4 NCC=CC(=O)O MCULE-3049811576 [0,1,0,0,0,0|1,0,0]=2 1290 B6R0.4 NCC=CC(=O)O MCULE-5171717036 [0,1,0,0,0,0|1,0,0]=2 1291 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [0,1,0,0,0,0|1,0,2]=4 1292 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [0,1,0,0,0,0|1,0,2]=4 1293 B6R0.4 NCCCC(=O)N MCULE-8039142092 [0,1,0,0,0,0|1,0,2]=4 1294 B6R0.4 NCCCC(=O)N MCULE-8262250872 [0,1,0,0,0,0|1,0,2]=4 1295 B6R0.4 NCCCC(=O)O MCULE-3615304273 [0,1,0,0,0,0|1,0,2]=4 1296 B6R0.4 NCCCC(=O)O MCULE-7613134021 [0,1,0,0,0,0|1,0,2]=4 1297 B6R0.4 NCCNC(=O)N MCULE-1197396950 [0,1,0,0,0,0|2,0,1]=4 1298 B6R0.4 NCCNC(=O)N MCULE-2171700183 [0,1,0,0,0,0|2,0,1]=4 1299 B6R0.4 NCCNC(=O)N MCULE-3799764813 [0,1,0,0,0,0|2,0,1]=4 1300 B6R0.4 NCCOC(=O)N MCULE-4144808257 [0,1,0,0,0,0|2,0,1]=4 1301 B6R0.4 NCCOC(=O)N MCULE-5815053840 [0,1,0,0,0,0|2,0,1]=4 1302 B6R0.4 O=C(Cl)CCCBr MCULE-1389049838 [0,1,0,0,0,0|1,0,2]=4 1303 B6R0.4 O=C(Cl)CCCCl MCULE-5885932072 [0,1,0,0,0,0|1,0,2]=4 1304 B6R0.4 O=C(Cl)OCCBr MCULE-6758010852 [0,1,0,0,0,0|2,0,1]=4 1305 B6R0.4 O=C(Cl)OCCCl MCULE-1505786385 [0,1,0,0,0,0|2,0,1]=4 1306 B6R0.4 O=C(Cl)OCCF MCULE-5233366139 [0,1,0,0,0,0|2,0,1]=4 1307 B6R0.4 O=C(O)/C=C/CBr MCULE-2012997584 [0,1,0,0,0,0|1,0,0]=2 1308 B6R0.4 O=C(O)/C=C/CCl MCULE-5651159998 [0,1,0,0,0,0|1,0,0]=2 1309 B6R0.4 O=C(O)/C=C/CO MCULE-1612823053 [0,1,0,0,0,0|1,0,0]=2 1310 B6R0.4 O=C(O)C#CCCl MCULE-6341675394 [0,1,0,0,0,0|1,0,2]=4 1311 B6R0.4 O=C(O)C#CCF MCULE-8744045229 [0,1,0,0,0,0|1,0,2]=4 1312 B6R0.4 O=C(O)C#CCO MCULE-1849362182 [0,1,0,0,0,0|1,0,2]=4 1313 B6R0.4 O=C(O)C=CCBr MCULE-3029375430 [0,1,0,0,0,0|1,0,0]=2 1314 B6R0.4 O=C(O)C=CCCl MCULE-1050913038 [0,1,0,0,0,0|1,0,0]=2 1315 B6R0.4 O=C(O)C=CCO MCULE-3375515425 [0,1,0,0,0,0|1,0,0]=2 1316 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [0,1,0,0,0,0|1,0,2]=4 1317 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [0,1,0,0,0,0|1,0,2]=4 1318 B6R0.4 O=C(O)CCCF MCULE-2415675768 [0,1,0,0,0,0|1,0,2]=4 1319 B6R0.4 O=C(O)CCCI MCULE-7794841553 [0,1,0,0,0,0|1,0,2]=4 1320 B6R0.4 O=C(O)CCCS MCULE-3352840152 [0,1,0,0,0,0|1,0,2]=4 1321 B6R0.4 O=C(O)CNCO MCULE-4092998319 [0,1,0,0,0,0|2,0,1]=4 1322 B6R0.4 O=C([O-])CCCCl MCULE-4131322715 [0,1,0,0,0,0|1,0,2]=4 1323 B6R0.4 O=C([O-])CNCO MCULE-2804068565 [0,1,0,0,0,0|2,0,1]=4 1324 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [0,1,0,0,0,0|2,0,1]=4 1325 B6R0.4 O=CNCC(=O)O MCULE-3251128290 [0,1,0,0,0,0|2,0,1]=4 1326 B6R0.4 OB(O)/C=C/CCl MCULE-9221515028 [0,1,0,0,0,0|2,0,1]=4 1327 B6R0.4 OB(O)C=CCCl MCULE-3662189757 [0,1,0,0,0,0|2,0,1]=4 1328 B6R0.5 C/C=C/C(F)(F)F MCULE-2905049653 [0,1,0,0,0,0|2,0,1]=4 1329 B6R0.5 C/C=C/[B-](F)(F)F MCULE-3335611121 [0,1,0,0,0,0|3,0,0]=4 1330 B6R0.5 C/C=C/[B-](F)(F)F MCULE-4141205615 [0,1,0,0,0,0|3,0,0]=4 1331 B6R0.5 C/C=C\P(=O)(O)O MCULE-8382984782 [0,1,0,0,0,0|2,0,0]=3 1332 B6R0.5 C/C=C\[B-](F)(F)F MCULE-6788579856 [0,1,0,0,0,0|3,0,0]=4 1333 B6R0.5 C/C=C\[B-](F)(F)F MCULE-7047692338 [0,1,0,0,0,0|3,0,0]=4 1334 B6R0.5 C/C=N/C(C)(C)C MCULE-5626139763 [0,1,0,0,0,0|2,0,1]=4 1335 B6R0.5 C=CCS(=O)(=O)C MCULE-8490929862 [0,1,0,0,0,0|1,0,2]=4 1336 B6R0.5 CC=CC(F)(F)F MCULE-9621139720 [0,1,0,0,0,0|2,0,1]=4 1337 B6R0.5 CC=CP(=O)(O)O MCULE-3593796042 [0,1,0,0,0,0|2,0,0]=3 1338 B6R0.5 CC=CS(=O)(=O)Cl MCULE-2808966547 [0,1,0,0,0,0|2,0,0]=3 1339 B6R0.5 CC=C[B-](F)(F)F MCULE-1518170629 [0,1,0,0,0,0|3,0,0]=4 1340 B6R0.5 CC=C[B-](F)(F)F MCULE-4523990415 [0,1,0,0,0,0|3,0,0]=4 1341 B6R0.5 CC=NC(C)(C)C MCULE-2642166720 [0,1,0,0,0,0|2,0,1]=4 1342 B6R0.5 CCNS(=O)(=O)C MCULE-7880259383 [0,1,0,0,0,0|2,0,1]=4 1343 B6R0.5 CCOP(=O)(C)S MCULE-4864782374 [0,1,0,0,0,0|2,0,1]=4 1344 B6R0.5 CCOS(=O)(=O)C MCULE-7269389229 [0,1,0,0,0,0|2,0,1]=4 1345 B6R0.5 C[Si](C)(C)/C=C/Br MCULE-9830897857 [0,1,0,0,0,0|2,1,0]=4 1346 B6R0.5 C[Si](C)(C)/C=C/I MCULE-3087366011 [0,1,0,0,0,0|2,1,0]=4 1347 B6R0.5 C[Si](C)(C)C=CBr MCULE-7908301119 [0,1,0,0,0,0|2,1,0]=4 1348 B6R0.5 C[Si](C)(C)C=CI MCULE-2274079570 [0,1,0,0,0,0|2,1,0]=4 1349 B6R1.2 BrC1=CC=CN1 MCULE-5264580992 [0,0,0,1,0,0|2,0,1]=4 1350 B6R1.2 BrC1=CC=CO1 MCULE-5734064318 [0,0,0,1,0,0|1,0,2]=4 1351 B6R1.2 BrC1=CC=CS1 MCULE-1364150691 [0,0,0,1,0,0|1,1,1]=4 1352 B6R1.2 BrC1=CC=C[Se]1 MCULE-9011330064 [0,0,0,1,0,0|1,1,1]=4 1353 B6R1.2 BrC1=CC=NN1 MCULE-9341716246 [0,0,0,1,0,0|3,0,0]=4 1354 B6R1.2 BrC1=CC=NO1 MCULE-9219362534 [0,0,0,1,0,0|2,0,1]=4 1355 B6R1.2 BrC1=CC=NS1 MCULE-2346915540 [0,0,0,1,0,0|2,1,0]=4 1356 B6R1.2 BrC1=CCCC1 MCULE-1008379150 [0,0,0,1,0,0|1,0,1]=3 1357 B6R1.2 BrC1=CNC=C1 MCULE-2704154564 [0,0,0,1,0,0|2,0,1]=4 1358 B6R1.2 BrC1=COC=C1 MCULE-7282301463 [0,0,0,1,0,0|2,0,1]=4 1359 B6R1.2 BrC1=COCC1 MCULE-8057569313 [0,0,0,1,0,0|2,0,0]=3 1360 B6R1.2 BrC1=CSC=C1 MCULE-6680927224 [0,0,0,1,0,0|2,0,1]=4 1361 B6R1.2 BrC1=NOC=C1 MCULE-1786338778 [0,0,0,1,0,0|3,0,0]=4 1362 B6R1.2 BrC1=NSC=C1 MCULE-5948625316 [0,0,0,1,0,0|3,0,0]=4 1363 B6R1.2 C=C1CCCC1 MCULE-4115373196 [0,0,0,1,0,0|1,0,2]=4 1364 B6R1.2 C=C1CCNC1 MCULE-7982953073 [0,0,0,1,0,0|2,0,1]=4 1365 B6R1.2 C=C1CCNC1 MCULE-8428731599 [0,0,0,1,0,0|2,0,1]=4 1366 B6R1.2 C=C1CCSC1 MCULE-7042571473 [0,0,0,1,0,0|2,0,1]=4 1367 B6R1.2 CC1=CC=CC1 MCULE-3765599626 [0,0,0,1,0,0|1,0,1]=3 1368 B6R1.2 CC1=CC=CN1 MCULE-7608248575 [0,0,0,1,0,0|1,0,1]=3 1369 B6R1.2 CC1=CC=CO1 MCULE-3620289319 [0,0,0,1,0,0|0,0,2]=3 1370 B6R1.2 CC1=CC=CS1 MCULE-7297776024 [0,0,0,1,0,0|0,1,1]=3 1371 B6R1.2 CC1=CC=NN1 MCULE-1457877312 [0,0,0,1,0,0|2,0,0]=3 1372 B6R1.2 CC1=CC=NN1 MCULE-3441401586 [0,0,0,1,0,0|2,0,0]=3 1373 B6R1.2 CC1=CC=NO1 MCULE-3188314923 [0,0,0,1,0,0|1,0,1]=3 1374 B6R1.2 CC1=CC=NS1 MCULE-4163670775 [0,0,0,1,0,0|1,1,0]=3 1375 B6R1.2 CC1=CCCC1 MCULE-8508688474 [0,0,0,1,0,0|1,0,1]=3 1376 B6R1.2 CC1=CCCO1 MCULE-7276659214 [0,0,0,1,0,0|0,0,2]=3 1377 B6R1.2 CC1=CCNC1 MCULE-5892113847 [0,0,0,1,0,0|2,0,1]=4 1378 B6R1.2 CC1=CCNC1 MCULE-9225220351 [0,0,0,1,0,0|2,0,1]=4 1379 B6R1.2 CC1=CN=CO1 MCULE-4609626879 [0,0,0,1,0,0|1,0,2]=4 1380 B6R1.2 CC1=CN=CS1 MCULE-8510377651 [0,0,0,1,0,0|1,1,1]=4 1381 B6R1.2 CC1=CN=NS1 MCULE-3290022680 [0,0,0,1,0,0|2,1,0]=4 1382 B6R1.2 CC1=CNC=C1 MCULE-9114555776 [0,0,0,1,0,0|2,0,0]=3 1383 B6R1.2 CC1=CNC=N1 MCULE-9375719449 [0,0,0,1,0,0|2,0,1]=4 1384 B6R1.2 CC1=CNN=C1 MCULE-2732751720 [0,0,0,1,0,0|3,0,0]=4 1385 B6R1.2 CC1=CNN=C1 MCULE-3538959589 [0,0,0,1,0,0|3,0,0]=4 1386 B6R1.2 CC1=CNN=N1 MCULE-2819973344 [0,0,0,1,0,0|3,0,0]=4 1387 B6R1.2 CC1=COC=C1 MCULE-1597223627 [0,0,0,1,0,0|2,0,0]=3 1388 B6R1.2 CC1=COC=N1 MCULE-3497089982 [0,0,0,1,0,0|2,0,1]=4 1389 B6R1.2 CC1=CON=C1 MCULE-4312100714 [0,0,0,1,0,0|3,0,0]=4 1390 B6R1.2 CC1=CSC=C1 MCULE-1408158529 [0,0,0,1,0,0|2,0,0]=3 1391 B6R1.2 CC1=CSC=N1 MCULE-3711308900 [0,0,0,1,0,0|2,0,1]=4 1392 B6R1.2 CC1=CSN=C1 MCULE-2603580928 [0,0,0,1,0,0|3,0,0]=4 1393 B6R1.2 CC1=CSN=N1 MCULE-9634894252 [0,0,0,1,0,0|3,0,0]=4 1394 B6R1.2 CC1=NC=CN1 MCULE-4484196639 [0,0,0,1,0,0|2,0,1]=4 1395 B6R1.2 CC1=NC=CO1 MCULE-7894525701 [0,0,0,1,0,0|1,0,2]=4 1396 B6R1.2 CC1=NC=CS1 MCULE-6863408892 [0,0,0,1,0,0|1,1,1]=4 1397 B6R1.2 CC1=NCCC1 MCULE-5009170423 [0,0,0,1,0,0|1,0,2]=4 1398 B6R1.2 CC1=NCCN1 MCULE-4787238872 [0,0,0,1,0,0|2,0,1]=4 1399 B6R1.2 CC1=NCCO1 MCULE-8564633040 [0,0,0,1,0,0|1,0,2]=4 1400 B6R1.2 CC1=NCCS1 MCULE-1701303405 [0,0,0,1,0,0|1,1,1]=4 1401 B6R1.2 CC1=NN=CN1 MCULE-4297826922 [0,0,0,1,0,0|3,0,0]=4 1402 B6R1.2 CC1=NN=CO1 MCULE-5138394000 [0,0,0,1,0,0|3,0,0]=4 1403 B6R1.2 CC1=NN=CS1 MCULE-5068390093 [0,0,0,1,0,0|3,0,0]=4 1404 B6R1.2 CC1=NNCC1 MCULE-1758510182 [0,0,0,1,0,0|3,0,0]=4 1405 B6R1.2 CC1=NOC=C1 MCULE-1572732397 [0,0,0,1,0,0|2,0,0]=3 1406 B6R1.2 CC1=NOC=N1 MCULE-5841548711 [0,0,0,1,0,0|3,0,0]=4 1407 B6R1.2 CC1=NON=C1 MCULE-7563934145 [0,0,0,1,0,0|3,0,0]=4 1408 B6R1.2 CC1=NSC=C1 MCULE-6941128185 [0,0,0,1,0,0|2,0,0]=3 1409 B6R1.2 CC1=NSN=C1 MCULE-8318780980 [0,0,0,1,0,0|3,0,0]=4 1410 B6R1.2 CC1C=CCC1 MCULE-1638534048 [0,0,0,1,0,0|1,0,1]=3 1411 B6R1.2 CN1C=CC=C1 MCULE-4929965979 [0,0,0,1,0,0|2,0,1]=4 1412 B6R1.2 CN1C=CC=N1 MCULE-9409141633 [0,0,0,1,0,0|2,0,1]=4 1413 B6R1.2 CN1C=CN=C1 MCULE-1468573178 [0,0,0,1,0,0|3,0,0]=4 1414 B6R1.2 CN1C=CN=C1 MCULE-1857627459 [0,0,0,1,0,0|3,0,0]=4 1415 B6R1.2 CN1C=CN=C1 MCULE-3087755909 [0,0,0,1,0,0|3,0,0]=4 1416 B6R1.2 CN1C=CN=C1 MCULE-7326970566 [0,0,0,1,0,0|3,0,0]=4 1417 B6R1.2 CN1C=CN=C1 MCULE-7347723440 [0,0,0,1,0,0|3,0,0]=4 1418 B6R1.2 CN1C=CN=N1 MCULE-5243651327 [0,0,0,1,0,0|3,0,0]=4 1419 B6R1.2 CN1C=C[NH+]=C1 MCULE-1511454799 [0,0,0,1,0,0|3,0,0]=4 1420 B6R1.2 ClC1=CC=CO1 MCULE-3538307465 [0,0,0,1,0,0|1,0,2]=4 1421 B6R1.2 ClC1=CC=CS1 MCULE-2640438050 [0,0,0,1,0,0|1,1,1]=4 1422 B6R1.2 ClC1=CC=NN1 MCULE-3560728451 [0,0,0,1,0,0|3,0,0]=4 1423 B6R1.2 ClC1=CCCC1 MCULE-7680993065 [0,0,0,1,0,0|1,0,1]=3 1424 B6R1.2 ClC1=CSC=C1 MCULE-1998275400 [0,0,0,1,0,0|2,0,1]=4 1425 B6R1.2 ClC1=NNC=C1 MCULE-6678816051 [0,0,0,1,0,0|3,0,0]=4 1426 B6R1.2 ClC1=NSC=C1 MCULE-5743382341 [0,0,0,1,0,0|3,0,0]=4 1427 B6R1.2 FC1=CC=CS1 MCULE-5362233873 [0,0,0,1,0,0|1,1,1]=4 1428 B6R1.2 FC1=CSC=C1 MCULE-3342972910 [0,0,0,1,0,0|2,0,1]=4 1429 B6R1.2 FC1=NNC=C1 MCULE-3532126949 [0,0,0,1,0,0|3,0,0]=4 1430 B6R1.2 IC1=CC=CO1 MCULE-6467830719 [0,0,0,1,0,0|1,0,2]=4 1431 B6R1.2 IC1=CC=CS1 MCULE-6025659368 [0,0,0,1,0,0|1,1,1]=4 1432 B6R1.2 IC1=CC=NN1 MCULE-9744954898 [0,0,0,1,0,0|3,0,0]=4 1433 B6R1.2 IC1=CC=NS1 MCULE-7758361866 [0,0,0,1,0,0|2,1,0]=4 1434 B6R1.2 IC1=CCCC1 MCULE-5953451970 [0,0,0,1,0,0|1,0,1]=3 1435 B6R1.2 IC1=CNC=C1 MCULE-4230351559 [0,0,0,1,0,0|2,0,1]=4 1436 B6R1.2 IC1=COCC1 MCULE-3076361502 [0,0,0,1,0,0|2,0,0]=3 1437 B6R1.2 IC1=CSC=C1 MCULE-1100365117 [0,0,0,1,0,0|2,0,1]=4 1438 B6R1.2 IC1=NNC=C1 MCULE-9771094813 [0,0,0,1,0,0|3,0,0]=4 1439 B6R1.2 N=C1CCCS1 MCULE-4228855265 [0,0,0,1,0,0|2,0,1]=4 1440 B6R1.2 N=C1CCCS1 MCULE-7496124035 [0,0,0,1,0,0|2,0,1]=4 1441 B6R1.2 NC1=CC=CN1 MCULE-5653620818 [0,0,0,1,0,0|2,0,1]=4 1442 B6R1.2 NC1=CC=CN1 MCULE-9753432085 [0,0,0,1,0,0|2,0,1]=4 1443 B6R1.2 NC1=CC=CO1 MCULE-2421139965 [0,0,0,1,0,0|1,0,2]=4 1444 B6R1.2 NC1=CC=CS1 MCULE-1649510352 [0,0,0,1,0,0|1,1,1]=4 1445 B6R1.2 NC1=CC=CS1 MCULE-9501271303 [0,0,0,1,0,0|1,1,1]=4 1446 B6R1.2 NC1=CC=NO1 MCULE-3638275568 [0,0,0,1,0,0|2,0,1]=4 1447 B6R1.2 NC1=CC=NS1 MCULE-2159626770 [0,0,0,1,0,0|2,1,0]=4 1448 B6R1.2 NC1=CC=NS1 MCULE-8733584582 [0,0,0,1,0,0|2,1,0]=4 1449 B6R1.2 NC1=CNC=C1 MCULE-1411730985 [0,0,0,1,0,0|2,0,1]=4 1450 B6R1.2 NC1=CNC=C1 MCULE-7701316156 [0,0,0,1,0,0|2,0,1]=4 1451 B6R1.2 NC1=COC=C1 MCULE-1858324031 [0,0,0,1,0,0|2,0,1]=4 1452 B6R1.2 NC1=COC=C1 MCULE-3985426542 [0,0,0,1,0,0|2,0,1]=4 1453 B6R1.2 NC1=CSC=C1 MCULE-1673174137 [0,0,0,1,0,0|2,0,1]=4 1454 B6R1.2 NC1=CSC=C1 MCULE-5461897385 [0,0,0,1,0,0|2,0,1]=4 1455 B6R1.2 NC1=CSC=C1 MCULE-6200615331 [0,0,0,1,0,0|2,0,1]=4 1456 B6R1.2 NC1=CSC=C1 MCULE-9439581665 [0,0,0,1,0,0|2,0,1]=4 1457 B6R1.2 NC1=NCCC1 MCULE-6089369366 [0,0,0,1,0,0|2,0,1]=4 1458 B6R1.2 NC1=NCCC1 MCULE-8979618464 [0,0,0,1,0,0|2,0,1]=4 1459 B6R1.2 NC1=NNC=C1 MCULE-1507683823 [0,0,0,1,0,0|3,0,0]=4 1460 B6R1.2 NC1=NNC=C1 MCULE-5117516307 [0,0,0,1,0,0|3,0,0]=4 1461 B6R1.2 NC1=NNC=C1 MCULE-7091290697 [0,0,0,1,0,0|3,0,0]=4 1462 B6R1.2 NC1=NNCC1 MCULE-4665265929 [0,0,0,1,0,0|3,0,0]=4 1463 B6R1.2 NC1=NOC=C1 MCULE-5363092492 [0,0,0,1,0,0|3,0,0]=4 1464 B6R1.2 NC1=NOCC1 MCULE-4971355735 [0,0,0,1,0,0|3,0,0]=4 1465 B6R1.2 NC1=NSC=C1 MCULE-2731864153 [0,0,0,1,0,0|3,0,0]=4 1466 B6R1.2 NC1=NSC=C1 MCULE-4778941442 [0,0,0,1,0,0|3,0,0]=4 1467 B6R1.2 NC1C=CCC1 MCULE-2537724380 [0,0,0,1,0,0|1,0,1]=3 1468 B6R1.2 NC1C=CCC1 MCULE-5017993489 [0,0,0,1,0,0|1,0,1]=3 1469 B6R1.2 O=C1C=CCC1 MCULE-1844779047 [0,0,0,1,0,0|0,0,0]=1 1470 B6R1.2 O=C1C=CCN1 MCULE-4338701003 [0,0,0,1,0,0|1,0,0]=2 1471 B6R1.2 O=C1C=CCO1 MCULE-4296503663 [0,0,0,1,0,0|1,0,0]=2 1472 B6R1.2 O=C1C=CCS1 MCULE-5623095583 [0,0,0,1,0,0|1,0,0]=2 1473 B6R1.2 O=C1C=CNN1 MCULE-8045056316 [0,0,0,1,0,0|2,0,0]=3 1474 B6R1.2 O=C1C=CSC1 MCULE-6580304664 [0,0,0,1,0,0|1,0,0]=2 1475 B6R1.2 O=C1C=CSN1 MCULE-6820517860 [0,0,0,1,0,0|2,0,0]=3 1476 B6R1.2 O=C1CC=CC1 MCULE-7606670114 [0,0,0,1,0,0|0,0,2]=3 1477 B6R1.2 O=C1CC=NN1 MCULE-1672455504 [0,0,0,1,0,0|2,0,1]=4 1478 B6R1.2 O=C1CCCC1 MCULE-9455227735 [0,0,0,1,0,0|0,0,2]=3 1479 B6R1.2 O=C1CCCN1 MCULE-3061780794 [0,0,0,1,0,0|1,0,1]=3 1480 B6R1.2 O=C1CCCO1 MCULE-6795890265 [0,0,0,1,0,0|1,0,1]=3 1481 B6R1.2 O=C1CCCS1 MCULE-5361654550 [0,0,0,1,0,0|1,0,1]=3 1482 B6R1.2 O=C1CCNC1 MCULE-2947789259 [0,0,0,1,0,0|1,0,1]=3 1483 B6R1.2 O=C1CCNC1 MCULE-7192595052 [0,0,0,1,0,0|1,0,1]=3 1484 B6R1.2 O=C1CCNN1 MCULE-7030953666 [0,0,0,1,0,0|2,0,0]=3 1485 B6R1.2 O=C1CCOC1 MCULE-2031733910 [0,0,0,1,0,0|1,0,1]=3 1486 B6R1.2 O=C1CCON1 MCULE-6799359324 [0,0,0,1,0,0|2,0,0]=3 1487 B6R1.2 O=C1CCSC1 MCULE-2059655624 [0,0,0,1,0,0|1,0,1]=3 1488 B6R1.2 O=C1CC[NH2+]N1 MCULE-5327505055 [0,0,0,1,0,0|2,0,0]=3 1489 B6R1.2 O=C1CNCN1 MCULE-2645891847 [0,0,0,1,0,0|2,0,1]=4 1490 B6R1.2 O=C1CNCN1 MCULE-9269137129 [0,0,0,1,0,0|2,0,1]=4 1491 B6R1.2 O=C1CSCN1 MCULE-3946660854 [0,0,0,1,0,0|2,0,1]=4 1492 B6R1.2 O=C1N=CN=N1 MCULE-3721166402 [0,0,0,1,0,0|3,0,0]=4 1493 B6R1.2 O=C1NC=CN1 MCULE-6249170076 [0,0,0,1,0,0|2,0,1]=4 1494 B6R1.2 O=C1NC=CO1 MCULE-4371023805 [0,0,0,1,0,0|2,0,1]=4 1495 B6R1.2 O=C1NC=CS1 MCULE-2039347995 [0,0,0,1,0,0|2,0,1]=4 1496 B6R1.2 O=C1NC=NN1 MCULE-8685001700 [0,0,0,1,0,0|3,0,0]=4 1497 B6R1.2 O=C1NCCN1 MCULE-9806791551 [0,0,0,1,0,0|2,0,1]=4 1498 B6R1.2 O=C1NCCO1 MCULE-3934923008 [0,0,0,1,0,0|2,0,1]=4 1499 B6R1.2 O=C1NCCS1 MCULE-6732478086 [0,0,0,1,0,0|2,0,1]=4 1500 B6R1.2 O=C1OC=CO1 MCULE-1924277704 [0,0,0,1,0,0|2,0,1]=4 1501 B6R1.2 O=C1OCCO1 MCULE-9493253045 [0,0,0,1,0,0|2,0,1]=4 1502 B6R1.2 O=S1CCCC1 MCULE-2442126780 [0,0,0,1,0,0|1,0,2]=4 1503 B6R1.2 OC1=CC=CO1 MCULE-7591676996 [0,0,0,1,0,0|1,0,2]=4 1504 B6R1.2 OC1=CC=CS1 MCULE-8044830478 [0,0,0,1,0,0|1,0,2]=4 1505 B6R1.2 OC1=CC=NN1 MCULE-9109008036 [0,0,0,1,0,0|2,0,1]=4 1506 B6R1.2 OC1=CNC=C1 MCULE-3938204755 [0,0,0,1,0,0|1,0,2]=4 1507 B6R1.2 OC1=CSC=C1 MCULE-2226095386 [0,0,0,1,0,0|1,0,2]=4 1508 B6R1.2 OC1=NOC=C1 MCULE-6441945551 [0,0,0,1,0,0|2,0,1]=4 1509 B6R1.2 OC1C=CCC1 MCULE-3857764876 [0,0,0,1,0,0|0,0,2]=3 1510 B6R1.2 OC1C=CCO1 MCULE-4636930669 [0,0,0,1,0,0|1,0,2]=4 1511 B6R1.2 S=C1CCCN1 MCULE-1089290822 [0,0,0,1,0,0|1,1,1]=4 1512 B6R1.2 SC1=CC=CS1 MCULE-8882266878 [0,0,0,1,0,0|1,1,1]=4 1513 B6R1.2 SC1=CSC=C1 MCULE-8930005512 [0,0,0,1,0,0|1,1,1]=4 1514 B6R1.2 [TlH2]C1=CC=CC1 MCULE-7402896981 [0,0,0,1,0,0|1,0,1]=3 1515 B6R1.3 Br/C=C/C1CC1 MCULE-8231904960 [0,0,0,1,0,0|2,0,1]=4 1516 B6R1.3 BrC=CC1CC1 MCULE-7061395349 [0,0,0,1,0,0|2,0,1]=4 1517 B6R1.5 C=C1CC(=O)O1 MCULE-7149487095 [0,0,0,1,0,0|1,0,1]=3 1518 B6R1.5 CC1CC(=O)C1 MCULE-2159393653 [0,0,0,1,0,0|0,0,2]=3 1519 B6R1.5 CC1CC(=O)N1 MCULE-6139592633 [0,0,0,1,0,0|1,0,1]=3 1520 B6R1.5 CC1CC(=O)O1 MCULE-9285847382 [0,0,0,1,0,0|1,0,1]=3 1521 B6R1.5 CN1CC(=O)C1 MCULE-1685267969 [0,0,0,1,0,0|1,0,1]=3 1522 B6R1.5 CN1CC(=O)C1 MCULE-2242594777 [0,0,0,1,0,0|1,0,1]=3 1523 B6R1.5 C[C@@H]1CC(=O)O1 MCULE-3257475519 [0,0,0,1,0,0|1,0,1]=3 1524 B6R1.5 NC1CC(=O)C1 MCULE-3450860282 [0,0,0,1,0,0|1,0,2]=4 1525 B6R1.5 NC1CC(=O)C1 MCULE-5974961836 [0,0,0,1,0,0|1,0,2]=4 1526 B6R1.5 O=C1CC(C1)Br MCULE-1715982282 [0,0,0,1,0,0|1,0,2]=4 1527 B6R1.5 O=C1CC(C1)F MCULE-2541516698 [0,0,0,1,0,0|1,0,2]=4 1528 B6R1.5 O=C1CC(C1)O MCULE-7099112258 [0,0,0,1,0,0|1,0,2]=4 1529 B6R1.10 O=S1(=O)C=CC1 MCULE-7285340589 [0,0,0,1,0,0|2,0,0]=3 1530 B6R1.11 C=C(C)C1CO1 MCULE-3656533343 [0,0,0,1,0,0|2,0,1]=4 1531 B6R1.11 CC(=O)C1CC1 MCULE-3846146416 [0,0,0,1,0,0|0,0,2]=3 1532 B6R1.11 CC(=O)C1CO1 MCULE-4329154079 [0,0,0,1,0,0|1,0,1]=3 1533 B6R1.11 NC(=O)C1CC1 MCULE-9911054913 [0,0,0,1,0,0|1,0,2]=4 1534 B6R1.11 NC(=O)C1CO1 MCULE-6911744868 [0,0,0,1,0,0|2,0,1]=4 1535 B6R1.11 O=C(Cl)C1CC1 MCULE-8675746452 [0,0,0,1,0,0|1,0,2]=4 1536 B6R1.11 O=C(O)C1CC1 MCULE-4677373694 [0,0,0,1,0,0|1,0,2]=4 1537 B6R1.11 O=C(O)C1CN1 MCULE-3236125597 [0,0,0,1,0,0|2,0,1]=4 1538 B6R1.11 O=C(O)C1CO1 MCULE-2152916793 [0,0,0,1,0,0|2,0,1]=4 1539 B6R1.11 O=C(O)[C@@H]1CN1 MCULE-4363753412 [0,0,0,1,0,0|2,0,1]=4 1540 B6R1.11 O=C(O)[C@H]1CN1 MCULE-4830347195 [0,0,0,1,0,0|2,0,1]=4 1541 B6R1.11 O=C(O)[C@H]1CO1 MCULE-5204459723 [0,0,0,1,0,0|2,0,1]=4 1542 B6R1.11 O=C(O)[C@H]1CO1 MCULE-6983707093 [0,0,0,1,0,0|2,0,1]=4 1543 B6R1.11 O=C([O-])C1CN1 MCULE-6490437892 [0,0,0,1,0,0|2,0,1]=4 1544 B6R1.11 O=C([O-])C1CO1 MCULE-4586459966 [0,0,0,1,0,0|2,0,1]=4 1545 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1647975669 [0,0,0,1,0,0|2,0,1]=4 1546 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1906997950 [0,0,0,1,0,0|2,0,1]=4 1547 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-4899800766 [0,0,0,1,0,0|2,0,1]=4 1548 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-9148170094 [0,0,0,1,0,0|2,0,1]=4 1549 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-6663734494 [0,0,0,1,0,0|2,0,1]=4 1550 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-8580451361 [0,0,0,1,0,0|2,0,1]=4 1551 B3R0.1 Br/C=C/Br MCULE-6284547614 [2,0,0,0,0,0|2,0,0]=4 1552 B3R0.1 BrC=CBr MCULE-4478409345 [2,0,0,0,0,0|2,0,0]=4 1553 B3R0.1 C#CC=O MCULE-4187736819 [2,0,0,0,0,0|0,0,2]=4 1554 B3R0.1 C/C=C/Br MCULE-4076369660 [2,0,0,0,0,0|1,0,0]=3 1555 B3R0.1 C/C=N/O MCULE-2376410404 [2,0,0,0,0,0|1,0,1]=4 1556 B3R0.1 C=CC#N MCULE-8176403366 [2,0,0,0,0,0|1,0,1]=4 1557 B3R0.1 C=CC=C MCULE-4134157329 [2,0,0,0,0,0|0,0,1]=3 1558 B3R0.1 C=CC=O MCULE-2104890669 [2,0,0,0,0,0|0,0,0]=2 1559 B3R0.1 C=CCBr MCULE-9486454833 [2,0,0,0,0,0|1,0,1]=4 1560 B3R0.1 C=CCC MCULE-8167907130 [2,0,0,0,0,0|0,0,1]=3 1561 B3R0.1 C=CCCl MCULE-4067772785 [2,0,0,0,0,0|1,0,1]=4 1562 B3R0.1 C=CCF MCULE-7783191980 [2,0,0,0,0,0|1,0,1]=4 1563 B3R0.1 C=CCI MCULE-5037698873 [2,0,0,0,0,0|1,0,1]=4 1564 B3R0.1 C=CCN MCULE-2424616806 [2,0,0,0,0,0|1,0,1]=4 1565 B3R0.1 C=CCN MCULE-2473480946 [2,0,0,0,0,0|1,0,1]=4 1566 B3R0.1 C=CCO MCULE-2145308838 [2,0,0,0,0,0|0,0,2]=4 1567 B3R0.1 C=CCS MCULE-7270484838 [2,0,0,0,0,0|0,1,1]=4 1568 B3R0.1 C=COC MCULE-4880746684 [2,0,0,0,0,0|1,0,0]=3 1569 B3R0.1 CC#CC MCULE-3721942346 [2,0,0,0,0,0|0,0,2]=4 1570 B3R0.1 CC=CBr MCULE-2098755460 [2,0,0,0,0,0|1,0,0]=3 1571 B3R0.1 CC=CCl MCULE-9225887510 [2,0,0,0,0,0|1,0,0]=3 1572 B3R0.1 CC=NO MCULE-9761317381 [2,0,0,0,0,0|1,0,1]=4 1573 B3R0.1 CCC=O MCULE-4079744837 [2,0,0,0,0,0|0,0,1]=3 1574 B3R0.1 CCCC MCULE-9760497805 [2,0,0,0,0,0|0,0,2]=4 1575 B3R0.1 CCNC MCULE-7215376398 [2,0,0,0,0,0|1,0,1]=4 1576 B3R0.1 CCNC MCULE-9811899205 [2,0,0,0,0,0|1,0,1]=4 1577 B3R0.1 CCSC MCULE-6944750263 [2,0,0,0,0,0|1,0,1]=4 1578 B3R0.1 CN=C=O MCULE-7764606582 [2,0,0,0,0,0|1,0,1]=4 1579 B3R0.1 CNC=O MCULE-4739122677 [2,0,0,0,0,0|1,0,0]=3 1580 B3R0.1 CNC=S MCULE-1018523469 [2,0,0,0,0,0|1,1,0]=4 1581 B3R0.1 CNNC MCULE-5932476941 [2,0,0,0,0,0|2,0,0]=4 1582 B3R0.1 CNNC MCULE-6419598860 [2,0,0,0,0,0|2,0,0]=4 1583 B3R0.1 CNOC MCULE-1706082503 [2,0,0,0,0,0|2,0,0]=4 1584 B3R0.1 CNOC MCULE-6224540090 [2,0,0,0,0,0|2,0,0]=4 1585 B3R0.1 COC=O MCULE-9122749354 [2,0,0,0,0,0|1,0,0]=3 1586 B3R0.1 CSSC MCULE-7451882535 [2,0,0,0,0,0|2,0,0]=4 1587 B3R0.1 C[Se][Se]C MCULE-1189700302 [2,0,0,0,0,0|2,0,0]=4 1588 B3R0.1 Cl/C=C/Cl MCULE-8326307647 [2,0,0,0,0,0|2,0,0]=4 1589 B3R0.1 Cl/C=C\Cl MCULE-8638364223 [2,0,0,0,0,0|2,0,0]=4 1590 B3R0.1 ClC=CCl MCULE-1709740532 [2,0,0,0,0,0|2,0,0]=4 1591 B3R0.1 F/C=C/Cl MCULE-6748930384 [2,0,0,0,0,0|2,0,0]=4 1592 B3R0.1 FC=CBr MCULE-3730796032 [2,0,0,0,0,0|2,0,0]=4 1593 B3R0.1 FC=CCl MCULE-8668714110 [2,0,0,0,0,0|2,0,0]=4 1594 B3R0.1 FC=CF MCULE-1668825245 [2,0,0,0,0,0|2,0,0]=4 1595 B3R0.1 NNC=O MCULE-6986968107 [2,0,0,0,0,0|2,0,0]=4 1596 B3R0.1 NOC=O MCULE-4489199776 [2,0,0,0,0,0|2,0,0]=4 1597 B3R0.1 O=CC=O MCULE-3212938778 [2,0,0,0,0,0|1,0,0]=3 1598 B3R0.1 O=CCBr MCULE-9076011270 [2,0,0,0,0,0|1,0,1]=4 1599 B3R0.1 O=CCCl MCULE-7307216184 [2,0,0,0,0,0|1,0,1]=4 1600 B3R0.1 O=CCI MCULE-1146810366 [2,0,0,0,0,0|1,0,1]=4 1601 B3R0.2 BN(C)C MCULE-2470964161 [2,0,0,0,0,0|2,0,0]=4 1602 B3R0.2 C=C(C)Br MCULE-7805530064 [2,0,0,0,0,0|1,0,0]=3 1603 B3R0.2 C=C(C)C MCULE-5640095130 [2,0,0,0,0,0|1,0,0]=3 1604 B3R0.2 C=C(C)Cl MCULE-1752401095 [2,0,0,0,0,0|1,0,0]=3 1605 B3R0.2 C=C(C)F MCULE-3213198231 [2,0,0,0,0,0|1,0,0]=3 1606 B3R0.2 C=C(Cl)Cl MCULE-1430323756 [2,0,0,0,0,0|2,0,0]=4 1607 B3R0.2 C=C(F)Cl MCULE-8528897253 [2,0,0,0,0,0|2,0,0]=4 1608 B3R0.2 C=C(F)F MCULE-2471767745 [2,0,0,0,0,0|2,0,0]=4 1609 B3R0.2 C=[N+](C)C MCULE-4450980212 [2,0,0,0,0,0|2,0,0]=4 1610 B3R0.2 C=[N+](C)C MCULE-5309464837 [2,0,0,0,0,0|2,0,0]=4 1611 B3R0.2 C=[N+](C)C MCULE-9321779445 [2,0,0,0,0,0|2,0,0]=4 1612 B3R0.2 CC(=N)N MCULE-3235425606 [2,0,0,0,0,0|2,0,0]=4 1613 B3R0.2 CC(=N)N MCULE-3546679379 [2,0,0,0,0,0|2,0,0]=4 1614 B3R0.2 CC(=N)N MCULE-3597638887 [2,0,0,0,0,0|2,0,0]=4 1615 B3R0.2 CC(=N)N MCULE-9831274654 [2,0,0,0,0,0|2,0,0]=4 1616 B3R0.2 CC(=O)Br MCULE-4892265063 [2,0,0,0,0,0|1,0,0]=3 1617 B3R0.2 CC(=O)C MCULE-6679625040 [2,0,0,0,0,0|0,0,0]=2 1618 B3R0.2 CC(=O)Cl MCULE-9041746362 [2,0,0,0,0,0|1,0,0]=3 1619 B3R0.2 CC(=O)I MCULE-4812718701 [2,0,0,0,0,0|1,0,0]=3 1620 B3R0.2 CC(=O)N MCULE-9280264861 [2,0,0,0,0,0|1,0,0]=3 1621 B3R0.2 CC(=O)O MCULE-1502330578 [2,0,0,0,0,0|1,0,0]=3 1622 B3R0.2 CC(=O)O MCULE-5514028500 [2,0,0,0,0,0|1,0,0]=3 1623 B3R0.2 CC(=O)O MCULE-5942589566 [2,0,0,0,0,0|1,0,0]=3 1624 B3R0.2 CC(=O)O MCULE-6780070129 [2,0,0,0,0,0|1,0,0]=3 1625 B3R0.2 CC(=O)O MCULE-8295936189 [2,0,0,0,0,0|1,0,0]=3 1626 B3R0.2 CC(=O)O MCULE-9103972283 [2,0,0,0,0,0|1,0,0]=3 1627 B3R0.2 CC(=O)O MCULE-9900518424 [2,0,0,0,0,0|1,0,0]=3 1628 B3R0.2 CC(=O)S MCULE-5769447035 [2,0,0,0,0,0|1,0,0]=3 1629 B3R0.2 CC(=O)[O-] MCULE-2314460022 [2,0,0,0,0,0|1,0,0]=3 1630 B3R0.2 CC(=O)[O-] MCULE-2960771771 [2,0,0,0,0,0|1,0,0]=3 1631 B3R0.2 CC(=O)[O-] MCULE-5334052410 [2,0,0,0,0,0|1,0,0]=3 1632 B3R0.2 CC(=O)[O-] MCULE-5482908386 [2,0,0,0,0,0|1,0,0]=3 1633 B3R0.2 CC(=O)[O-] MCULE-9723570182 [2,0,0,0,0,0|1,0,0]=3 1634 B3R0.2 CC(=O)[O-] MCULE-9910426896 [2,0,0,0,0,0|1,0,0]=3 1635 B3R0.2 CC(=S)N MCULE-4635097605 [2,0,0,0,0,0|1,1,0]=4 1636 B3R0.2 CC(=S)[O-] MCULE-1878530758 [2,0,0,0,0,0|1,0,1]=4 1637 B3R0.2 CC(C)Br MCULE-4068304617 [2,0,0,0,0,0|1,0,1]=4 1638 B3R0.2 CC(C)C MCULE-6616676274 [2,0,0,0,0,0|1,0,1]=4 1639 B3R0.2 CC(C)Cl MCULE-3190141598 [2,0,0,0,0,0|1,0,1]=4 1640 B3R0.2 CC(C)F MCULE-5333357055 [2,0,0,0,0,0|1,0,1]=4 1641 B3R0.2 CC(C)I MCULE-6151711033 [2,0,0,0,0,0|1,0,1]=4 1642 B3R0.2 CC(C)N MCULE-1048799006 [2,0,0,0,0,0|1,0,1]=4 1643 B3R0.2 CC(C)N MCULE-1125416142 [2,0,0,0,0,0|1,0,1]=4 1644 B3R0.2 CC(C)N MCULE-2418429353 [2,0,0,0,0,0|1,0,1]=4 1645 B3R0.2 CC(C)N MCULE-7280647435 [2,0,0,0,0,0|1,0,1]=4 1646 B3R0.2 CC(C)O MCULE-6646752234 [2,0,0,0,0,0|0,0,2]=4 1647 B3R0.2 CC(C)S MCULE-8283942088 [2,0,0,0,0,0|0,1,1]=4 1648 B3R0.2 CN(=O)=O MCULE-8704524604 [2,0,0,0,0,0|2,0,0]=4 1649 B3R0.2 CN(C)C MCULE-5179437979 [2,0,0,0,0,0|2,0,0]=4 1650 B3R0.2 CN(C)C MCULE-6816696733 [2,0,0,0,0,0|2,0,0]=4 1651 B3R0.2 CN(C)C MCULE-7903544426 [2,0,0,0,0,0|2,0,0]=4 1652 B3R0.2 CN(C)N MCULE-7177216911 [2,0,0,0,0,0|2,0,0]=4 1653 B3R0.2 CN(C)N MCULE-8775366011 [2,0,0,0,0,0|2,0,0]=4 1654 B3R0.2 CN(C)O MCULE-6572915706 [2,0,0,0,0,0|1,0,1]=4 1655 B3R0.2 CN(C)O MCULE-6950647562 [2,0,0,0,0,0|1,0,1]=4 1656 B3R0.2 CP(=O)C MCULE-6150886622 [2,0,0,0,0,0|1,0,0]=3 1657 B3R0.2 CP(C)C MCULE-6703190251 [2,0,0,0,0,0|2,0,0]=4 1658 B3R0.2 CS(=O)C MCULE-2005841258 [2,0,0,0,0,0|1,0,0]=3 1659 B3R0.2 CS(=O)Cl MCULE-1292201352 [2,0,0,0,0,0|2,0,0]=4 1660 B3R0.2 CS(=O)N MCULE-5162949591 [2,0,0,0,0,0|2,0,0]=4 1661 B3R0.2 CS(=O)O MCULE-8711306710 [2,0,0,0,0,0|2,0,0]=4 1662 B3R0.2 CS(=O)[O-] MCULE-1437194827 [2,0,0,0,0,0|2,0,0]=4 1663 B3R0.2 C[Ga](C)C MCULE-6013775603 [2,0,0,0,0,0|2,0,0]=4 1664 B3R0.2 C[In](C)C MCULE-1424187192 [2,0,0,0,0,0|2,0,0]=4 1665 B3R0.2 C[O+](C)C MCULE-2925451414 [2,0,0,0,0,0|2,0,0]=4 1666 B3R0.2 C[S+](C)Br MCULE-2734391695 [2,0,0,0,0,0|2,0,0]=4 1667 B3R0.2 C[S+](C)Br MCULE-6411921824 [2,0,0,0,0,0|2,0,0]=4 1668 B3R0.2 C[S+](C)C MCULE-5867625832 [2,0,0,0,0,0|2,0,0]=4 1669 B3R0.2 C[S+](C)C MCULE-7678314643 [2,0,0,0,0,0|2,0,0]=4 1670 B3R0.2 C[S+](C)C MCULE-8005905986 [2,0,0,0,0,0|2,0,0]=4 1671 B3R0.2 C[Se](=O)C MCULE-4596040471 [2,0,0,0,0,0|1,0,0]=3 1672 B3R0.2 C[Se](=O)O MCULE-5568767851 [2,0,0,0,0,0|2,0,0]=4 1673 B3R0.2 NC(=O)N MCULE-3224868954 [2,0,0,0,0,0|2,0,0]=4 1674 B3R0.2 NC(=O)N MCULE-8513891094 [2,0,0,0,0,0|2,0,0]=4 1675 B3R0.2 NC(=O)O MCULE-1579038047 [2,0,0,0,0,0|2,0,0]=4 1676 B3R0.2 NC(=O)O MCULE-3232812015 [2,0,0,0,0,0|2,0,0]=4 1677 B3R0.2 O=C(Cl)[Au] MCULE-6601882022 [2,0,0,0,0,0|2,0,0]=4 1678 B3R0.2 O=C(O)O MCULE-3743781291 [2,0,0,0,0,0|2,0,0]=4 1679 B3R0.2 O=C(O)O MCULE-6373078171 [2,0,0,0,0,0|2,0,0]=4 1680 B3R0.2 O=C([O-])O MCULE-5529655359 [2,0,0,0,0,0|2,0,0]=4 1681 B3R0.2 O=C([O-])O MCULE-7293729150 [2,0,0,0,0,0|2,0,0]=4 1682 B3R0.2 O=C([O-])[O-] MCULE-1092668330 [2,0,0,0,0,0|2,0,0]=4 1683 B3R0.2 O=C([O-])[O-] MCULE-1095103800 [2,0,0,0,0,0|2,0,0]=4 1684 B3R0.2 O=C([O-])[O-] MCULE-1597066471 [2,0,0,0,0,0|2,0,0]=4 1685 B3R0.2 O=C([O-])[O-] MCULE-2005483457 [2,0,0,0,0,0|2,0,0]=4 1686 B3R0.2 O=C([O-])[O-] MCULE-3299525070 [2,0,0,0,0,0|2,0,0]=4 1687 B3R0.2 O=C([O-])[O-] MCULE-4074516840 [2,0,0,0,0,0|2,0,0]=4 1688 B3R0.2 O=C([O-])[O-] MCULE-4180727513 [2,0,0,0,0,0|2,0,0]=4 1689 B3R0.2 O=C([O-])[O-] MCULE-4294265087 [2,0,0,0,0,0|2,0,0]=4 1690 B3R0.2 O=C([O-])[O-] MCULE-5127021441 [2,0,0,0,0,0|2,0,0]=4 1691 B3R0.2 O=C([O-])[O-] MCULE-5345790821 [2,0,0,0,0,0|2,0,0]=4 1692 B3R0.2 O=C([O-])[O-] MCULE-6214917073 [2,0,0,0,0,0|2,0,0]=4 1693 B3R0.2 O=C([O-])[O-] MCULE-6757968396 [2,0,0,0,0,0|2,0,0]=4 1694 B3R0.2 O=C([O-])[O-] MCULE-7714638074 [2,0,0,0,0,0|2,0,0]=4 1695 B3R0.2 O=C([O-])[O-] MCULE-8731559807 [2,0,0,0,0,0|2,0,0]=4 1696 B5R0.3 C#CC(=O)CC MCULE-1563732373 [1,1,0,0,0,0|0,0,2]=4 1697 B5R0.3 C#CC(=O)NC MCULE-8852565705 [1,1,0,0,0,0|0,0,2]=4 1698 B5R0.3 C#CC(=O)OC MCULE-5108326717 [1,1,0,0,0,0|0,0,2]=4 1699 B5R0.3 C/C(=C\Br)/C#N MCULE-5132213304 [1,1,0,0,0,0|2,0,0]=4 1700 B5R0.3 C/C(=C\N)/C=O MCULE-4713460468 [1,1,0,0,0,0|1,0,0]=3 1701 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [1,1,0,0,0,0|1,0,0]=3 1702 B5R0.3 C/C=C(\C)/C=O MCULE-2818872726 [1,1,0,0,0,0|0,0,0]=2 1703 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [1,1,0,0,0,0|1,0,0]=3 1704 B5R0.3 C/N=C(\N)/SC MCULE-1114021101 [1,1,0,0,0,0|2,0,0]=4 1705 B5R0.3 C/N=C(\N)/SC MCULE-4249574209 [1,1,0,0,0,0|2,0,0]=4 1706 B5R0.3 C=C(C=O)CC MCULE-2875154067 [1,1,0,0,0,0|0,0,2]=4 1707 B5R0.3 C=C(CC)CBr MCULE-1652422688 [1,1,0,0,0,0|1,0,1]=4 1708 B5R0.3 C=C(CC)CC MCULE-9174509622 [1,1,0,0,0,0|1,0,1]=4 1709 B5R0.3 C=C(CC)CN MCULE-2269385026 [1,1,0,0,0,0|1,0,1]=4 1710 B5R0.3 C=C(CC)CN MCULE-3033447984 [1,1,0,0,0,0|1,0,1]=4 1711 B5R0.3 C=C(CC)CO MCULE-8127766352 [1,1,0,0,0,0|1,0,1]=4 1712 B5R0.3 C=C(SC)SC MCULE-8497326619 [1,1,0,0,0,0|2,0,0]=4 1713 B5R0.3 C=C/C(=C/C)/C MCULE-6445909882 [1,1,0,0,0,0|1,0,0]=3 1714 B5R0.3 C=CC(=CC)C MCULE-8585683674 [1,1,0,0,0,0|1,0,0]=3 1715 B5R0.3 C=CC(=O)C=C MCULE-8555160354 [1,1,0,0,0,0|0,0,1]=3 1716 B5R0.3 C=CC(=O)CC MCULE-7277696617 [1,1,0,0,0,0|0,0,0]=2 1717 B5R0.3 C=CC(=O)NC MCULE-5619481947 [1,1,0,0,0,0|0,0,0]=2 1718 B5R0.3 C=CC(=O)NN MCULE-4327484127 [1,1,0,0,0,0|1,0,0]=3 1719 B5R0.3 C=CC(=O)NN MCULE-4961696321 [1,1,0,0,0,0|1,0,0]=3 1720 B5R0.3 C=CC(=O)NO MCULE-9528737042 [1,1,0,0,0,0|1,0,0]=3 1721 B5R0.3 C=CC(=O)OC MCULE-6010665978 [1,1,0,0,0,0|0,0,0]=2 1722 B5R0.3 C=CC(C)C#N MCULE-7507500865 [1,1,0,0,0,0|1,0,1]=4 1723 B5R0.3 C=CC(C)CC MCULE-8112547661 [1,1,0,0,0,0|1,0,1]=4 1724 B5R0.3 C=CC(C)NC MCULE-1929679074 [1,1,0,0,0,0|1,0,1]=4 1725 B5R0.3 C=CC(C)NC MCULE-6382339452 [1,1,0,0,0,0|1,0,1]=4 1726 B5R0.3 C=CC(C)ON MCULE-2385478473 [1,1,0,0,0,0|0,0,2]=4 1727 B5R0.3 C=CC(C)ON MCULE-3428023923 [1,1,0,0,0,0|0,0,2]=4 1728 B5R0.3 C=CC(Cl)CCl MCULE-8000466907 [1,1,0,0,0,0|1,0,1]=4 1729 B5R0.3 C=CC(N)CC MCULE-6270835453 [1,1,0,0,0,0|1,0,1]=4 1730 B5R0.3 C=CC(N)CC MCULE-7920121163 [1,1,0,0,0,0|1,0,1]=4 1731 B5R0.3 C=CC(N)CO MCULE-2457433196 [1,1,0,0,0,0|1,0,1]=4 1732 B5R0.3 C=CC(N)CO MCULE-6697949182 [1,1,0,0,0,0|1,0,1]=4 1733 B5R0.3 C=CC(N)CO MCULE-7137123222 [1,1,0,0,0,0|1,0,1]=4 1734 B5R0.3 C=CC(N)CO MCULE-8388687355 [1,1,0,0,0,0|1,0,1]=4 1735 B5R0.3 C=CC(O)CBr MCULE-3538023814 [1,1,0,0,0,0|0,0,2]=4 1736 B5R0.3 C=CC(O)CC MCULE-2794806228 [1,1,0,0,0,0|0,0,2]=4 1737 B5R0.3 C=CC(O)CN MCULE-3472823475 [1,1,0,0,0,0|0,0,2]=4 1738 B5R0.3 C=CC(O)CO MCULE-6172654550 [1,1,0,0,0,0|0,0,2]=4 1739 B5R0.3 C=CS(=O)C=C MCULE-5650907653 [1,1,0,0,0,0|1,0,1]=4 1740 B5R0.3 C=C[C@@H](N)CO MCULE-1000343618 [1,1,0,0,0,0|1,0,1]=4 1741 B5R0.3 C=C[C@@H](N)CO MCULE-1074988940 [1,1,0,0,0,0|1,0,1]=4 1742 B5R0.3 C=C[C@@H](N)CO MCULE-3685491078 [1,1,0,0,0,0|1,0,1]=4 1743 B5R0.3 C=C[C@@H](N)CO MCULE-4969611575 [1,1,0,0,0,0|1,0,1]=4 1744 B5R0.3 C=C[C@@H](O)CO MCULE-5957455616 [1,1,0,0,0,0|0,0,2]=4 1745 B5R0.3 C=C[C@H](N)CO MCULE-2834725512 [1,1,0,0,0,0|1,0,1]=4 1746 B5R0.3 C=C[C@H](N)CO MCULE-3281738311 [1,1,0,0,0,0|1,0,1]=4 1747 B5R0.3 C=C[C@H](N)CO MCULE-3551585090 [1,1,0,0,0,0|1,0,1]=4 1748 B5R0.3 C=C[C@H](N)CO MCULE-9055556349 [1,1,0,0,0,0|1,0,1]=4 1749 B5R0.3 C=C[C@H](O)CO MCULE-6068203844 [1,1,0,0,0,0|0,0,2]=4 1750 B5R0.3 C=C[C@H](O)CO MCULE-9367072182 [1,1,0,0,0,0|0,0,2]=4 1751 B5R0.3 CC(=CBr)C#N MCULE-9263455697 [1,1,0,0,0,0|2,0,0]=4 1752 B5R0.3 CC(=CCl)CCl MCULE-2732105685 [1,1,0,0,0,0|2,0,0]=4 1753 B5R0.3 CC(=CI)CI MCULE-3347686188 [1,1,0,0,0,0|2,0,0]=4 1754 B5R0.3 CC(=CI)CO MCULE-8491569199 [1,1,0,0,0,0|1,0,1]=4 1755 B5R0.3 CC(=CN)C=O MCULE-5507488903 [1,1,0,0,0,0|1,0,0]=3 1756 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [1,1,0,0,0,0|0,0,2]=4 1757 B5R0.3 CC=C(Br)C=O MCULE-4703333701 [1,1,0,0,0,0|1,0,0]=3 1758 B5R0.3 CC=C(C)C#N MCULE-4009455127 [1,1,0,0,0,0|1,0,0]=3 1759 B5R0.3 CC=C(C)C=O MCULE-9453566957 [1,1,0,0,0,0|0,0,0]=2 1760 B5R0.3 CC=C(C)CC MCULE-5790494157 [1,1,0,0,0,0|1,0,0]=3 1761 B5R0.3 CC=C(C)CCl MCULE-2444762050 [1,1,0,0,0,0|1,0,0]=3 1762 B5R0.3 CCC(=N)OC MCULE-4123543795 [1,1,0,0,0,0|1,0,1]=4 1763 B5R0.3 CCC(=N)OC MCULE-5346320805 [1,1,0,0,0,0|1,0,1]=4 1764 B5R0.3 CCC(=NO)C MCULE-1859652505 [1,1,0,0,0,0|0,0,2]=4 1765 B5R0.3 CCC(=O)CBr MCULE-7825573294 [1,1,0,0,0,0|0,0,1]=3 1766 B5R0.3 CCC(=O)CC MCULE-8236549739 [1,1,0,0,0,0|0,0,1]=3 1767 B5R0.3 CCC(=O)CCl MCULE-9019890380 [1,1,0,0,0,0|0,0,1]=3 1768 B5R0.3 CCC(=O)CN MCULE-1863418812 [1,1,0,0,0,0|0,0,1]=3 1769 B5R0.3 CCC(=O)CN MCULE-5831164340 [1,1,0,0,0,0|0,0,1]=3 1770 B5R0.3 CCC(=O)CO MCULE-8674894820 [1,1,0,0,0,0|0,0,1]=3 1771 B5R0.3 CCC(=O)NC MCULE-5612060170 [1,1,0,0,0,0|0,0,1]=3 1772 B5R0.3 CCC(=O)NN MCULE-1803705917 [1,1,0,0,0,0|1,0,1]=4 1773 B5R0.3 CCC(=O)NO MCULE-1033164448 [1,1,0,0,0,0|1,0,1]=4 1774 B5R0.3 CCC(=O)OC MCULE-7384824725 [1,1,0,0,0,0|0,0,1]=3 1775 B5R0.3 CCC(=O)SC MCULE-9712192191 [1,1,0,0,0,0|0,0,1]=3 1776 B5R0.3 CCC(C)C=O MCULE-2523669899 [1,1,0,0,0,0|0,0,2]=4 1777 B5R0.3 CCN(C)C=O MCULE-2308681384 [1,1,0,0,0,0|1,0,1]=4 1778 B5R0.3 CCP(=O)CC MCULE-2216184595 [1,1,0,0,0,0|1,0,1]=4 1779 B5R0.3 CCS(=O)CC MCULE-5102735179 [1,1,0,0,0,0|1,0,1]=4 1780 B5R0.3 CN(C=O)C=O MCULE-7774435044 [1,1,0,0,0,0|2,0,0]=4 1781 B5R0.3 CNC(=N)CO MCULE-3239749882 [1,1,0,0,0,0|2,0,0]=4 1782 B5R0.3 CNC(=N)NC MCULE-7703075263 [1,1,0,0,0,0|2,0,0]=4 1783 B5R0.3 CNC(=O)CBr MCULE-1439209307 [1,1,0,0,0,0|1,0,0]=3 1784 B5R0.3 CNC(=O)CCl MCULE-1437904095 [1,1,0,0,0,0|1,0,0]=3 1785 B5R0.3 CNC(=O)CI MCULE-1687694185 [1,1,0,0,0,0|1,0,0]=3 1786 B5R0.3 CNC(=O)CN MCULE-1901033297 [1,1,0,0,0,0|1,0,0]=3 1787 B5R0.3 CNC(=O)CN MCULE-8532774234 [1,1,0,0,0,0|1,0,0]=3 1788 B5R0.3 CNC(=O)CO MCULE-5899226107 [1,1,0,0,0,0|1,0,0]=3 1789 B5R0.3 CNC(=O)CS MCULE-7032391129 [1,1,0,0,0,0|1,0,0]=3 1790 B5R0.3 CNC(=O)NC MCULE-5319497155 [1,1,0,0,0,0|1,0,0]=3 1791 B5R0.3 CNC(=O)NN MCULE-2093843774 [1,1,0,0,0,0|2,0,0]=4 1792 B5R0.3 CNC(=O)OC MCULE-1162861376 [1,1,0,0,0,0|1,0,0]=3 1793 B5R0.3 CNC(=S)NC MCULE-7998520647 [1,1,0,0,0,0|1,1,0]=4 1794 B5R0.3 COC(=N)CCl MCULE-2713131753 [1,1,0,0,0,0|2,0,0]=4 1795 B5R0.3 COC(=N)CCl MCULE-6471252676 [1,1,0,0,0,0|2,0,0]=4 1796 B5R0.3 COC(=O)C#N MCULE-8762838190 [1,1,0,0,0,0|1,0,1]=4 1797 B5R0.3 COC(=O)C=O MCULE-2685327079 [1,1,0,0,0,0|1,0,0]=3 1798 B5R0.3 COC(=O)CBr MCULE-2684954408 [1,1,0,0,0,0|1,0,0]=3 1799 B5R0.3 COC(=O)CCl MCULE-5886832940 [1,1,0,0,0,0|1,0,0]=3 1800 B5R0.3 COC(=O)CF MCULE-4367430175 [1,1,0,0,0,0|1,0,0]=3 1801 B5R0.3 COC(=O)CI MCULE-9545584156 [1,1,0,0,0,0|1,0,0]=3 1802 B5R0.3 COC(=O)CN MCULE-7462799100 [1,1,0,0,0,0|1,0,0]=3 1803 B5R0.3 COC(=O)CN MCULE-8887061469 [1,1,0,0,0,0|1,0,0]=3 1804 B5R0.3 COC(=O)CO MCULE-8734582763 [1,1,0,0,0,0|1,0,0]=3 1805 B5R0.3 COC(=O)CS MCULE-3020830180 [1,1,0,0,0,0|1,0,0]=3 1806 B5R0.3 COC(=O)NN MCULE-2637794839 [1,1,0,0,0,0|2,0,0]=4 1807 B5R0.3 COC(=O)OC MCULE-7488725621 [1,1,0,0,0,0|1,0,0]=3 1808 B5R0.3 COC(=O)SCl MCULE-1018411491 [1,1,0,0,0,0|2,0,0]=4 1809 B5R0.3 COC(=S)SC MCULE-7665194168 [1,1,0,0,0,0|1,1,0]=4 1810 B5R0.3 CON(C)C=O MCULE-6743121315 [1,1,0,0,0,0|2,0,0]=4 1811 B5R0.3 COS(=O)OC MCULE-9352053920 [1,1,0,0,0,0|2,0,0]=4 1812 B5R0.3 CS/C(=N/O)/C MCULE-8496912522 [1,1,0,0,0,0|1,0,1]=4 1813 B5R0.3 CSC(=NO)C MCULE-1500524467 [1,1,0,0,0,0|1,0,1]=4 1814 B5R0.3 CSC(=O)SC MCULE-7167992573 [1,1,0,0,0,0|1,0,0]=3 1815 B5R0.3 CSC(=S)SC MCULE-5023087703 [1,1,0,0,0,0|1,1,0]=4 1816 B5R0.3 Cl/C=C(\Cl)/CCl MCULE-8945457634 [1,1,0,0,0,0|2,0,0]=4 1817 B5R0.3 ClC=C(Cl)CCl MCULE-5187224514 [1,1,0,0,0,0|2,0,0]=4 1818 B5R0.3 NCC(=O)CN MCULE-2420991481 [1,1,0,0,0,0|1,0,1]=4 1819 B5R0.3 NCC(=O)CN MCULE-8626789745 [1,1,0,0,0,0|1,0,1]=4 1820 B5R0.3 NCC(=O)NN MCULE-2318099199 [1,1,0,0,0,0|2,0,0]=4 1821 B5R0.3 NCC(=O)NN MCULE-3392354502 [1,1,0,0,0,0|2,0,0]=4 1822 B5R0.3 NCC(=O)NO MCULE-5417617455 [1,1,0,0,0,0|2,0,0]=4 1823 B5R0.3 NNC(=O)CCl MCULE-2158347473 [1,1,0,0,0,0|2,0,0]=4 1824 B5R0.3 NNC(=O)CCl MCULE-9762553206 [1,1,0,0,0,0|2,0,0]=4 1825 B5R0.3 NNC(=O)CO MCULE-8443636349 [1,1,0,0,0,0|2,0,0]=4 1826 B5R0.3 NNC(=O)CS MCULE-4913925166 [1,1,0,0,0,0|2,0,0]=4 1827 B5R0.3 O=C(CBr)CBr MCULE-5262523719 [1,1,0,0,0,0|1,0,1]=4 1828 B5R0.3 O=C(CCl)CCl MCULE-2048636813 [1,1,0,0,0,0|1,0,1]=4 1829 B5R0.3 O=C(CF)CF MCULE-8790300272 [1,1,0,0,0,0|1,0,1]=4 1830 B5R0.3 O=C(CO)CO MCULE-7188810449 [1,1,0,0,0,0|1,0,1]=4 1831 B5R0.3 O=CC(=CO)Br MCULE-8777401868 [1,1,0,0,0,0|2,0,0]=4 1832 B5R0.3 O=CC(=C[O-])F MCULE-8068241665 [1,1,0,0,0,0|2,0,0]=4 1833 B5R0.3 O=CC(=C[O-])F MCULE-9099292239 [1,1,0,0,0,0|2,0,0]=4 1834 B5R0.3 O=CC(=O)CO MCULE-7273475675 [1,1,0,0,0,0|1,0,0]=3 1835 B5R0.3 P(=O)(OC)OC MCULE-7918891029 [1,1,0,0,0,0|2,0,0]=4 1836 B5R0.4 C=CC(C)(C)C MCULE-9118431864 [1,1,0,0,0,0|1,0,1]=4 1837 B5R0.4 C=CC(C)(C)Cl MCULE-4502558407 [1,1,0,0,0,0|1,0,1]=4 1838 B5R0.4 C=CC(C)(C)N MCULE-2016559865 [1,1,0,0,0,0|1,0,1]=4 1839 B5R0.4 C=CC(C)(C)N MCULE-2690537002 [1,1,0,0,0,0|1,0,1]=4 1840 B5R0.4 C=CC(C)(C)O MCULE-5809739830 [1,1,0,0,0,0|0,0,2]=4 1841 B5R0.4 C=CC(C)(Cl)Cl MCULE-7431364327 [1,1,0,0,0,0|1,0,1]=4 1842 B5R0.4 C=CP(=O)(O)O MCULE-3783505051 [1,1,0,0,0,0|2,0,0]=4 1843 B5R0.4 C=CS(=O)(=O)C MCULE-9709633620 [1,1,0,0,0,0|1,0,0]=3 1844 B5R0.4 C=CS(=O)(=O)Cl MCULE-9752322572 [1,1,0,0,0,0|2,0,0]=4 1845 B5R0.4 C=CS(=O)(=O)F MCULE-6614982622 [1,1,0,0,0,0|2,0,0]=4 1846 B5R0.4 C=CS(=O)(=O)N MCULE-7350624756 [1,1,0,0,0,0|2,0,0]=4 1847 B5R0.4 C=CS(=O)(=O)O MCULE-2196938026 [1,1,0,0,0,0|2,0,0]=4 1848 B5R0.4 C=CS(=O)(=O)[O-] MCULE-8568044801 [1,1,0,0,0,0|2,0,0]=4 1849 B5R0.4 C=C[N+](C)(C)C MCULE-1874033627 [1,1,0,0,0,0|2,0,0]=4 1850 B5R0.4 C=C[N+](C)(C)C MCULE-3871229486 [1,1,0,0,0,0|2,0,0]=4 1851 B5R0.4 C=C[Si](C)(C)C MCULE-1884850322 [1,1,0,0,0,0|1,1,0]=4 1852 B5R0.4 C=C[Si](C)(C)Cl MCULE-3962013421 [1,1,0,0,0,0|1,1,0]=4 1853 B5R0.4 C=C[Si](C)(Cl)Cl MCULE-7977866277 [1,1,0,0,0,0|1,1,0]=4 1854 B5R0.4 CCS(=N)(=O)C MCULE-6682726319 [1,1,0,0,0,0|1,0,1]=4 1855 B5R0.4 CCS(=O)(=O)C MCULE-8932195925 [1,1,0,0,0,0|1,0,1]=4 1856 B5R0.4 CNS(=O)(=O)C MCULE-1909911079 [1,1,0,0,0,0|2,0,0]=4 1857 B5R0.4 COS(=O)(=O)C MCULE-4411511042 [1,1,0,0,0,0|2,0,0]=4 1858 B5R0.4 CSS(=O)(=O)C MCULE-2094653694 [1,1,0,0,0,0|2,0,0]=4 1859 B5R0.5 C=C(Br)C(=O)O MCULE-2068246942 [1,1,0,0,0,0|1,0,0]=3 1860 B5R0.5 C=C(C)C(=C)C MCULE-6799765242 [1,1,0,0,0,0|1,0,0]=3 1861 B5R0.5 C=C(C)C(=O)C MCULE-5872425076 [1,1,0,0,0,0|0,0,0]=2 1862 B5R0.5 C=C(C)C(=O)Cl MCULE-9163474336 [1,1,0,0,0,0|1,0,0]=3 1863 B5R0.5 C=C(C)C(=O)N MCULE-3416322097 [1,1,0,0,0,0|1,0,0]=3 1864 B5R0.5 C=C(C)C(=O)O MCULE-9899621926 [1,1,0,0,0,0|1,0,0]=3 1865 B5R0.5 C=C(C)C(=O)[O-] MCULE-5299174444 [1,1,0,0,0,0|1,0,0]=3 1866 B5R0.5 C=C(C)C(=O)[O-] MCULE-7320418926 [1,1,0,0,0,0|1,0,0]=3 1867 B5R0.5 C=C(C)C(=O)[O-] MCULE-7347881815 [1,1,0,0,0,0|1,0,0]=3 1868 B5R0.5 C=C(C)C(C)C MCULE-2535284443 [1,1,0,0,0,0|1,0,1]=4 1869 B5R0.5 C=C(C)C(C)Cl MCULE-5294924458 [1,1,0,0,0,0|1,0,1]=4 1870 B5R0.5 C=C(C)C(C)O MCULE-3768810742 [1,1,0,0,0,0|0,0,2]=4 1871 B5R0.5 C=C(Cl)C(=O)O MCULE-8316225208 [1,1,0,0,0,0|1,0,0]=3 1872 B5R0.5 C=C(F)C(=O)Cl MCULE-6769824615 [1,1,0,0,0,0|1,0,0]=3 1873 B5R0.5 C=C(F)C(=O)O MCULE-7137929861 [1,1,0,0,0,0|1,0,0]=3 1874 B5R0.5 C=C(F)C(=O)[O-] MCULE-1806853701 [1,1,0,0,0,0|1,0,0]=3 1875 B5R0.5 CC(=C(C)Br)C MCULE-2244219065 [1,1,0,0,0,0|1,0,0]=3 1876 B5R0.5 CC(=C(C)C)C MCULE-2888318026 [1,1,0,0,0,0|1,0,0]=3 1877 B5R0.5 CC(=O)C(=O)C MCULE-5742661187 [1,1,0,0,0,0|0,0,0]=2 1878 B5R0.5 CC(=O)C(=O)Cl MCULE-3413498860 [1,1,0,0,0,0|1,0,0]=3 1879 B5R0.5 CC(=O)C(=O)N MCULE-6804734996 [1,1,0,0,0,0|1,0,0]=3 1880 B5R0.5 CC(=O)C(=O)O MCULE-8587144313 [1,1,0,0,0,0|1,0,0]=3 1881 B5R0.5 CC(=O)C(=O)[O-] MCULE-2773521709 [1,1,0,0,0,0|1,0,0]=3 1882 B5R0.5 CC(=O)C(=O)[O-] MCULE-7007482346 [1,1,0,0,0,0|1,0,0]=3 1883 B5R0.5 CC(=O)C(=O)[O-] MCULE-8344520452 [1,1,0,0,0,0|1,0,0]=3 1884 B5R0.5 CC(=O)C(=S)N MCULE-3142518834 [1,1,0,0,0,0|1,0,0]=3 1885 B5R0.5 CC(=O)C(C)Br MCULE-3764525199 [1,1,0,0,0,0|0,0,1]=3 1886 B5R0.5 CC(=O)C(C)C MCULE-5982732938 [1,1,0,0,0,0|0,0,1]=3 1887 B5R0.5 CC(=O)C(C)Cl MCULE-5065840606 [1,1,0,0,0,0|0,0,1]=3 1888 B5R0.5 CC(=O)C(C)F MCULE-2129925918 [1,1,0,0,0,0|0,0,1]=3 1889 B5R0.5 CC(=O)C(C)N MCULE-5716124999 [1,1,0,0,0,0|0,0,1]=3 1890 B5R0.5 CC(=O)C(C)N MCULE-9248002534 [1,1,0,0,0,0|0,0,1]=3 1891 B5R0.5 CC(=O)C(C)O MCULE-5374414264 [1,1,0,0,0,0|0,0,1]=3 1892 B5R0.5 CC(=O)C(C)S MCULE-2716722148 [1,1,0,0,0,0|0,0,1]=3 1893 B5R0.5 CC(=O)C(Cl)Cl MCULE-9043899746 [1,1,0,0,0,0|1,0,1]=4 1894 B5R0.5 CC(=O)C(F)F MCULE-9206168077 [1,1,0,0,0,0|1,0,1]=4 1895 B5R0.5 CC(=O)N(C)C MCULE-4256511309 [1,1,0,0,0,0|1,0,0]=3 1896 B5R0.5 CC(=O)N(C)N MCULE-2447375293 [1,1,0,0,0,0|1,0,0]=3 1897 B5R0.5 CC(=O)[C@H](C)N MCULE-2609095078 [1,1,0,0,0,0|0,0,1]=3 1898 B5R0.5 CC(=O)[C@H](C)N MCULE-6039921944 [1,1,0,0,0,0|0,0,1]=3 1899 B5R0.5 CC(=O)[C@H](C)N MCULE-6387613992 [1,1,0,0,0,0|0,0,1]=3 1900 B5R0.5 CC(=O)[C@H](C)N MCULE-7052375323 [1,1,0,0,0,0|0,0,1]=3 1901 B5R0.5 CC(=S)N(C)C MCULE-6797990305 [1,1,0,0,0,0|1,1,0]=4 1902 B5R0.5 CC(Br)C(=O)Br MCULE-2400047844 [1,1,0,0,0,0|1,0,1]=4 1903 B5R0.5 CC(Br)C(=O)Cl MCULE-7431871683 [1,1,0,0,0,0|1,0,1]=4 1904 B5R0.5 CC(Br)C(=O)N MCULE-9226586148 [1,1,0,0,0,0|1,0,1]=4 1905 B5R0.5 CC(Br)C(=O)O MCULE-3935837943 [1,1,0,0,0,0|1,0,1]=4 1906 B5R0.5 CC(Br)C(=O)O MCULE-6068441065 [1,1,0,0,0,0|1,0,1]=4 1907 B5R0.5 CC(C)C(=O)Br MCULE-3679003896 [1,1,0,0,0,0|1,0,1]=4 1908 B5R0.5 CC(C)C(=O)Cl MCULE-6582236331 [1,1,0,0,0,0|1,0,1]=4 1909 B5R0.5 CC(C)C(=O)N MCULE-9773835068 [1,1,0,0,0,0|1,0,1]=4 1910 B5R0.5 CC(C)C(=O)O MCULE-7783770647 [1,1,0,0,0,0|1,0,1]=4 1911 B5R0.5 CC(C)C(=O)S MCULE-9552406593 [1,1,0,0,0,0|1,0,1]=4 1912 B5R0.5 CC(Cl)C(=O)Cl MCULE-6547241717 [1,1,0,0,0,0|1,0,1]=4 1913 B5R0.5 CC(Cl)C(=O)N MCULE-5322078211 [1,1,0,0,0,0|1,0,1]=4 1914 B5R0.5 CC(Cl)C(=O)O MCULE-3597230803 [1,1,0,0,0,0|1,0,1]=4 1915 B5R0.5 CC(Cl)C(=O)O MCULE-5449120618 [1,1,0,0,0,0|1,0,1]=4 1916 B5R0.5 CC(F)C(=O)O MCULE-7334922730 [1,1,0,0,0,0|1,0,1]=4 1917 B5R0.5 CC(I)C(=O)N MCULE-8608495554 [1,1,0,0,0,0|1,0,1]=4 1918 B5R0.5 CC(N)C(=O)N MCULE-1264398810 [1,1,0,0,0,0|1,0,1]=4 1919 B5R0.5 CC(N)C(=O)N MCULE-2251123672 [1,1,0,0,0,0|1,0,1]=4 1920 B5R0.5 CC(N)C(=O)N MCULE-2273926073 [1,1,0,0,0,0|1,0,1]=4 1921 B5R0.5 CC(N)C(=O)N MCULE-5340923071 [1,1,0,0,0,0|1,0,1]=4 1922 B5R0.5 CC(N)C(=O)N MCULE-6061233032 [1,1,0,0,0,0|1,0,1]=4 1923 B5R0.5 CC(N)C(=O)N MCULE-9273221837 [1,1,0,0,0,0|1,0,1]=4 1924 B5R0.5 CC(N)C(=O)O MCULE-3498369789 [1,1,0,0,0,0|1,0,1]=4 1925 B5R0.5 CC(N)C(=O)O MCULE-3809839392 [1,1,0,0,0,0|1,0,1]=4 1926 B5R0.5 CC(N)C(=O)O MCULE-4751903561 [1,1,0,0,0,0|1,0,1]=4 1927 B5R0.5 CC(N)C(=O)O MCULE-6963397848 [1,1,0,0,0,0|1,0,1]=4 1928 B5R0.5 CC(O)C(=O)N MCULE-6247123668 [1,1,0,0,0,0|1,0,1]=4 1929 B5R0.5 CC(O)C(=O)N MCULE-7823792358 [1,1,0,0,0,0|1,0,1]=4 1930 B5R0.5 CC(O)C(=O)O MCULE-3922256529 [1,1,0,0,0,0|1,0,1]=4 1931 B5R0.5 CC(O)C(=O)O MCULE-5387110670 [1,1,0,0,0,0|1,0,1]=4 1932 B5R0.5 CC(O)C(=O)[O-] MCULE-1056716990 [1,1,0,0,0,0|1,0,1]=4 1933 B5R0.5 CC(O)C(=O)[O-] MCULE-8184872865 [1,1,0,0,0,0|1,0,1]=4 1934 B5R0.5 CC(O)C(=O)[O-] MCULE-8730993694 [1,1,0,0,0,0|1,0,1]=4 1935 B5R0.5 CC(S)C(=O)N MCULE-1465182001 [1,1,0,0,0,0|1,0,1]=4 1936 B5R0.5 CC(S)C(=O)O MCULE-6944738352 [1,1,0,0,0,0|1,0,1]=4 1937 B5R0.5 CN(C)C(=O)Cl MCULE-1738506605 [1,1,0,0,0,0|2,0,0]=4 1938 B5R0.5 CN(C)C(=O)N MCULE-3142720631 [1,1,0,0,0,0|2,0,0]=4 1939 B5R0.5 CN(C)C(=O)O MCULE-1039144559 [1,1,0,0,0,0|2,0,0]=4 1940 B5R0.5 CN(C)C(=O)[O-] MCULE-5405204721 [1,1,0,0,0,0|2,0,0]=4 1941 B5R0.5 CN(N)C(=O)N MCULE-9114734246 [1,1,0,0,0,0|2,0,0]=4 1942 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8303539222 [1,1,0,0,0,0|1,0,1]=4 1943 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8530283309 [1,1,0,0,0,0|1,0,1]=4 1944 B5R0.5 C[C@@H](Cl)C(=O)Cl MCULE-3579498695 [1,1,0,0,0,0|1,0,1]=4 1945 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-6578788045 [1,1,0,0,0,0|1,0,1]=4 1946 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-8314108697 [1,1,0,0,0,0|1,0,1]=4 1947 B5R0.5 C[C@@H](F)C(=O)N MCULE-1505685009 [1,1,0,0,0,0|1,0,1]=4 1948 B5R0.5 C[C@@H](N)C(=O)N MCULE-4677983549 [1,1,0,0,0,0|1,0,1]=4 1949 B5R0.5 C[C@@H](N)C(=O)N MCULE-6112443507 [1,1,0,0,0,0|1,0,1]=4 1950 B5R0.5 C[C@@H](N)C(=O)N MCULE-7940270709 [1,1,0,0,0,0|1,0,1]=4 1951 B5R0.5 C[C@@H](N)C(=O)N MCULE-8482332558 [1,1,0,0,0,0|1,0,1]=4 1952 B5R0.5 C[C@@H](N)C(=O)O MCULE-3571488623 [1,1,0,0,0,0|1,0,1]=4 1953 B5R0.5 C[C@@H](N)C(=O)O MCULE-9756365751 [1,1,0,0,0,0|1,0,1]=4 1954 B5R0.5 C[C@@H](O)C(=O)N MCULE-2026557726 [1,1,0,0,0,0|1,0,1]=4 1955 B5R0.5 C[C@@H](O)C(=O)N MCULE-8056291801 [1,1,0,0,0,0|1,0,1]=4 1956 B5R0.5 C[C@@H](O)C(=O)O MCULE-4625208788 [1,1,0,0,0,0|1,0,1]=4 1957 B5R0.5 C[C@@H](O)C(=O)O MCULE-9141235095 [1,1,0,0,0,0|1,0,1]=4 1958 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-5673591667 [1,1,0,0,0,0|1,0,1]=4 1959 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-8146434340 [1,1,0,0,0,0|1,0,1]=4 1960 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-9026662277 [1,1,0,0,0,0|1,0,1]=4 1961 B5R0.5 C[C@H](Br)C(=O)Cl MCULE-2960953088 [1,1,0,0,0,0|1,0,1]=4 1962 B5R0.5 C[C@H](Br)C(=O)O MCULE-4788730445 [1,1,0,0,0,0|1,0,1]=4 1963 B5R0.5 C[C@H](Br)C(=O)O MCULE-9354978281 [1,1,0,0,0,0|1,0,1]=4 1964 B5R0.5 C[C@H](Cl)C(=O)O MCULE-4816831649 [1,1,0,0,0,0|1,0,1]=4 1965 B5R0.5 C[C@H](Cl)C(=O)O MCULE-8389122613 [1,1,0,0,0,0|1,0,1]=4 1966 B5R0.5 C[C@H](F)C(=O)N MCULE-7457242428 [1,1,0,0,0,0|1,0,1]=4 1967 B5R0.5 C[C@H](N)C(=O)N MCULE-4716963408 [1,1,0,0,0,0|1,0,1]=4 1968 B5R0.5 C[C@H](N)C(=O)N MCULE-6879702251 [1,1,0,0,0,0|1,0,1]=4 1969 B5R0.5 C[C@H](N)C(=O)N MCULE-7090555441 [1,1,0,0,0,0|1,0,1]=4 1970 B5R0.5 C[C@H](N)C(=O)N MCULE-7293369315 [1,1,0,0,0,0|1,0,1]=4 1971 B5R0.5 C[C@H](N)C(=O)N MCULE-7341432132 [1,1,0,0,0,0|1,0,1]=4 1972 B5R0.5 C[C@H](N)C(=O)N MCULE-7556063213 [1,1,0,0,0,0|1,0,1]=4 1973 B5R0.5 C[C@H](N)C(=O)N MCULE-8320991932 [1,1,0,0,0,0|1,0,1]=4 1974 B5R0.5 C[C@H](N)C(=O)N MCULE-8491573930 [1,1,0,0,0,0|1,0,1]=4 1975 B5R0.5 C[C@H](N)C(=O)O MCULE-4916719758 [1,1,0,0,0,0|1,0,1]=4 1976 B5R0.5 C[C@H](N)C(=O)O MCULE-5261590548 [1,1,0,0,0,0|1,0,1]=4 1977 B5R0.5 C[C@H](N)C(=O)O MCULE-7791919887 [1,1,0,0,0,0|1,0,1]=4 1978 B5R0.5 C[C@H](N)C(=O)O MCULE-8724854497 [1,1,0,0,0,0|1,0,1]=4 1979 B5R0.5 C[C@H](O)C(=O)N MCULE-8400190365 [1,1,0,0,0,0|1,0,1]=4 1980 B5R0.5 C[C@H](O)C(=O)O MCULE-5695391344 [1,1,0,0,0,0|1,0,1]=4 1981 B5R0.5 C[C@H](O)C(=O)O MCULE-8864689875 [1,1,0,0,0,0|1,0,1]=4 1982 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-1034285072 [1,1,0,0,0,0|1,0,1]=4 1983 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-3598405830 [1,1,0,0,0,0|1,0,1]=4 1984 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-7525689298 [1,1,0,0,0,0|1,0,1]=4 1985 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8057429776 [1,1,0,0,0,0|1,0,1]=4 1986 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8729310894 [1,1,0,0,0,0|1,0,1]=4 1987 B5R0.5 NC(=O)C(=O)N MCULE-9024594322 [1,1,0,0,0,0|2,0,0]=4 1988 B5R0.5 NC(=O)C(=O)O MCULE-4442165428 [1,1,0,0,0,0|2,0,0]=4 1989 B5R0.5 NC(=O)C(=O)[O-] MCULE-6520154385 [1,1,0,0,0,0|2,0,0]=4 1990 B5R0.5 NC(=O)C(=O)[O-] MCULE-9489956613 [1,1,0,0,0,0|2,0,0]=4 1991 B5R0.5 O=C(Br)C(=O)Br MCULE-6502494359 [1,1,0,0,0,0|2,0,0]=4 1992 B5R0.5 O=C(Cl)C(=O)Cl MCULE-7263932124 [1,1,0,0,0,0|2,0,0]=4 1993 B5R0.5 O=C(O)C(=O)O MCULE-2859436444 [1,1,0,0,0,0|2,0,0]=4 1994 B5R0.5 O=C(O)C(=O)O MCULE-3054574273 [1,1,0,0,0,0|2,0,0]=4 1995 B5R0.5 O=C(O)C(=O)O MCULE-4285591204 [1,1,0,0,0,0|2,0,0]=4 1996 B5R0.5 O=C(O)C(=O)O MCULE-4461843798 [1,1,0,0,0,0|2,0,0]=4 1997 B5R0.5 O=C(O)C(=O)O MCULE-6031758101 [1,1,0,0,0,0|2,0,0]=4 1998 B5R0.5 O=C(O)C(=O)O MCULE-6647815245 [1,1,0,0,0,0|2,0,0]=4 1999 B5R0.5 O=C(O)C(=O)O MCULE-7895971003 [1,1,0,0,0,0|2,0,0]=4 2000 B5R0.5 O=C(O)C(=O)O MCULE-8046063377 [1,1,0,0,0,0|2,0,0]=4 2001 B5R0.5 O=C(O)C(=O)O MCULE-8198551041 [1,1,0,0,0,0|2,0,0]=4 2002 B5R0.5 O=C(O)C(=O)O MCULE-8472527874 [1,1,0,0,0,0|2,0,0]=4 2003 B5R0.5 O=C(O)C(=O)O MCULE-9701145416 [1,1,0,0,0,0|2,0,0]=4 2004 B5R0.5 O=C([O-])C(=O)[O-] MCULE-1850167183 [1,1,0,0,0,0|2,0,0]=4 2005 B5R0.5 O=C([O-])C(=O)[O-] MCULE-2102182772 [1,1,0,0,0,0|2,0,0]=4 2006 B5R0.5 O=C([O-])C(=O)[O-] MCULE-2594600365 [1,1,0,0,0,0|2,0,0]=4 2007 B5R0.5 O=C([O-])C(=O)[O-] MCULE-2876490980 [1,1,0,0,0,0|2,0,0]=4 2008 B5R0.5 O=C([O-])C(=O)[O-] MCULE-4875218588 [1,1,0,0,0,0|2,0,0]=4 2009 B5R0.5 O=C([O-])C(=O)[O-] MCULE-6598296804 [1,1,0,0,0,0|2,0,0]=4 2010 B5R0.5 O=C([O-])C(=O)[O-] MCULE-6729461006 [1,1,0,0,0,0|2,0,0]=4 2011 B5R0.5 O=C([O-])C(=O)[O-] MCULE-7607695802 [1,1,0,0,0,0|2,0,0]=4 2012 B5R0.5 [C@@H](C)(O)C(=O)N MCULE-6953360641 [1,1,0,0,0,0|1,0,1]=4 2013 B5R0.2 BrC/C=C/CBr MCULE-9004545331 [1,1,0,0,0,0|1,0,1]=4 2014 B5R0.2 BrCC=CCBr MCULE-4240565660 [1,1,0,0,0,0|1,0,1]=4 2015 B5R0.2 C(=CCCl)CN MCULE-8092426171 [1,1,0,0,0,0|1,0,1]=4 2016 B5R0.2 C(=CCCl)CN MCULE-9706120646 [1,1,0,0,0,0|1,0,1]=4 2017 B5R0.2 C(=C\CCl)\CN MCULE-3474871402 [1,1,0,0,0,0|1,0,1]=4 2018 B5R0.2 C/C=C/C=C/C MCULE-9400628806 [1,1,0,0,0,0|0,0,0]=2 2019 B5R0.2 C/C=C/CC#N MCULE-3707973146 [1,1,0,0,0,0|0,0,2]=4 2020 B5R0.2 C/C=C/CCC MCULE-9851656818 [1,1,0,0,0,0|0,0,1]=3 2021 B5R0.2 C/C=C/CCO MCULE-3952855392 [1,1,0,0,0,0|0,0,1]=3 2022 B5R0.2 C/C=C/OCC MCULE-2891896400 [1,1,0,0,0,0|0,0,1]=3 2023 B5R0.2 C/C=C\CCC MCULE-1013657748 [1,1,0,0,0,0|0,0,1]=3 2024 B5R0.2 C=C/C=C/C=C MCULE-2938938774 [1,1,0,0,0,0|0,0,2]=4 2025 B5R0.2 C=C/C=C/CC MCULE-5996202716 [1,1,0,0,0,0|0,0,1]=3 2026 B5R0.2 C=CC/C=C/C MCULE-8732875285 [1,1,0,0,0,0|0,0,1]=3 2027 B5R0.2 C=CCC=CC MCULE-8643449832 [1,1,0,0,0,0|0,0,1]=3 2028 B5R0.2 C=CCCC=O MCULE-7850336174 [1,1,0,0,0,0|0,0,2]=4 2029 B5R0.2 C=CCNC=O MCULE-1911798514 [1,1,0,0,0,0|0,0,2]=4 2030 B5R0.2 C=CCOC=O MCULE-4161785970 [1,1,0,0,0,0|0,0,2]=4 2031 B5R0.2 CC#CCC=O MCULE-6071390808 [1,1,0,0,0,0|0,0,2]=4 2032 B5R0.2 CC/C=C/C=O MCULE-5102906061 [1,1,0,0,0,0|0,0,0]=2 2033 B5R0.2 CC/C=C/CC MCULE-6762040186 [1,1,0,0,0,0|0,0,1]=3 2034 B5R0.2 CC/C=C\C#N MCULE-2648641382 [1,1,0,0,0,0|0,0,2]=4 2035 B5R0.2 CC/C=C\CC MCULE-9418110460 [1,1,0,0,0,0|0,0,1]=3 2036 B5R0.2 CC/C=C\CO MCULE-5480473249 [1,1,0,0,0,0|0,0,1]=3 2037 B5R0.2 CC=CC=CC MCULE-7702675183 [1,1,0,0,0,0|0,0,0]=2 2038 B5R0.2 CC=CCC#N MCULE-6960681395 [1,1,0,0,0,0|0,0,2]=4 2039 B5R0.2 CC=CCCBr MCULE-7329159278 [1,1,0,0,0,0|0,0,1]=3 2040 B5R0.2 CC=CCCC MCULE-8736231124 [1,1,0,0,0,0|0,0,1]=3 2041 B5R0.2 CC=CCCN MCULE-5129102475 [1,1,0,0,0,0|0,0,1]=3 2042 B5R0.2 CC=CCCN MCULE-8500001929 [1,1,0,0,0,0|0,0,1]=3 2043 B5R0.2 CC=CCCO MCULE-4302367089 [1,1,0,0,0,0|0,0,1]=3 2044 B5R0.2 CC=COCC MCULE-1473170404 [1,1,0,0,0,0|0,0,1]=3 2045 B5R0.2 CC=CSSC MCULE-2442770677 [1,1,0,0,0,0|1,0,0]=3 2046 B5R0.2 CCC#CC=O MCULE-3889262436 [1,1,0,0,0,0|0,0,2]=4 2047 B5R0.2 CCC=CC#N MCULE-1091834842 [1,1,0,0,0,0|0,0,2]=4 2048 B5R0.2 CCC=CC=O MCULE-1318250395 [1,1,0,0,0,0|0,0,0]=2 2049 B5R0.2 CCC=CCBr MCULE-5326763881 [1,1,0,0,0,0|0,0,1]=3 2050 B5R0.2 CCC=CCC MCULE-5435957422 [1,1,0,0,0,0|0,0,1]=3 2051 B5R0.2 CCC=CCO MCULE-5633399984 [1,1,0,0,0,0|0,0,1]=3 2052 B5R0.2 CCCCC=O MCULE-4736782822 [1,1,0,0,0,0|0,0,2]=4 2053 B5R0.2 CCCNC=O MCULE-6344556391 [1,1,0,0,0,0|0,0,2]=4 2054 B5R0.2 CCCOC=O MCULE-3133604529 [1,1,0,0,0,0|0,0,2]=4 2055 B5R0.2 CCO/C=C\Br MCULE-7396084973 [1,1,0,0,0,0|1,0,1]=4 2056 B5R0.2 CCOC=CBr MCULE-5241125671 [1,1,0,0,0,0|1,0,1]=4 2057 B5R0.2 CCSCC=O MCULE-8069035019 [1,1,0,0,0,0|0,0,2]=4 2058 B5R0.2 COC=CC#N MCULE-4212629233 [1,1,0,0,0,0|1,0,1]=4 2059 B5R0.2 COCCC=O MCULE-2812117208 [1,1,0,0,0,0|0,0,2]=4 2060 B5R0.2 CSCCC=O MCULE-6273241704 [1,1,0,0,0,0|0,0,2]=4 2061 B5R0.2 ClC/C=C/CCl MCULE-3586653669 [1,1,0,0,0,0|1,0,1]=4 2062 B5R0.2 ClC/C=C\CCl MCULE-9193094097 [1,1,0,0,0,0|1,0,1]=4 2063 B5R0.2 ClCC=CCCl MCULE-9190878082 [1,1,0,0,0,0|1,0,1]=4 2064 B5R0.2 N#CC=CCBr MCULE-2538176669 [1,1,0,0,0,0|1,0,1]=4 2065 B5R0.2 NC/C=C/CN MCULE-3194321905 [1,1,0,0,0,0|1,0,1]=4 2066 B5R0.2 NC/C=C/CN MCULE-8357316852 [1,1,0,0,0,0|1,0,1]=4 2067 B5R0.2 NC/C=C\CCl MCULE-7895966955 [1,1,0,0,0,0|1,0,1]=4 2068 B5R0.2 NC/C=C\CN MCULE-6310541400 [1,1,0,0,0,0|1,0,1]=4 2069 B5R0.2 NC/C=C\CN MCULE-8765736519 [1,1,0,0,0,0|1,0,1]=4 2070 B5R0.2 NCC=CCN MCULE-3768809289 [1,1,0,0,0,0|1,0,1]=4 2071 B5R0.2 NCC=CCN MCULE-4004493343 [1,1,0,0,0,0|1,0,1]=4 2072 B5R0.2 NCC=CCN MCULE-6780035248 [1,1,0,0,0,0|1,0,1]=4 2073 B5R0.2 NCC=CCO MCULE-4993379992 [1,1,0,0,0,0|0,0,2]=4 2074 B5R0.2 O=CCCC=O MCULE-3362810468 [1,1,0,0,0,0|1,0,1]=4 2075 B5R0.2 O=CCCC=O MCULE-3813951568 [1,1,0,0,0,0|1,0,1]=4 2076 B5R0.2 O=CCCCBr MCULE-7239613396 [1,1,0,0,0,0|0,0,2]=4 2077 B5R0.2 O=CCCCCl MCULE-3011225716 [1,1,0,0,0,0|0,0,2]=4 2078 B5R0.2 O=CCCCI MCULE-3153720790 [1,1,0,0,0,0|0,0,2]=4 2079 B5R0.2 O=CCCCO MCULE-8728420992 [1,1,0,0,0,0|0,0,2]=4 2080 B5R0.2 O=CNCCO MCULE-3688614090 [1,1,0,0,0,0|1,0,1]=4 2081 B5R0.2 O=CNNC=O MCULE-7634212643 [1,1,0,0,0,0|2,0,0]=4 2082 B5R0.2 O=COCCO MCULE-1922672843 [1,1,0,0,0,0|1,0,1]=4 2083 B5R0.2 OC/C=C/CCl MCULE-4378785113 [1,1,0,0,0,0|0,0,2]=4 2084 B5R0.2 OC/C=C/CO MCULE-4752272005 [1,1,0,0,0,0|0,0,2]=4 2085 B5R0.2 OC/C=C\CO MCULE-2695577582 [1,1,0,0,0,0|0,0,2]=4 2086 B5R0.2 OC=CCCBr MCULE-3964604828 [1,1,0,0,0,0|0,0,2]=4 2087 B5R0.2 OC=CCCBr MCULE-5728835735 [1,1,0,0,0,0|0,0,2]=4 2088 B5R0.2 OCC=CCCl MCULE-7597942117 [1,1,0,0,0,0|0,0,2]=4 2089 B5R0.2 OCC=CCO MCULE-9559211408 [1,1,0,0,0,0|0,0,2]=4 2090 B7R0.2 C/C(=C/N(C)C)/C=O MCULE-5191348171 [0,2,0,0,0,0|1,0,0]=3 2091 B7R0.2 C/C(=C\N(C)C)/C=O MCULE-4104391160 [0,2,0,0,0,0|1,0,0]=3 2092 B7R0.2 C=C(C#N)OC(=O)C MCULE-8738842712 [0,2,0,0,0,0|1,0,1]=4 2093 B7R0.2 C=CC(=O)C=C(C)C MCULE-3761351531 [0,2,0,0,0,0|0,0,1]=3 2094 B7R0.2 C=CC(=O)NC(=O)N MCULE-8826369233 [0,2,0,0,0,0|1,0,1]=4 2095 B7R0.2 C=CC(C)OC(=O)C MCULE-9221300039 [0,2,0,0,0,0|0,0,2]=4 2096 B7R0.2 CC(=CC(=O)O)C=O MCULE-7652207149 [0,2,0,0,0,0|1,0,0]=3 2097 B7R0.2 CC(=CN(C)C)C=O MCULE-6590049848 [0,2,0,0,0,0|1,0,0]=3 2098 B7R0.2 CC(=O)NC(=O)CBr MCULE-3222708274 [0,2,0,0,0,0|1,0,0]=3 2099 B7R0.2 CC(=O)NC(C)CN MCULE-4226474809 [0,2,0,0,0,0|1,0,1]=4 2100 B7R0.2 CC(=O)NC(C)CN MCULE-7570690280 [0,2,0,0,0,0|1,0,1]=4 2101 B7R0.2 CC(=O)NC(C)CO MCULE-9455210462 [0,2,0,0,0,0|1,0,1]=4 2102 B7R0.2 CC(=O)N[C@H](C)CO MCULE-2174899443 [0,2,0,0,0,0|1,0,1]=4 2103 B7R0.2 CC(=O)N[C@H](C)CO MCULE-5097293473 [0,2,0,0,0,0|1,0,1]=4 2104 B7R0.2 CC(=O)OC(Br)CBr MCULE-7215936142 [0,2,0,0,0,0|1,0,1]=4 2105 B7R0.2 CC(C)/C=C(\F)/CO MCULE-5089231546 [0,2,0,0,0,0|1,0,1]=4 2106 B7R0.2 CC(C)CC(=O)CBr MCULE-3556695745 [0,2,0,0,0,0|0,0,2]=4 2107 B7R0.2 CC(C)CC(=O)CCl MCULE-6858533367 [0,2,0,0,0,0|0,0,2]=4 2108 B7R0.2 CC(C)CC(=O)CN MCULE-2435223768 [0,2,0,0,0,0|0,0,2]=4 2109 B7R0.2 CC(C)CC(=O)CN MCULE-7131454463 [0,2,0,0,0,0|0,0,2]=4 2110 B7R0.2 CC(C)NC(=O)CBr MCULE-1272363222 [0,2,0,0,0,0|1,0,1]=4 2111 B7R0.2 CC(C)NC(=O)CCl MCULE-8342964960 [0,2,0,0,0,0|1,0,1]=4 2112 B7R0.2 CC(C)NC(=O)CI MCULE-8316056040 [0,2,0,0,0,0|1,0,1]=4 2113 B7R0.2 CC(C)NC(=O)CN MCULE-7188824856 [0,2,0,0,0,0|1,0,1]=4 2114 B7R0.2 CC(C)NC(=O)CN MCULE-8867435369 [0,2,0,0,0,0|1,0,1]=4 2115 B7R0.2 CC(C)NC(=O)CO MCULE-5386700783 [0,2,0,0,0,0|1,0,1]=4 2116 B7R0.2 CC(C)OC(=O)CBr MCULE-1610339208 [0,2,0,0,0,0|1,0,1]=4 2117 B7R0.2 CC(C)OC(=O)CCl MCULE-3017211046 [0,2,0,0,0,0|1,0,1]=4 2118 B7R0.2 CC(C)OC(=O)CN MCULE-4475626262 [0,2,0,0,0,0|1,0,1]=4 2119 B7R0.2 CC(C)OC(=O)CN MCULE-5696337645 [0,2,0,0,0,0|1,0,1]=4 2120 B7R0.2 CC(C)OC(=O)CO MCULE-4694316703 [0,2,0,0,0,0|1,0,1]=4 2121 B7R0.2 CC(C)OC(=O)CS MCULE-5298940210 [0,2,0,0,0,0|1,0,1]=4 2122 B7R0.2 CCC(=CC(=O)O)C MCULE-3864767099 [0,2,0,0,0,0|1,0,0]=3 2123 B7R0.2 CCC(=CC(C)C)C MCULE-7337557698 [0,2,0,0,0,0|1,0,1]=4 2124 B7R0.2 CCC(=O)CC(=O)C MCULE-1892470405 [0,2,0,0,0,0|0,0,1]=3 2125 B7R0.2 CCC(=O)CC(=O)O MCULE-1083768149 [0,2,0,0,0,0|1,0,1]=4 2126 B7R0.2 CCC(=O)CC(C)C MCULE-8378320990 [0,2,0,0,0,0|0,0,2]=4 2127 B7R0.2 CCC(=O)NC(=S)N MCULE-7487842736 [0,2,0,0,0,0|2,0,0]=4 2128 B7R0.2 CCC(=O)NC(C)C MCULE-3565002235 [0,2,0,0,0,0|1,0,1]=4 2129 B7R0.2 CCC(=O)OC(=O)C MCULE-8264492254 [0,2,0,0,0,0|0,0,1]=3 2130 B7R0.2 CCC(=O)OC(C)C MCULE-6546381101 [0,2,0,0,0,0|1,0,1]=4 2131 B7R0.2 CCC(C)CC(=O)C MCULE-5801548800 [0,2,0,0,0,0|0,0,2]=4 2132 B7R0.2 CCC(C)OC(=O)C MCULE-8410375215 [0,2,0,0,0,0|0,0,2]=4 2133 B7R0.2 CCC(O)CC(=O)C MCULE-1222748729 [0,2,0,0,0,0|0,0,2]=4 2134 B7R0.2 CCN(C)CC(=O)C MCULE-5302720081 [0,2,0,0,0,0|0,0,2]=4 2135 B7R0.2 CCN(C)CC(=O)C MCULE-7283054437 [0,2,0,0,0,0|0,0,2]=4 2136 B7R0.2 CN(C)C=C(Br)C=O MCULE-6219650032 [0,2,0,0,0,0|2,0,0]=4 2137 B7R0.2 CN(C)C=C(F)C=O MCULE-7113199029 [0,2,0,0,0,0|2,0,0]=4 2138 B7R0.2 CN(C)C=C(I)C=O MCULE-5701724761 [0,2,0,0,0,0|2,0,0]=4 2139 B7R0.2 CNC(=CC(=O)C)C MCULE-1943688292 [0,2,0,0,0,0|0,0,0]=2 2140 B7R0.2 CNC(=C[N+](=O)[O-])N MCULE-4229797824 [0,2,0,0,0,0|2,0,0]=4 2141 B7R0.2 CNC(=O)CC(=N)N MCULE-4798896062 [0,2,0,0,0,0|1,0,1]=4 2142 B7R0.2 CNC(=O)CC(=N)N MCULE-6994336455 [0,2,0,0,0,0|1,0,1]=4 2143 B7R0.2 CNC(=O)CC(=O)C MCULE-4316009681 [0,2,0,0,0,0|0,0,1]=3 2144 B7R0.2 CNC(=O)CC(=O)O MCULE-3506871336 [0,2,0,0,0,0|1,0,1]=4 2145 B7R0.2 CNC(=O)CC(=S)N MCULE-1637389152 [0,2,0,0,0,0|1,0,1]=4 2146 B7R0.2 CNC(=O)CC(C)C MCULE-2303112628 [0,2,0,0,0,0|0,0,2]=4 2147 B7R0.2 CNC(=O)CC(C)N MCULE-7773306348 [0,2,0,0,0,0|0,0,2]=4 2148 B7R0.2 CNC(=O)CC(C)N MCULE-8658175271 [0,2,0,0,0,0|0,0,2]=4 2149 B7R0.2 CNC(=O)NC(=O)C MCULE-9100713966 [0,2,0,0,0,0|1,0,0]=3 2150 B7R0.2 CNC(=O)NC(=O)N MCULE-8107942434 [0,2,0,0,0,0|2,0,0]=4 2151 B7R0.2 CO/C(=C/C(=O)O)/C MCULE-5031076713 [0,2,0,0,0,0|1,0,0]=3 2152 B7R0.2 COC(=CC(=O)C)C MCULE-1939113485 [0,2,0,0,0,0|0,0,0]=2 2153 B7R0.2 COC(=CC(=O)O)C MCULE-2215306459 [0,2,0,0,0,0|1,0,0]=3 2154 B7R0.2 COC(=O)/C=C(/C)\N MCULE-2378404457 [0,2,0,0,0,0|0,0,0]=2 2155 B7R0.2 COC(=O)/C=C(\C)/N MCULE-7223502425 [0,2,0,0,0,0|0,0,0]=2 2156 B7R0.2 COC(=O)C=C(C)C MCULE-9357284649 [0,2,0,0,0,0|0,0,0]=2 2157 B7R0.2 COC(=O)C=C(C)N MCULE-8452012306 [0,2,0,0,0,0|0,0,0]=2 2158 B7R0.2 COC(=O)C=C(C)[O-] MCULE-2706789496 [0,2,0,0,0,0|0,0,0]=2 2159 B7R0.2 COC(=O)C=C(C)[O-] MCULE-4482386969 [0,2,0,0,0,0|0,0,0]=2 2160 B7R0.2 COC(=O)CC(=N)N MCULE-3622266378 [0,2,0,0,0,0|1,0,1]=4 2161 B7R0.2 COC(=O)CC(=N)N MCULE-8717458518 [0,2,0,0,0,0|1,0,1]=4 2162 B7R0.2 COC(=O)CC(=O)C MCULE-1265364784 [0,2,0,0,0,0|0,0,1]=3 2163 B7R0.2 COC(=O)CC(=O)Cl MCULE-5016603273 [0,2,0,0,0,0|1,0,1]=4 2164 B7R0.2 COC(=O)CC(=O)N MCULE-7129379910 [0,2,0,0,0,0|1,0,1]=4 2165 B7R0.2 COC(=O)CC(=O)O MCULE-7983457925 [0,2,0,0,0,0|1,0,1]=4 2166 B7R0.2 COC(=O)CC(=O)[O-] MCULE-4316322156 [0,2,0,0,0,0|1,0,1]=4 2167 B7R0.2 COC(=O)CC(=S)N MCULE-3325362226 [0,2,0,0,0,0|1,0,1]=4 2168 B7R0.2 COC(=O)CC(C)Br MCULE-4193147778 [0,2,0,0,0,0|0,0,2]=4 2169 B7R0.2 COC(=O)CC(C)C MCULE-2808202854 [0,2,0,0,0,0|0,0,2]=4 2170 B7R0.2 COC(=O)CC(C)Cl MCULE-2734734940 [0,2,0,0,0,0|0,0,2]=4 2171 B7R0.2 COC(=O)CC(C)N MCULE-2402304310 [0,2,0,0,0,0|0,0,2]=4 2172 B7R0.2 COC(=O)CC(C)N MCULE-3520358398 [0,2,0,0,0,0|0,0,2]=4 2173 B7R0.2 COC(=O)CC(C)N MCULE-4044567169 [0,2,0,0,0,0|0,0,2]=4 2174 B7R0.2 COC(=O)CC(C)N MCULE-5962991844 [0,2,0,0,0,0|0,0,2]=4 2175 B7R0.2 COC(=O)CC(C)O MCULE-7542131760 [0,2,0,0,0,0|0,0,2]=4 2176 B7R0.2 COC(=O)CC(C)O MCULE-7559608260 [0,2,0,0,0,0|0,0,2]=4 2177 B7R0.2 COC(=O)CC(C)S MCULE-8423856471 [0,2,0,0,0,0|0,0,2]=4 2178 B7R0.2 COC(=O)CN(C)C MCULE-2035644817 [0,2,0,0,0,0|1,0,1]=4 2179 B7R0.2 COC(=O)CN(C)C MCULE-2356820620 [0,2,0,0,0,0|1,0,1]=4 2180 B7R0.2 COC(=O)CS(=O)C MCULE-6286293391 [0,2,0,0,0,0|1,0,1]=4 2181 B7R0.2 COC(=O)C[C@@H](C)N MCULE-1483636974 [0,2,0,0,0,0|0,0,2]=4 2182 B7R0.2 COC(=O)C[C@@H](C)N MCULE-4260923997 [0,2,0,0,0,0|0,0,2]=4 2183 B7R0.2 COC(=O)C[C@@H](C)N MCULE-6569883717 [0,2,0,0,0,0|0,0,2]=4 2184 B7R0.2 COC(=O)C[C@@H](C)N MCULE-9853158708 [0,2,0,0,0,0|0,0,2]=4 2185 B7R0.2 COC(=O)C[C@@H](C)O MCULE-1647366037 [0,2,0,0,0,0|0,0,2]=4 2186 B7R0.2 COC(=O)C[C@@H](C)O MCULE-7832771936 [0,2,0,0,0,0|0,0,2]=4 2187 B7R0.2 COC(=O)C[C@H](C)N MCULE-1385999778 [0,2,0,0,0,0|0,0,2]=4 2188 B7R0.2 COC(=O)C[C@H](C)N MCULE-1446150641 [0,2,0,0,0,0|0,0,2]=4 2189 B7R0.2 COC(=O)C[C@H](C)N MCULE-2979603570 [0,2,0,0,0,0|0,0,2]=4 2190 B7R0.2 COC(=O)C[C@H](C)N MCULE-7679126750 [0,2,0,0,0,0|0,0,2]=4 2191 B7R0.2 COC(=O)C[C@H](C)O MCULE-5154734951 [0,2,0,0,0,0|0,0,2]=4 2192 B7R0.2 COC(=O)C[C@H](C)O MCULE-7031738180 [0,2,0,0,0,0|0,0,2]=4 2193 B7R0.2 COC(=O)NC(C)C MCULE-4552685948 [0,2,0,0,0,0|1,0,1]=4 2194 B7R0.2 COC(=O)OC(C)C MCULE-4462394604 [0,2,0,0,0,0|1,0,1]=4 2195 B7R0.2 COC(=O)SC(C)C MCULE-9908884347 [0,2,0,0,0,0|1,0,1]=4 2196 B7R0.2 CSC(=O)CC(C)C MCULE-5433173038 [0,2,0,0,0,0|0,0,2]=4 2197 B7R0.2 N=C(N)NC(=O)CO MCULE-1435627041 [0,2,0,0,0,0|2,0,0]=4 2198 B7R0.2 NC(=O)NC(=O)CBr MCULE-4561848957 [0,2,0,0,0,0|2,0,0]=4 2199 B7R0.2 NC(=O)NC(=O)CCl MCULE-6047100495 [0,2,0,0,0,0|2,0,0]=4 2200 B7R0.2 O=C(Br)CC(=O)CBr MCULE-5776576043 [0,2,0,0,0,0|1,0,1]=4 2201 B7R0.2 O=C(C=C(Cl)Cl)CCl MCULE-5580104687 [0,2,0,0,0,0|1,0,0]=3 2202 B7R0.2 O=C(Cl)CC(=O)CCl MCULE-6416318811 [0,2,0,0,0,0|1,0,1]=4 2203 B7R0.2 O=C(O)CC(=O)CCl MCULE-9671015150 [0,2,0,0,0,0|1,0,1]=4 2204 B7R0.2 O=C(O)CC(=O)CO MCULE-2224143705 [0,2,0,0,0,0|1,0,1]=4 2205 B7R0.3 C/C=C/CC(=O)OC MCULE-7204157194 [0,2,0,0,0,0|0,0,0]=2 2206 B7R0.3 C=CC=CC(=O)OC MCULE-1940821537 [0,2,0,0,0,0|0,0,1]=3 2207 B7R0.3 C=CCCC(=O)CBr MCULE-8443541398 [0,2,0,0,0,0|0,0,2]=4 2208 B7R0.3 C=CCCC(=O)CC MCULE-7933484898 [0,2,0,0,0,0|0,0,2]=4 2209 B7R0.3 C=CCCC(=O)CCl MCULE-4669619111 [0,2,0,0,0,0|0,0,2]=4 2210 B7R0.3 C=CCCC(=O)NC MCULE-9859680580 [0,2,0,0,0,0|0,0,2]=4 2211 B7R0.3 C=CCCC(=O)OC MCULE-8671478952 [0,2,0,0,0,0|0,0,2]=4 2212 B7R0.3 C=CCNC(=O)CBr MCULE-5894560132 [0,2,0,0,0,0|0,0,2]=4 2213 B7R0.3 C=CCNC(=O)CCl MCULE-4830676670 [0,2,0,0,0,0|0,0,2]=4 2214 B7R0.3 C=CCNC(=O)CN MCULE-8221456161 [0,2,0,0,0,0|0,0,2]=4 2215 B7R0.3 C=CCNC(=O)CN MCULE-9764331326 [0,2,0,0,0,0|0,0,2]=4 2216 B7R0.3 C=CCNC(=O)CO MCULE-1240234665 [0,2,0,0,0,0|0,0,2]=4 2217 B7R0.3 C=CCNC(=O)CS MCULE-1040670812 [0,2,0,0,0,0|0,0,2]=4 2218 B7R0.3 C=CCOC(=O)CBr MCULE-1915528510 [0,2,0,0,0,0|0,0,2]=4 2219 B7R0.3 C=CCOC(=O)CCl MCULE-4722834512 [0,2,0,0,0,0|0,0,2]=4 2220 B7R0.3 C=CCOC(=O)CI MCULE-1155914135 [0,2,0,0,0,0|0,0,2]=4 2221 B7R0.3 C=CCOC(=O)CN MCULE-2053601318 [0,2,0,0,0,0|0,0,2]=4 2222 B7R0.3 C=CCOC(=O)CN MCULE-8513191813 [0,2,0,0,0,0|0,0,2]=4 2223 B7R0.3 C=CCOC(=O)CS MCULE-3191036289 [0,2,0,0,0,0|0,0,2]=4 2224 B7R0.3 C=CCOC(=O)OC MCULE-9416609870 [0,2,0,0,0,0|0,0,2]=4 2225 B7R0.3 CC#CCC(=O)OC MCULE-4727663716 [0,2,0,0,0,0|0,0,2]=4 2226 B7R0.3 CC/C=C/C(=O)OC MCULE-5661442711 [0,2,0,0,0,0|0,0,0]=2 2227 B7R0.3 CC/C=C/C(C)CC MCULE-2438890702 [0,2,0,0,0,0|1,0,1]=4 2228 B7R0.3 CC=C(C)C=NNC MCULE-5058431186 [0,2,0,0,0,0|2,0,0]=4 2229 B7R0.3 CC=CCC(=O)OC MCULE-9658428283 [0,2,0,0,0,0|0,0,0]=2 2230 B7R0.3 CC=CCC(C)CC MCULE-4817855750 [0,2,0,0,0,0|1,0,1]=4 2231 B7R0.3 CC=NNC(=S)NC MCULE-3608462649 [0,2,0,0,0,0|1,1,0]=4 2232 B7R0.3 CCC(=O)/C=C/C=O MCULE-5654548275 [0,2,0,0,0,0|0,0,1]=3 2233 B7R0.3 CCC(=O)C=CC=O MCULE-8246295239 [0,2,0,0,0,0|0,0,1]=3 2234 B7R0.3 CCC(=O)CCCBr MCULE-3298679210 [0,2,0,0,0,0|0,0,2]=4 2235 B7R0.3 CCC(=O)CCCCl MCULE-3397599793 [0,2,0,0,0,0|0,0,2]=4 2236 B7R0.3 CCC(=O)NCCN MCULE-3384406070 [0,2,0,0,0,0|1,0,1]=4 2237 B7R0.3 CCC(=O)NCCN MCULE-3992696592 [0,2,0,0,0,0|1,0,1]=4 2238 B7R0.3 CCC(=O)NCCN MCULE-4556462042 [0,2,0,0,0,0|1,0,1]=4 2239 B7R0.3 CCC(=O)NCCO MCULE-7351790148 [0,2,0,0,0,0|1,0,1]=4 2240 B7R0.3 CCC(=O)OCCCl MCULE-7825392065 [0,2,0,0,0,0|1,0,1]=4 2241 B7R0.3 CCC(=O)OCCO MCULE-6019276519 [0,2,0,0,0,0|1,0,1]=4 2242 B7R0.3 CCC(=O)OCOC MCULE-8101176829 [0,2,0,0,0,0|1,0,1]=4 2243 B7R0.3 CCC=CC(=O)OC MCULE-2390679048 [0,2,0,0,0,0|0,0,0]=2 2244 B7R0.3 CCC=CC(C)CC MCULE-8910467842 [0,2,0,0,0,0|1,0,1]=4 2245 B7R0.3 CCCC=C(C)CC MCULE-4699949699 [0,2,0,0,0,0|1,0,1]=4 2246 B7R0.3 CCCCC(=O)CBr MCULE-5866288227 [0,2,0,0,0,0|0,0,2]=4 2247 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [0,2,0,0,0,0|0,0,2]=4 2248 B7R0.3 CCCCC(=O)CCl MCULE-9673190063 [0,2,0,0,0,0|0,0,2]=4 2249 B7R0.3 CCCCC(=O)NC MCULE-6810865419 [0,2,0,0,0,0|0,0,2]=4 2250 B7R0.3 CCCCC(=O)OC MCULE-8635651818 [0,2,0,0,0,0|0,0,2]=4 2251 B7R0.3 CCCNC(=O)CBr MCULE-3357000060 [0,2,0,0,0,0|0,0,2]=4 2252 B7R0.3 CCCNC(=O)CCl MCULE-3171078913 [0,2,0,0,0,0|0,0,2]=4 2253 B7R0.3 CCCNC(=O)CN MCULE-2964958967 [0,2,0,0,0,0|0,0,2]=4 2254 B7R0.3 CCCNC(=O)CN MCULE-4880764199 [0,2,0,0,0,0|0,0,2]=4 2255 B7R0.3 CCCOC(=O)CBr MCULE-9392658897 [0,2,0,0,0,0|0,0,2]=4 2256 B7R0.3 CCCOC(=O)CC MCULE-2749425161 [0,2,0,0,0,0|0,0,2]=4 2257 B7R0.3 CCCOC(=O)CCl MCULE-4900509903 [0,2,0,0,0,0|0,0,2]=4 2258 B7R0.3 CCCOC(=O)CN MCULE-5016724090 [0,2,0,0,0,0|0,0,2]=4 2259 B7R0.3 CCCOC(=O)CN MCULE-9899563764 [0,2,0,0,0,0|0,0,2]=4 2260 B7R0.3 CCCOC(=O)CS MCULE-7918412380 [0,2,0,0,0,0|0,0,2]=4 2261 B7R0.3 CCCOC(=O)OC MCULE-7254829881 [0,2,0,0,0,0|0,0,2]=4 2262 B7R0.3 CCNCC(=O)NC MCULE-6292959559 [0,2,0,0,0,0|0,0,2]=4 2263 B7R0.3 CCNCC(=O)OC MCULE-7988488004 [0,2,0,0,0,0|0,0,2]=4 2264 B7R0.3 CCNCC(=O)OC MCULE-9483901468 [0,2,0,0,0,0|0,0,2]=4 2265 B7R0.3 CCO/C=C(/C)\C=O MCULE-3167895853 [0,2,0,0,0,0|0,0,1]=3 2266 B7R0.3 CCO/C=C(\C)/C=O MCULE-5904529641 [0,2,0,0,0,0|0,0,1]=3 2267 B7R0.3 CCOC=C(C)C=O MCULE-8349392891 [0,2,0,0,0,0|0,0,1]=3 2268 B7R0.3 CCOCC(=O)CCl MCULE-3495077500 [0,2,0,0,0,0|0,0,2]=4 2269 B7R0.3 CCOCC(=O)OC MCULE-5158396979 [0,2,0,0,0,0|0,0,2]=4 2270 B7R0.3 CCONC(=O)CN MCULE-8014418978 [0,2,0,0,0,0|1,0,1]=4 2271 B7R0.3 CCONC(=O)CN MCULE-9229677559 [0,2,0,0,0,0|1,0,1]=4 2272 B7R0.3 CCSCC(=O)OC MCULE-2538182357 [0,2,0,0,0,0|0,0,2]=4 2273 B7R0.3 CNC(=O)C=CCN MCULE-3646722223 [0,2,0,0,0,0|0,0,0]=2 2274 B7R0.3 CNC(=O)C=CCN MCULE-6988679780 [0,2,0,0,0,0|0,0,0]=2 2275 B7R0.3 CNC(=O)CCCCl MCULE-9460684794 [0,2,0,0,0,0|0,0,2]=4 2276 B7R0.3 CNC(=O)CCCN MCULE-4766031038 [0,2,0,0,0,0|0,0,2]=4 2277 B7R0.3 CNC(=O)CCCN MCULE-8992476653 [0,2,0,0,0,0|0,0,2]=4 2278 B7R0.3 CNC(=O)CCCO MCULE-2592655912 [0,2,0,0,0,0|0,0,2]=4 2279 B7R0.3 CNC(=O)CCOC MCULE-1263122933 [0,2,0,0,0,0|0,0,2]=4 2280 B7R0.3 CNC(=O)NCCN MCULE-4075769099 [0,2,0,0,0,0|1,0,1]=4 2281 B7R0.3 CNC(=O)NCCN MCULE-9668937902 [0,2,0,0,0,0|1,0,1]=4 2282 B7R0.3 CNC(=O)NCCO MCULE-7936045962 [0,2,0,0,0,0|1,0,1]=4 2283 B7R0.3 CNC(=O)OCCCl MCULE-9946450406 [0,2,0,0,0,0|1,0,1]=4 2284 B7R0.3 CNC(=O)OCCO MCULE-7181085118 [0,2,0,0,0,0|1,0,1]=4 2285 B7R0.3 CNCCC(=O)NC MCULE-1793457920 [0,2,0,0,0,0|0,0,2]=4 2286 B7R0.3 CNCCC(=O)NC MCULE-7089073664 [0,2,0,0,0,0|0,0,2]=4 2287 B7R0.3 CNCCC(=O)OC MCULE-5657949377 [0,2,0,0,0,0|0,0,2]=4 2288 B7R0.3 CNCCC(=O)OC MCULE-9145127599 [0,2,0,0,0,0|0,0,2]=4 2289 B7R0.3 CNOCC(=O)OC MCULE-1491246414 [0,2,0,0,0,0|1,0,1]=4 2290 B7R0.3 CNOCC(=O)OC MCULE-2119135006 [0,2,0,0,0,0|1,0,1]=4 2291 B7R0.3 CO/C=C/C(=O)OC MCULE-8858181328 [0,2,0,0,0,0|0,0,0]=2 2292 B7R0.3 COC(=O)/C=C/CBr MCULE-5511432414 [0,2,0,0,0,0|0,0,0]=2 2293 B7R0.3 COC(=O)/C=C/CN MCULE-6249542756 [0,2,0,0,0,0|0,0,0]=2 2294 B7R0.3 COC(=O)/C=C/CN MCULE-7014993899 [0,2,0,0,0,0|0,0,0]=2 2295 B7R0.3 COC(=O)/C=C\CBr MCULE-5925439397 [0,2,0,0,0,0|0,0,0]=2 2296 B7R0.3 COC(=O)C#CCN MCULE-5567960811 [0,2,0,0,0,0|0,0,2]=4 2297 B7R0.3 COC(=O)C#CCN MCULE-9518684465 [0,2,0,0,0,0|0,0,2]=4 2298 B7R0.3 COC(=O)C#CCO MCULE-5683806193 [0,2,0,0,0,0|0,0,2]=4 2299 B7R0.3 COC(=O)C=CC=O MCULE-3663456611 [0,2,0,0,0,0|0,0,1]=3 2300 B7R0.3 COC(=O)C=CCBr MCULE-1558782396 [0,2,0,0,0,0|0,0,0]=2 2301 B7R0.3 COC(=O)C=CCN MCULE-4573398613 [0,2,0,0,0,0|0,0,0]=2 2302 B7R0.3 COC(=O)C=CCN MCULE-4807348004 [0,2,0,0,0,0|0,0,0]=2 2303 B7R0.3 COC(=O)C=CCN MCULE-7751483147 [0,2,0,0,0,0|0,0,0]=2 2304 B7R0.3 COC(=O)CCC=O MCULE-2572188002 [0,2,0,0,0,0|1,0,1]=4 2305 B7R0.3 COC(=O)CCCBr MCULE-3856139347 [0,2,0,0,0,0|0,0,2]=4 2306 B7R0.3 COC(=O)CCCCl MCULE-9725150748 [0,2,0,0,0,0|0,0,2]=4 2307 B7R0.3 COC(=O)CCCI MCULE-6607823615 [0,2,0,0,0,0|0,0,2]=4 2308 B7R0.3 COC(=O)CCCN MCULE-2399653885 [0,2,0,0,0,0|0,0,2]=4 2309 B7R0.3 COC(=O)CCCN MCULE-7745643244 [0,2,0,0,0,0|0,0,2]=4 2310 B7R0.3 COC(=O)CCCO MCULE-6149839873 [0,2,0,0,0,0|0,0,2]=4 2311 B7R0.3 COC(=O)CCCS MCULE-6897052882 [0,2,0,0,0,0|0,0,2]=4 2312 B7R0.3 COC(=O)CCSC MCULE-8525618169 [0,2,0,0,0,0|0,0,2]=4 2313 B7R0.3 COC(=O)CNC=O MCULE-1485317532 [0,2,0,0,0,0|1,0,1]=4 2314 B7R0.3 COC(=O)NCCN MCULE-4816806580 [0,2,0,0,0,0|1,0,1]=4 2315 B7R0.3 COC(=O)NCCN MCULE-9765640123 [0,2,0,0,0,0|1,0,1]=4 2316 B7R0.3 COC(=O)NCCO MCULE-7141835204 [0,2,0,0,0,0|1,0,1]=4 2317 B7R0.3 COC=CC(=O)OC MCULE-3167643214 [0,2,0,0,0,0|0,0,0]=2 2318 B7R0.3 COCCC(=O)CCl MCULE-2918704994 [0,2,0,0,0,0|0,0,2]=4 2319 B7R0.3 COCCC(=O)OC MCULE-5918489580 [0,2,0,0,0,0|0,0,2]=4 2320 B7R0.3 NCC(=O)NCCF MCULE-1969796129 [0,2,0,0,0,0|1,0,1]=4 2321 B7R0.3 NCC(=O)NCCF MCULE-9924478230 [0,2,0,0,0,0|1,0,1]=4 2322 B7R0.3 NCC(=O)NCCO MCULE-3809178129 [0,2,0,0,0,0|1,0,1]=4 2323 B7R0.3 NCC(=O)NCCO MCULE-7057019123 [0,2,0,0,0,0|1,0,1]=4 2324 B7R0.3 NCC(=O)OCCCl MCULE-7924059164 [0,2,0,0,0,0|1,0,1]=4 2325 B7R0.3 NCC(=O)OCCCl MCULE-9260214783 [0,2,0,0,0,0|1,0,1]=4 2326 B7R0.3 NCCNC(=O)CCl MCULE-6059411085 [0,2,0,0,0,0|1,0,1]=4 2327 B7R0.3 NCCNC(=O)CCl MCULE-7545329795 [0,2,0,0,0,0|1,0,1]=4 2328 B7R0.3 O=C(CCl)/N=C/NO MCULE-8588086105 [0,2,0,0,0,0|2,0,0]=4 2329 B7R0.3 O=C(CCl)CCCCl MCULE-2362491395 [0,2,0,0,0,0|0,0,2]=4 2330 B7R0.3 O=C(CCl)NCCCl MCULE-2029189763 [0,2,0,0,0,0|1,0,1]=4 2331 B7R0.3 O=C(CCl)NCCO MCULE-2803332455 [0,2,0,0,0,0|1,0,1]=4 2332 B7R0.3 O=C(CCl)OCCCl MCULE-7706105725 [0,2,0,0,0,0|1,0,1]=4 2333 B7R0.3 O=C(CO)NCCO MCULE-8933511918 [0,2,0,0,0,0|1,0,1]=4 2334 B7R0.5 C=C(C)C(=O)NCO MCULE-2758821094 [0,2,0,0,0,0|2,0,0]=4 2335 B7R0.5 C=C(C)C(=O)OCC MCULE-9496497565 [0,2,0,0,0,0|1,0,1]=4 2336 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [0,2,0,0,0,0|1,0,1]=4 2337 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [0,2,0,0,0,0|1,0,1]=4 2338 B7R0.5 C=C(COC)C(=O)O MCULE-8964616960 [0,2,0,0,0,0|1,0,1]=4 2339 B7R0.5 C=CC=C(C)C(=O)O MCULE-9568360048 [0,2,0,0,0,0|0,0,1]=3 2340 B7R0.5 C=CCC(C)C(=O)C MCULE-4395269639 [0,2,0,0,0,0|0,0,2]=4 2341 B7R0.5 C=COC(=O)C(=C)C MCULE-3204745409 [0,2,0,0,0,0|1,0,1]=4 2342 B7R0.5 CC(=O)C(C)CCBr MCULE-4705039689 [0,2,0,0,0,0|0,0,2]=4 2343 B7R0.5 CC(=O)C(C)CCCl MCULE-2960091698 [0,2,0,0,0,0|0,0,2]=4 2344 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [0,2,0,0,0,0|0,0,2]=4 2345 B7R0.5 CC(=O)C(Cl)CCCl MCULE-4634341484 [0,2,0,0,0,0|0,0,2]=4 2346 B7R0.5 CC(=O)C(Cl)CCO MCULE-1606704903 [0,2,0,0,0,0|0,0,2]=4 2347 B7R0.5 CC(=O)N(C)CCN MCULE-3153405152 [0,2,0,0,0,0|1,0,1]=4 2348 B7R0.5 CC(=O)N(C)CCN MCULE-4043248689 [0,2,0,0,0,0|1,0,1]=4 2349 B7R0.5 CC(=O)N(C)CCO MCULE-4135818139 [0,2,0,0,0,0|1,0,1]=4 2350 B7R0.5 CC/C=C(\C)/C(=O)O MCULE-1290613859 [0,2,0,0,0,0|0,0,1]=3 2351 B7R0.5 CC=CC(C)C(=O)O MCULE-5584906296 [0,2,0,0,0,0|0,0,1]=3 2352 B7R0.5 CC=CC(O)C(=O)O MCULE-5249095255 [0,2,0,0,0,0|1,0,0]=3 2353 B7R0.5 CCC=C(C)C(=O)O MCULE-5045441145 [0,2,0,0,0,0|0,0,1]=3 2354 B7R0.5 CCC=C(F)C(=O)O MCULE-6630499680 [0,2,0,0,0,0|1,0,0]=3 2355 B7R0.5 CCCC(=O)C(=O)C MCULE-8267463586 [0,2,0,0,0,0|0,0,1]=3 2356 B7R0.5 CCCC(=O)C(=O)N MCULE-6625605588 [0,2,0,0,0,0|1,0,1]=4 2357 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [0,2,0,0,0,0|1,0,1]=4 2358 B7R0.5 CCCC(=O)C(C)Br MCULE-8743472868 [0,2,0,0,0,0|0,0,2]=4 2359 B7R0.5 CCCC(=O)C(C)C MCULE-7690543374 [0,2,0,0,0,0|0,0,2]=4 2360 B7R0.5 CCCC(=O)N(C)C MCULE-8154537620 [0,2,0,0,0,0|0,0,2]=4 2361 B7R0.5 CCCC(Br)C(=O)C MCULE-2062903416 [0,2,0,0,0,0|0,0,2]=4 2362 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [0,2,0,0,0,0|0,0,2]=4 2363 B7R0.5 CCNC(=O)C(=O)O MCULE-1213485294 [0,2,0,0,0,0|1,0,1]=4 2364 B7R0.5 CCNC(=O)C(C)Br MCULE-4342500989 [0,2,0,0,0,0|1,0,1]=4 2365 B7R0.5 CCNC(=O)C(C)Cl MCULE-2094375104 [0,2,0,0,0,0|1,0,1]=4 2366 B7R0.5 CCNC(=O)C(C)N MCULE-7767946644 [0,2,0,0,0,0|1,0,1]=4 2367 B7R0.5 CCNC(=O)C(C)N MCULE-8324775088 [0,2,0,0,0,0|1,0,1]=4 2368 B7R0.5 CCNC(=O)C(C)N MCULE-9028977052 [0,2,0,0,0,0|1,0,1]=4 2369 B7R0.5 CCNC(=O)N(C)N MCULE-4378383472 [0,2,0,0,0,0|1,0,1]=4 2370 B7R0.5 CCNC(=O)[C@H](C)N MCULE-1043080386 [0,2,0,0,0,0|1,0,1]=4 2371 B7R0.5 CCNC(=O)[C@H](C)O MCULE-9098995292 [0,2,0,0,0,0|1,0,1]=4 2372 B7R0.5 CCOC(=O)C(=O)C MCULE-5817261721 [0,2,0,0,0,0|0,0,1]=3 2373 B7R0.5 CCOC(=O)C(=O)Cl MCULE-6454421959 [0,2,0,0,0,0|1,0,1]=4 2374 B7R0.5 CCOC(=O)C(=O)N MCULE-2968497645 [0,2,0,0,0,0|1,0,1]=4 2375 B7R0.5 CCOC(=O)C(=O)O MCULE-2368024441 [0,2,0,0,0,0|1,0,1]=4 2376 B7R0.5 CCOC(=O)C(=O)[O-] MCULE-1807862684 [0,2,0,0,0,0|1,0,1]=4 2377 B7R0.5 CCOC(=O)C(Br)Br MCULE-8701615311 [0,2,0,0,0,0|1,0,1]=4 2378 B7R0.5 CCOC(=O)C(C)Br MCULE-3184697988 [0,2,0,0,0,0|1,0,1]=4 2379 B7R0.5 CCOC(=O)C(C)C MCULE-7190269066 [0,2,0,0,0,0|1,0,1]=4 2380 B7R0.5 CCOC(=O)C(C)Cl MCULE-8192833024 [0,2,0,0,0,0|1,0,1]=4 2381 B7R0.5 CCOC(=O)C(C)F MCULE-5743308430 [0,2,0,0,0,0|1,0,1]=4 2382 B7R0.5 CCOC(=O)C(C)I MCULE-5895787216 [0,2,0,0,0,0|1,0,1]=4 2383 B7R0.5 CCOC(=O)C(C)N MCULE-1694144423 [0,2,0,0,0,0|1,0,1]=4 2384 B7R0.5 CCOC(=O)C(C)N MCULE-4073874506 [0,2,0,0,0,0|1,0,1]=4 2385 B7R0.5 CCOC(=O)C(C)N MCULE-4082731166 [0,2,0,0,0,0|1,0,1]=4 2386 B7R0.5 CCOC(=O)C(C)N MCULE-5175870607 [0,2,0,0,0,0|1,0,1]=4 2387 B7R0.5 CCOC(=O)C(C)O MCULE-8057202883 [0,2,0,0,0,0|1,0,1]=4 2388 B7R0.5 CCOC(=O)C(C)O MCULE-9679398205 [0,2,0,0,0,0|1,0,1]=4 2389 B7R0.5 CCOC(=O)C(C)S MCULE-7890942953 [0,2,0,0,0,0|1,0,1]=4 2390 B7R0.5 CCOC(=O)C(Cl)Cl MCULE-3838429635 [0,2,0,0,0,0|1,0,1]=4 2391 B7R0.5 CCOC(=O)C(F)Br MCULE-5661791694 [0,2,0,0,0,0|1,0,1]=4 2392 B7R0.5 CCOC(=O)C(F)Cl MCULE-4260692293 [0,2,0,0,0,0|1,0,1]=4 2393 B7R0.5 CCOC(=O)C(F)F MCULE-6388513707 [0,2,0,0,0,0|1,0,1]=4 2394 B7R0.5 CCOC(=O)C(F)I MCULE-4681224874 [0,2,0,0,0,0|1,0,1]=4 2395 B7R0.5 CCOC(=O)N(C)C MCULE-8344568471 [0,2,0,0,0,0|1,0,1]=4 2396 B7R0.5 CCOC(=O)N(C)N MCULE-3043289486 [0,2,0,0,0,0|1,0,1]=4 2397 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1032359164 [0,2,0,0,0,0|1,0,1]=4 2398 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1087923626 [0,2,0,0,0,0|1,0,1]=4 2399 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-1553164105 [0,2,0,0,0,0|1,0,1]=4 2400 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-2294196196 [0,2,0,0,0,0|1,0,1]=4 2401 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-4613491627 [0,2,0,0,0,0|1,0,1]=4 2402 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-8190900780 [0,2,0,0,0,0|1,0,1]=4 2403 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-3372948910 [0,2,0,0,0,0|1,0,1]=4 2404 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-5795033916 [0,2,0,0,0,0|1,0,1]=4 2405 B7R0.5 CCOC(=O)[C@H](C)F MCULE-3258014155 [0,2,0,0,0,0|1,0,1]=4 2406 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4397919899 [0,2,0,0,0,0|1,0,1]=4 2407 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4404274511 [0,2,0,0,0,0|1,0,1]=4 2408 B7R0.5 CCOC(=O)[C@H](C)N MCULE-7626045082 [0,2,0,0,0,0|1,0,1]=4 2409 B7R0.5 CCOC(=O)[C@H](C)N MCULE-8333235087 [0,2,0,0,0,0|1,0,1]=4 2410 B7R0.5 CCOC(=O)[C@H](C)O MCULE-4333545760 [0,2,0,0,0,0|1,0,1]=4 2411 B7R0.5 CCOC(=O)[C@H](C)O MCULE-8787861948 [0,2,0,0,0,0|1,0,1]=4 2412 B7R0.5 CCOC(=S)C(=O)N MCULE-4600711043 [0,2,0,0,0,0|1,0,1]=4 2413 B7R0.5 CCSC(=O)C(C)N MCULE-3205133332 [0,2,0,0,0,0|1,0,1]=4 2414 B7R0.5 CCSC(=O)C(C)N MCULE-4228316337 [0,2,0,0,0,0|1,0,1]=4 2415 B7R0.5 CCSC(=O)[C@H](C)N MCULE-3136283874 [0,2,0,0,0,0|1,0,1]=4 2416 B7R0.5 CCSC(=O)[C@H](C)N MCULE-7218618193 [0,2,0,0,0,0|1,0,1]=4 2417 B7R0.5 CCSC(=O)[C@H](C)N MCULE-8421179745 [0,2,0,0,0,0|1,0,1]=4 2418 B7R0.5 CCSC(=O)[C@H](C)N MCULE-9872171069 [0,2,0,0,0,0|1,0,1]=4 2419 B7R0.5 CNCC(=O)N(C)C MCULE-2332172341 [0,2,0,0,0,0|1,0,1]=4 2420 B7R0.5 CNCC(=O)N(C)C MCULE-6934800093 [0,2,0,0,0,0|1,0,1]=4 2421 B7R0.5 COCC(=O)C(C)C MCULE-8251961368 [0,2,0,0,0,0|1,0,1]=4 2422 B7R0.5 COCC(=O)N(C)C MCULE-4175778673 [0,2,0,0,0,0|1,0,1]=4 2423 B7R0.5 COCC(C)C(=O)C MCULE-5328927786 [0,2,0,0,0,0|0,0,2]=4 2424 B7R0.5 CON=C(C)C(=O)O MCULE-8599774085 [0,2,0,0,0,0|2,0,0]=4 2425 B7R0.7 C#CCC(=O)OCC MCULE-2012473321 [0,2,0,0,0,0|1,0,1]=4 2426 B7R0.7 C/C=C/C(=O)N=C=S MCULE-1051826106 [0,2,0,0,0,0|0,0,1]=3 2427 B7R0.7 C/C=C/C(=O)OCC MCULE-8433823264 [0,2,0,0,0,0|0,0,0]=2 2428 B7R0.7 C=C=CC(=O)OCC MCULE-9108726418 [0,2,0,0,0,0|0,0,2]=4 2429 B7R0.7 C=CCC(=O)OCC MCULE-2006542536 [0,2,0,0,0,0|0,0,2]=4 2430 B7R0.7 C=COC(=O)/C=C/C MCULE-3646996165 [0,2,0,0,0,0|0,0,1]=3 2431 B7R0.7 C=COC(=O)C=CC MCULE-7917602280 [0,2,0,0,0,0|0,0,1]=3 2432 B7R0.7 C=COC(=O)CCC MCULE-2764567967 [0,2,0,0,0,0|1,0,1]=4 2433 B7R0.7 CC#CC(=O)OCC MCULE-3358315498 [0,2,0,0,0,0|0,0,2]=4 2434 B7R0.7 CC=CC(=O)N=C=S MCULE-4538158885 [0,2,0,0,0,0|0,0,1]=3 2435 B7R0.7 CC=CC(=O)OCC MCULE-1904771513 [0,2,0,0,0,0|0,0,0]=2 2436 B7R0.7 CC=CC(O)CCC MCULE-2375824505 [0,2,0,0,0,0|0,0,2]=4 2437 B7R0.7 CCCC(=O)CC#N MCULE-7580308812 [0,2,0,0,0,0|0,0,2]=4 2438 B7R0.7 CCCC(=O)CCC MCULE-1621649928 [0,2,0,0,0,0|0,0,2]=4 2439 B7R0.7 CCCC(=O)OCC MCULE-9977024136 [0,2,0,0,0,0|0,0,2]=4 2440 B7R0.7 CCCC(=O)OCCl MCULE-5186069317 [0,2,0,0,0,0|0,0,2]=4 2441 B7R0.7 CCNC(=O)CC#N MCULE-4756290560 [0,2,0,0,0,0|1,0,1]=4 2442 B7R0.7 CCNC(=O)CCCl MCULE-3246776319 [0,2,0,0,0,0|1,0,1]=4 2443 B7R0.7 CCNC(=O)CCN MCULE-2856252531 [0,2,0,0,0,0|1,0,1]=4 2444 B7R0.7 CCNC(=O)CCN MCULE-3929666209 [0,2,0,0,0,0|1,0,1]=4 2445 B7R0.7 CCNC(=O)CCO MCULE-3624072697 [0,2,0,0,0,0|1,0,1]=4 2446 B7R0.7 CCNC(=O)CNC MCULE-1939824251 [0,2,0,0,0,0|1,0,1]=4 2447 B7R0.7 CCNC(=O)CNC MCULE-2815515396 [0,2,0,0,0,0|1,0,1]=4 2448 B7R0.7 CCNC(=O)NCC MCULE-2253571388 [0,2,0,0,0,0|1,0,1]=4 2449 B7R0.7 CCNC(=O)OCC MCULE-3910060770 [0,2,0,0,0,0|1,0,1]=4 2450 B7R0.7 CCOC(=O)/C=C/I MCULE-4105665503 [0,2,0,0,0,0|1,0,0]=3 2451 B7R0.7 CCOC(=O)/C=C/O MCULE-1984925411 [0,2,0,0,0,0|1,0,0]=3 2452 B7R0.7 CCOC(=O)/C=C/[O-] MCULE-5625833261 [0,2,0,0,0,0|1,0,0]=3 2453 B7R0.7 CCOC(=O)/C=C\Br MCULE-7525620721 [0,2,0,0,0,0|1,0,0]=3 2454 B7R0.7 CCOC(=O)/C=C\I MCULE-4741067503 [0,2,0,0,0,0|1,0,0]=3 2455 B7R0.7 CCOC(=O)/C=C\N MCULE-1135242139 [0,2,0,0,0,0|1,0,0]=3 2456 B7R0.7 CCOC(=O)C=CBr MCULE-3778834856 [0,2,0,0,0,0|1,0,0]=3 2457 B7R0.7 CCOC(=O)C=CI MCULE-9930784067 [0,2,0,0,0,0|1,0,0]=3 2458 B7R0.7 CCOC(=O)C=CO MCULE-2570791221 [0,2,0,0,0,0|1,0,0]=3 2459 B7R0.7 CCOC(=O)C=C[O-] MCULE-8425740727 [0,2,0,0,0,0|1,0,0]=3 2460 B7R0.7 CCOC(=O)C=NN MCULE-5132323904 [0,2,0,0,0,0|2,0,0]=4 2461 B7R0.7 CCOC(=O)C=NN MCULE-5899717314 [0,2,0,0,0,0|2,0,0]=4 2462 B7R0.7 CCOC(=O)C=NO MCULE-8888029932 [0,2,0,0,0,0|2,0,0]=4 2463 B7R0.7 CCOC(=O)CC#N MCULE-3161671261 [0,2,0,0,0,0|1,0,1]=4 2464 B7R0.7 CCOC(=O)CC=O MCULE-5042552247 [0,2,0,0,0,0|1,0,1]=4 2465 B7R0.7 CCOC(=O)CCBr MCULE-1898467026 [0,2,0,0,0,0|1,0,1]=4 2466 B7R0.7 CCOC(=O)CCCl MCULE-2623656770 [0,2,0,0,0,0|1,0,1]=4 2467 B7R0.7 CCOC(=O)CCI MCULE-9651397551 [0,2,0,0,0,0|1,0,1]=4 2468 B7R0.7 CCOC(=O)CCN MCULE-4383008445 [0,2,0,0,0,0|1,0,1]=4 2469 B7R0.7 CCOC(=O)CCN MCULE-6873709061 [0,2,0,0,0,0|1,0,1]=4 2470 B7R0.7 CCOC(=O)CCO MCULE-3972081033 [0,2,0,0,0,0|1,0,1]=4 2471 B7R0.7 CCOC(=O)CCS MCULE-3955367746 [0,2,0,0,0,0|1,0,1]=4 2472 B7R0.7 CCOC(=O)CNC MCULE-3219895330 [0,2,0,0,0,0|1,0,1]=4 2473 B7R0.7 CCOC(=O)CNC MCULE-6164649520 [0,2,0,0,0,0|1,0,1]=4 2474 B7R0.7 CCOC(=O)CNN MCULE-2832319636 [0,2,0,0,0,0|1,0,1]=4 2475 B7R0.7 CCOC(=O)CNN MCULE-3479623348 [0,2,0,0,0,0|1,0,1]=4 2476 B7R0.7 CCOC(=O)CNN MCULE-5066106273 [0,2,0,0,0,0|1,0,1]=4 2477 B7R0.7 CCOC(=O)COC MCULE-7739678079 [0,2,0,0,0,0|1,0,1]=4 2478 B7R0.7 CCOC(=O)CON MCULE-4924818206 [0,2,0,0,0,0|1,0,1]=4 2479 B7R0.7 CCOC(=O)CSC MCULE-5199209389 [0,2,0,0,0,0|1,0,1]=4 2480 B7R0.7 CCOC(=O)NCCl MCULE-9646468987 [0,2,0,0,0,0|1,0,1]=4 2481 B7R0.7 CCOC(=O)NCO MCULE-1265242244 [0,2,0,0,0,0|1,0,1]=4 2482 B7R0.7 CCOC(=O)NNC MCULE-8689837834 [0,2,0,0,0,0|1,0,1]=4 2483 B7R0.7 CCOC(=O)NOC MCULE-2256963329 [0,2,0,0,0,0|1,0,1]=4 2484 B7R0.7 CCOC(=O)OCC MCULE-1394890550 [0,2,0,0,0,0|1,0,1]=4 2485 B7R0.7 CCOC(=O)OCCl MCULE-9723292956 [0,2,0,0,0,0|1,0,1]=4 2486 B7R0.7 CCOC(=O)OCI MCULE-7994621582 [0,2,0,0,0,0|1,0,1]=4 2487 B7R0.7 CCOC(=O)[CH-]C=O MCULE-1944484299 [0,2,0,0,0,0|1,0,1]=4 2488 B7R0.7 CCOC(=O)[CH-]C=O MCULE-5022028224 [0,2,0,0,0,0|1,0,1]=4 2489 B7R0.7 CCSC(=O)SCC MCULE-7783165279 [0,2,0,0,0,0|1,0,1]=4 2490 B7R0.7 COCC(=O)CC#N MCULE-7023614757 [0,2,0,0,0,0|1,0,1]=4 2491 B7R0.7 COCC(=O)COC MCULE-5119511792 [0,2,0,0,0,0|1,0,1]=4 2492 B7R0.10 C/C=C(/C)\C(=O)OC MCULE-6490619453 [0,2,0,0,0,0|0,0,0]=2 2493 B7R0.10 C/C=C(\C)/C(=O)OC MCULE-2521624465 [0,2,0,0,0,0|0,0,0]=2 2494 B7R0.10 C=C(C#N)C(=O)OC MCULE-4928080553 [0,2,0,0,0,0|1,0,1]=4 2495 B7R0.10 C=C(CBr)C(=O)OC MCULE-7991860093 [0,2,0,0,0,0|1,0,1]=4 2496 B7R0.10 C=C(CC)C(=O)OC MCULE-2064145693 [0,2,0,0,0,0|0,0,1]=3 2497 B7R0.10 C=C(CCl)C(=O)OC MCULE-8356509776 [0,2,0,0,0,0|1,0,1]=4 2498 B7R0.10 C=C(CO)C(=O)OC MCULE-8888105984 [0,2,0,0,0,0|1,0,1]=4 2499 B7R0.10 C=C(OC)C(=O)OC MCULE-3256769494 [0,2,0,0,0,0|1,0,0]=3 2500 B7R0.10 C=CC(Cl)C(=O)OC MCULE-8371197919 [0,2,0,0,0,0|0,0,2]=4 2501 B7R0.10 C=CC(N)C(=O)OC MCULE-6449924585 [0,2,0,0,0,0|0,0,2]=4 2502 B7R0.10 C=CC(N)C(=O)OC MCULE-8138684326 [0,2,0,0,0,0|0,0,2]=4 2503 B7R0.10 C=CC(O)C(=O)OC MCULE-8475572887 [0,2,0,0,0,0|0,0,2]=4 2504 B7R0.10 CC=C(Br)C(=O)OC MCULE-8210439839 [0,2,0,0,0,0|0,0,0]=2 2505 B7R0.10 CC=C(C)C(=O)OC MCULE-7431996149 [0,2,0,0,0,0|0,0,0]=2 2506 B7R0.10 CCC(=O)C(=NO)C MCULE-5669219787 [0,2,0,0,0,0|0,0,2]=4 2507 B7R0.10 CCC(=O)C(=O)CC MCULE-4346857339 [0,2,0,0,0,0|0,0,1]=3 2508 B7R0.10 CCC(=O)C(=O)OC MCULE-6526576267 [0,2,0,0,0,0|0,0,1]=3 2509 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [0,2,0,0,0,0|0,0,2]=4 2510 B7R0.10 CCC(=O)N(C)CC MCULE-1764457516 [0,2,0,0,0,0|1,0,1]=4 2511 B7R0.10 CCC(=O)N(C)OC MCULE-7450696534 [0,2,0,0,0,0|2,0,0]=4 2512 B7R0.10 CCC(Br)C(=O)NC MCULE-5335067622 [0,2,0,0,0,0|0,0,2]=4 2513 B7R0.10 CCC(Br)C(=O)OC MCULE-2335527491 [0,2,0,0,0,0|0,0,2]=4 2514 B7R0.10 CCC(C)C(=O)CBr MCULE-7022126762 [0,2,0,0,0,0|0,0,2]=4 2515 B7R0.10 CCC(C)C(=O)CCl MCULE-6800466655 [0,2,0,0,0,0|0,0,2]=4 2516 B7R0.10 CCC(C)C(=O)NC MCULE-5599095900 [0,2,0,0,0,0|0,0,2]=4 2517 B7R0.10 CCC(C)C(=O)OC MCULE-9845747952 [0,2,0,0,0,0|0,0,2]=4 2518 B7R0.10 CCC(Cl)C(=O)OC MCULE-4773486285 [0,2,0,0,0,0|0,0,2]=4 2519 B7R0.10 CCC(N)C(=O)NC MCULE-7274856339 [0,2,0,0,0,0|0,0,2]=4 2520 B7R0.10 CCC(N)C(=O)NC MCULE-9912780545 [0,2,0,0,0,0|0,0,2]=4 2521 B7R0.10 CCC(N)C(=O)OC MCULE-1569242271 [0,2,0,0,0,0|0,0,2]=4 2522 B7R0.10 CCC(N)C(=O)OC MCULE-3183954116 [0,2,0,0,0,0|0,0,2]=4 2523 B7R0.10 CCC(N)C(=O)OC MCULE-4045754117 [0,2,0,0,0,0|0,0,2]=4 2524 B7R0.10 CCC(N)C(=O)OC MCULE-5328984047 [0,2,0,0,0,0|0,0,2]=4 2525 B7R0.10 CCC(O)C(=O)OC MCULE-8768500574 [0,2,0,0,0,0|0,0,2]=4 2526 B7R0.10 CCN(C)C(=O)CBr MCULE-4444194334 [0,2,0,0,0,0|1,0,1]=4 2527 B7R0.10 CCN(C)C(=O)CCl MCULE-7762522604 [0,2,0,0,0,0|1,0,1]=4 2528 B7R0.10 CC[C@@H](Br)C(=O)OC MCULE-2676798410 [0,2,0,0,0,0|0,0,2]=4 2529 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6794991435 [0,2,0,0,0,0|0,0,2]=4 2530 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6825672331 [0,2,0,0,0,0|0,0,2]=4 2531 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-7307663817 [0,2,0,0,0,0|0,0,2]=4 2532 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-8717527808 [0,2,0,0,0,0|0,0,2]=4 2533 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-6916010003 [0,2,0,0,0,0|0,0,2]=4 2534 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-9376722018 [0,2,0,0,0,0|0,0,2]=4 2535 B7R0.10 CC[C@H](Br)C(=O)OC MCULE-5490793206 [0,2,0,0,0,0|0,0,2]=4 2536 B7R0.10 CC[C@H](N)C(=O)OC MCULE-2336816190 [0,2,0,0,0,0|0,0,2]=4 2537 B7R0.10 CC[C@H](N)C(=O)OC MCULE-3480066740 [0,2,0,0,0,0|0,0,2]=4 2538 B7R0.10 CC[C@H](N)C(=O)OC MCULE-4883083558 [0,2,0,0,0,0|0,0,2]=4 2539 B7R0.10 CC[C@H](N)C(=O)OC MCULE-6241184216 [0,2,0,0,0,0|0,0,2]=4 2540 B7R0.10 CC[C@H](O)C(=O)OC MCULE-5873092635 [0,2,0,0,0,0|0,0,2]=4 2541 B7R0.10 CC[C@H](O)C(=O)OC MCULE-8209874812 [0,2,0,0,0,0|0,0,2]=4 2542 B7R0.10 CNC(=O)/C(=N/O)/N MCULE-4165941405 [0,2,0,0,0,0|2,0,0]=4 2543 B7R0.10 CNC(=O)C(=NO)C MCULE-5419636892 [0,2,0,0,0,0|1,0,1]=4 2544 B7R0.10 CNC(=O)C(=O)NC MCULE-5993874240 [0,2,0,0,0,0|1,0,0]=3 2545 B7R0.10 CNC(=O)C(=O)OC MCULE-1771479923 [0,2,0,0,0,0|1,0,0]=3 2546 B7R0.10 CNC(=O)C(C)NC MCULE-5788965533 [0,2,0,0,0,0|1,0,1]=4 2547 B7R0.10 CNC(=O)[C@H](C)NC MCULE-4236618966 [0,2,0,0,0,0|1,0,1]=4 2548 B7R0.10 CNC(=O)[C@H](C)NC MCULE-9974564724 [0,2,0,0,0,0|1,0,1]=4 2549 B7R0.10 CNC(=S)C(=S)NC MCULE-2962897883 [0,2,0,0,0,0|1,1,0]=4 2550 B7R0.10 CNC(C)C(=O)OC MCULE-1524259113 [0,2,0,0,0,0|1,0,1]=4 2551 B7R0.10 CNC(C)C(=O)OC MCULE-2414146201 [0,2,0,0,0,0|1,0,1]=4 2552 B7R0.10 CNC(C)C(=O)OC MCULE-3192973771 [0,2,0,0,0,0|1,0,1]=4 2553 B7R0.10 CNC(C)C(=O)OC MCULE-9929257431 [0,2,0,0,0,0|1,0,1]=4 2554 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-1271745038 [0,2,0,0,0,0|1,0,1]=4 2555 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-3018199319 [0,2,0,0,0,0|1,0,1]=4 2556 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3420184809 [0,2,0,0,0,0|1,0,1]=4 2557 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3818454089 [0,2,0,0,0,0|1,0,1]=4 2558 B7R0.10 CN[C@H](C)C(=O)OC MCULE-8297775033 [0,2,0,0,0,0|1,0,1]=4 2559 B7R0.10 CN[C@H](C)C(=O)OC MCULE-9637759835 [0,2,0,0,0,0|1,0,1]=4 2560 B7R0.10 COC(=O)/C(=C/Br)/C MCULE-9213242172 [0,2,0,0,0,0|1,0,0]=3 2561 B7R0.10 COC(=O)/C(=C/Cl)/Cl MCULE-7181141754 [0,2,0,0,0,0|1,0,0]=3 2562 B7R0.10 COC(=O)/C(=C/[O-])/Cl MCULE-5795286951 [0,2,0,0,0,0|1,0,0]=3 2563 B7R0.10 COC(=O)/C(=C/[O-])/Cl MCULE-6102470934 [0,2,0,0,0,0|1,0,0]=3 2564 B7R0.10 COC(=O)/C(=N/O)/N MCULE-6279341489 [0,2,0,0,0,0|2,0,0]=4 2565 B7R0.10 COC(=O)C(=CBr)C MCULE-2452279572 [0,2,0,0,0,0|1,0,0]=3 2566 B7R0.10 COC(=O)C(=O)CBr MCULE-7596502094 [0,2,0,0,0,0|1,0,0]=3 2567 B7R0.10 COC(=O)C(=O)NN MCULE-7834741474 [0,2,0,0,0,0|2,0,0]=4 2568 B7R0.10 COC(=O)C(=O)OC MCULE-5018268642 [0,2,0,0,0,0|1,0,0]=3 2569 B7R0.10 COC(=O)C(Br)OC MCULE-5672396067 [0,2,0,0,0,0|1,0,1]=4 2570 B7R0.10 COC(=O)C(C)C=O MCULE-8461987901 [0,2,0,0,0,0|1,0,1]=4 2571 B7R0.10 COC(=O)C(C)OC MCULE-3274761391 [0,2,0,0,0,0|1,0,1]=4 2572 B7R0.10 COC(=O)C(C)SC MCULE-6914204626 [0,2,0,0,0,0|1,0,1]=4 2573 B7R0.10 COC(=O)C(Cl)C=O MCULE-1767241035 [0,2,0,0,0,0|1,0,1]=4 2574 B7R0.10 COC(=O)C(Cl)OC MCULE-8296320773 [0,2,0,0,0,0|1,0,1]=4 2575 B7R0.10 COC(=O)C(O)OC MCULE-5465190164 [0,2,0,0,0,0|1,0,1]=4 2576 B7R0.10 COC(=O)[C@H](C)C=O MCULE-9841785503 [0,2,0,0,0,0|1,0,1]=4 2577 B7R0.10 COC(=O)[C@H](C)OC MCULE-3095326114 [0,2,0,0,0,0|1,0,1]=4 2578 B7R0.10 CON(C)C(=O)CBr MCULE-2482429241 [0,2,0,0,0,0|2,0,0]=4 2579 B7R0.10 CON(C)C(=O)CCl MCULE-1502732282 [0,2,0,0,0,0|2,0,0]=4 2580 B7R0.10 CON(C)C(=O)CF MCULE-9037247053 [0,2,0,0,0,0|2,0,0]=4 2581 B7R0.10 CON(C)C(=O)CN MCULE-1461344814 [0,2,0,0,0,0|2,0,0]=4 2582 B7R0.10 CON(C)C(=O)CN MCULE-5305104539 [0,2,0,0,0,0|2,0,0]=4 2583 B7R0.10 O=C(CBr)C(=O)CBr MCULE-2533799421 [0,2,0,0,0,0|1,0,1]=4 2584 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-1799930850 [0,2,0,0,0,0|1,0,1]=4 2585 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-5931188957 [0,2,0,0,0,0|1,0,1]=4 2586 B7R0.9 CC(=CC(C)(C)C)C MCULE-4264115616 [0,2,0,0,0,0|1,0,1]=4 2587 B7R0.9 CC(=O)CC(C)(C)C MCULE-5477546626 [0,2,0,0,0,0|0,0,2]=4 2588 B7R0.9 CC(=O)CC(C)(C)Cl MCULE-5981575591 [0,2,0,0,0,0|0,0,2]=4 2589 B7R0.9 CC(=O)CC(C)(C)N MCULE-1511988439 [0,2,0,0,0,0|0,0,2]=4 2590 B7R0.9 CC(=O)CC(C)(C)N MCULE-7807079460 [0,2,0,0,0,0|0,0,2]=4 2591 B7R0.9 CC(=O)CC(C)(C)N MCULE-8677016157 [0,2,0,0,0,0|0,0,2]=4 2592 B7R0.9 CC(=O)CC(C)(C)O MCULE-2623560163 [0,2,0,0,0,0|0,0,2]=4 2593 B7R0.9 CC(=O)CC(C)(C)S MCULE-8901285593 [0,2,0,0,0,0|0,0,2]=4 2594 B7R0.9 CC(=O)CS(=O)(=O)C MCULE-5686426572 [0,2,0,0,0,0|1,0,1]=4 2595 B7R0.9 CC(=O)NC(C)(C)C MCULE-7590749185 [0,2,0,0,0,0|1,0,1]=4 2596 B7R0.9 CC(=O)N[Si](C)(C)C MCULE-1892187625 [0,2,0,0,0,0|1,1,0]=4 2597 B7R0.9 CC(=O)OC(C)(C)C MCULE-4713236745 [0,2,0,0,0,0|1,0,1]=4 2598 B7R0.9 CC(=O)OS(=O)(=O)C MCULE-1489852585 [0,2,0,0,0,0|2,0,0]=4 2599 B7R0.9 CC(=O)O[Si](C)(C)C MCULE-9062827817 [0,2,0,0,0,0|1,1,0]=4 2600 B7R0.9 CC(=O)SC(C)(C)C MCULE-7111846167 [0,2,0,0,0,0|1,0,1]=4 2601 B7R0.16 C=C(C(=O)O)C(=O)O MCULE-7540749901 [0,2,0,0,0,0|2,0,0]=4 2602 B7R0.16 C=C(C(=O)O)C(C)C MCULE-6667026437 [0,2,0,0,0,0|1,0,1]=4 2603 B7R0.16 C=C(C)C(=O)C(C)C MCULE-6219149152 [0,2,0,0,0,0|1,0,1]=4 2604 B7R0.16 C=C(C)C(=O)N(C)C MCULE-5921699549 [0,2,0,0,0,0|2,0,0]=4 2605 B7R0.16 C=C(C)C(C)C(=O)C MCULE-2480790812 [0,2,0,0,0,0|0,0,1]=3 2606 B7R0.16 C=C(C)C(N)C(=O)O MCULE-1815568719 [0,2,0,0,0,0|1,0,1]=4 2607 B7R0.16 C=C(C)C(N)C(=O)O MCULE-2839869274 [0,2,0,0,0,0|1,0,1]=4 2608 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5015326828 [0,2,0,0,0,0|1,0,1]=4 2609 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5043630144 [0,2,0,0,0,0|1,0,1]=4 2610 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-2007035571 [0,2,0,0,0,0|1,0,1]=4 2611 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-6240689602 [0,2,0,0,0,0|1,0,1]=4 2612 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-8025014656 [0,2,0,0,0,0|1,0,1]=4 2613 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-9704891439 [0,2,0,0,0,0|1,0,1]=4 2614 B7R0.16 CC(=C(Br)C(=O)O)C MCULE-8944482091 [0,2,0,0,0,0|1,0,0]=3 2615 B7R0.16 CC(=C(Br)N(C)C)C MCULE-7886727413 [0,2,0,0,0,0|2,0,0]=4 2616 B7R0.16 CC(=C(C)C(=O)O)Br MCULE-9431818570 [0,2,0,0,0,0|1,0,0]=3 2617 B7R0.16 CC(=C(C)C(=O)O)C MCULE-1062537992 [0,2,0,0,0,0|1,0,0]=3 2618 B7R0.16 CC(=C(C)C(C)C)C MCULE-1277261872 [0,2,0,0,0,0|1,0,1]=4 2619 B7R0.16 CC(=C(Cl)C(=O)O)C MCULE-9408683615 [0,2,0,0,0,0|1,0,0]=3 2620 B7R0.16 CC(=C(Cl)N(C)C)C MCULE-2216665088 [0,2,0,0,0,0|2,0,0]=4 2621 B7R0.16 CC(=C(F)C(=O)O)C MCULE-9025515032 [0,2,0,0,0,0|1,0,0]=3 2622 B7R0.16 CC(=O)C(=C(C)[O-])C MCULE-1358390281 [0,2,0,0,0,0|0,0,0]=2 2623 B7R0.16 CC(=O)C(=C(C)[O-])C MCULE-6098819264 [0,2,0,0,0,0|0,0,0]=2 2624 B7R0.16 CC(=O)C(=O)C(C)Br MCULE-8153095418 [0,2,0,0,0,0|0,0,1]=3 2625 B7R0.16 CC(=O)C(=O)N(C)C MCULE-9467983911 [0,2,0,0,0,0|1,0,0]=3 2626 B7R0.16 CC(=O)C(Br)C(=O)C MCULE-2980550700 [0,2,0,0,0,0|0,0,1]=3 2627 B7R0.16 CC(=O)C(Br)C(C)C MCULE-2864707278 [0,2,0,0,0,0|0,0,2]=4 2628 B7R0.16 CC(=O)C(C)C(=O)C MCULE-9607259412 [0,2,0,0,0,0|0,0,1]=3 2629 B7R0.16 CC(=O)C(Cl)C(=O)C MCULE-4716617423 [0,2,0,0,0,0|0,0,1]=3 2630 B7R0.16 CC(=O)C(Cl)C(C)C MCULE-2825069638 [0,2,0,0,0,0|0,0,2]=4 2631 B7R0.16 CC(=O)C(F)C(=O)C MCULE-4665621902 [0,2,0,0,0,0|0,0,1]=3 2632 B7R0.16 CC(=O)C(N)C(=O)C MCULE-6440496769 [0,2,0,0,0,0|0,0,1]=3 2633 B7R0.16 CC(=O)C(N)C(=O)C MCULE-8525737264 [0,2,0,0,0,0|0,0,1]=3 2634 B7R0.16 CC(=O)N(C)C(=O)C MCULE-6245493539 [0,2,0,0,0,0|1,0,0]=3 2635 B7R0.16 CC(C)C(=O)C(=O)Cl MCULE-6254092186 [0,2,0,0,0,0|1,0,1]=4 2636 B7R0.16 CC(C)C(=O)C(=O)O MCULE-9877767821 [0,2,0,0,0,0|1,0,1]=4 2637 B7R0.16 CC(C)C(=O)C(=O)[O-] MCULE-3960241746 [0,2,0,0,0,0|1,0,1]=4 2638 B7R0.16 CN(C)C(=O)C(=O)O MCULE-4063274840 [0,2,0,0,0,0|2,0,0]=4 2639 B7R0.16 O=C(Cl)C(=C(Cl)Cl)Cl MCULE-8279367474 [0,2,0,0,0,0|2,0,0]=4 2640 B7R0.16 O=C(O)C(=C(Cl)Cl)Cl MCULE-4004262160 [0,2,0,0,0,0|2,0,0]=4 2641 B7R0.16 O=C(O)C(=O)C(=O)O MCULE-9031084199 [0,2,0,0,0,0|2,0,0]=4 2642 B7R0.16 O=C([O-])C(=O)C(=O)[O-] MCULE-3642448111 [0,2,0,0,0,0|2,0,0]=4 2643 B7R0.16 O=C([O-])C(=O)C(=O)[O-] MCULE-7835235837 [0,2,0,0,0,0|2,0,0]=4 2644 B7R0.13 CCC(C)(C)C(=O)C MCULE-3647111938 [0,2,0,0,0,0|0,0,2]=4 2645 B7R0.13 CCC(C)(O)C(=O)C MCULE-5532598723 [0,2,0,0,0,0|0,0,2]=4 2646 B7R0.13 COC(C)(C)C(=O)C MCULE-2989232242 [0,2,0,0,0,0|1,0,1]=4 2647 B7R0.14 CC=C(C)C(C)(C)C MCULE-9617441610 [0,2,0,0,0,0|1,0,1]=4 2648 B7R0.15 C/C=C(\C#N)/C(=O)O MCULE-4984827905 [0,2,0,0,0,0|1,0,0]=3 2649 B7R0.15 CC(=O)C(=NO)C#N MCULE-7581545205 [0,2,0,0,0,0|1,0,1]=4 2650 B7R0.15 CC=C(C#N)C(=O)O MCULE-5255376210 [0,2,0,0,0,0|1,0,0]=3 2651 B7R0.15 CC=C(CC)C(=O)O MCULE-9303879981 [0,2,0,0,0,0|1,0,0]=3 2652 B7R0.15 CCC(CC)C(=O)C MCULE-5291760485 [0,2,0,0,0,0|0,0,2]=4 2653 B7R0.15 CCN(CC)C(=O)C MCULE-6584128098 [0,2,0,0,0,0|1,0,1]=4 2654 B7R0.15 COC(OC)C(=O)C MCULE-9746788369 [0,2,0,0,0,0|1,0,1]=4 2655 B7R0.4 C#CCCCC(=O)C MCULE-9860822800 [0,2,0,0,0,0|0,0,2]=4 2656 B7R0.4 C#CCCNC(=O)C MCULE-2003551338 [0,2,0,0,0,0|1,0,1]=4 2657 B7R0.4 C(=C/C(=O)O)\CCC MCULE-7580507705 [0,2,0,0,0,0|1,0,0]=3 2658 B7R0.4 C(=C/CC(=O)O)\CC MCULE-2731794411 [0,2,0,0,0,0|1,0,0]=3 2659 B7R0.4 C/C=C/C=C/C(=O)O MCULE-5933850278 [0,2,0,0,0,0|1,0,0]=3 2660 B7R0.4 C/C=C/C=C/C(=O)[O-] MCULE-2438491537 [0,2,0,0,0,0|1,0,0]=3 2661 B7R0.4 C/C=C/C=C/C(=O)[O-] MCULE-8550303604 [0,2,0,0,0,0|1,0,0]=3 2662 B7R0.4 C/C=C/C=C\C(=O)O MCULE-3744855708 [0,2,0,0,0,0|1,0,0]=3 2663 B7R0.4 C/C=C/COC(=O)C MCULE-4948306153 [0,2,0,0,0,0|0,0,0]=2 2664 B7R0.4 C=C(C)CCC=CC MCULE-7970794651 [0,2,0,0,0,0|1,0,0]=3 2665 B7R0.4 C=CC=COC(=O)C MCULE-8556263077 [0,2,0,0,0,0|0,0,1]=3 2666 B7R0.4 C=CC=N/[NH+]=C(/C)\N MCULE-3546579711 [0,2,0,0,0,0|1,0,1]=4 2667 B7R0.4 C=CC=N/[NH+]=C(/C)\N MCULE-7747986139 [0,2,0,0,0,0|1,0,1]=4 2668 B7R0.4 C=CC=NNC(=O)N MCULE-6611985512 [0,2,0,0,0,0|1,0,1]=4 2669 B7R0.4 C=CCCOC(=O)C MCULE-4554969214 [0,2,0,0,0,0|0,0,2]=4 2670 B7R0.4 C=CCONC(=O)C MCULE-1401456265 [0,2,0,0,0,0|0,0,2]=4 2671 B7R0.4 CC(=C=CCCO)C MCULE-7603464206 [0,2,0,0,0,0|1,0,1]=4 2672 B7R0.4 CC(=CCCC=O)C MCULE-3815388926 [0,2,0,0,0,0|1,0,1]=4 2673 B7R0.4 CC(=CCCCO)C MCULE-5263952692 [0,2,0,0,0,0|1,0,1]=4 2674 B7R0.4 CC(=CCOC=O)C MCULE-1475053986 [0,2,0,0,0,0|2,0,0]=4 2675 B7R0.4 CC(=O)CCCC#N MCULE-5884370871 [0,2,0,0,0,0|0,0,2]=4 2676 B7R0.4 CC(=O)CCCCBr MCULE-8801446022 [0,2,0,0,0,0|0,0,2]=4 2677 B7R0.4 CC(=O)CCCCCl MCULE-2883443563 [0,2,0,0,0,0|0,0,2]=4 2678 B7R0.4 CC(=O)CCCCO MCULE-9846338144 [0,2,0,0,0,0|0,0,2]=4 2679 B7R0.4 CC(=O)CSCCF MCULE-8129308816 [0,2,0,0,0,0|0,0,2]=4 2680 B7R0.4 CC(=O)NCCC#N MCULE-1781318297 [0,2,0,0,0,0|1,0,1]=4 2681 B7R0.4 CC(=O)NCCC=O MCULE-1907633123 [0,2,0,0,0,0|1,0,1]=4 2682 B7R0.4 CC(=O)NCCCBr MCULE-5421597540 [0,2,0,0,0,0|0,0,2]=4 2683 B7R0.4 CC(=O)NCCCCl MCULE-4056331581 [0,2,0,0,0,0|0,0,2]=4 2684 B7R0.4 CC(=O)NCCCN MCULE-6321543480 [0,2,0,0,0,0|0,0,2]=4 2685 B7R0.4 CC(=O)NCCCN MCULE-8441492497 [0,2,0,0,0,0|0,0,2]=4 2686 B7R0.4 CC(=O)NCCCO MCULE-5627003249 [0,2,0,0,0,0|0,0,2]=4 2687 B7R0.4 CC(=O)NCCON MCULE-3703048482 [0,2,0,0,0,0|1,0,1]=4 2688 B7R0.4 CC(=O)OCCCBr MCULE-4735159476 [0,2,0,0,0,0|0,0,2]=4 2689 B7R0.4 CC(=O)OCCCCl MCULE-4801419214 [0,2,0,0,0,0|0,0,2]=4 2690 B7R0.4 CC(=O)OCCCI MCULE-5830086336 [0,2,0,0,0,0|0,0,2]=4 2691 B7R0.4 CC(=O)OCCCO MCULE-1423430948 [0,2,0,0,0,0|0,0,2]=4 2692 B7R0.4 CC(=O)OCCCS MCULE-2576827025 [0,2,0,0,0,0|0,0,2]=4 2693 B7R0.4 CC(=O)SCCC#N MCULE-4159295037 [0,2,0,0,0,0|1,0,1]=4 2694 B7R0.4 CC(=O)SCCC=O MCULE-3054558493 [0,2,0,0,0,0|1,0,1]=4 2695 B7R0.4 CC(=O)SCCCBr MCULE-2716633608 [0,2,0,0,0,0|0,0,2]=4 2696 B7R0.4 CC(=O)SCCCCl MCULE-3875604518 [0,2,0,0,0,0|0,0,2]=4 2697 B7R0.4 CC(=O)SCCCO MCULE-9014625190 [0,2,0,0,0,0|0,0,2]=4 2698 B7R0.4 CC=CC=CC(=O)C MCULE-1781846029 [0,2,0,0,0,0|0,0,0]=2 2699 B7R0.4 CC=CC=CC(=O)Cl MCULE-7711381941 [0,2,0,0,0,0|1,0,0]=3 2700 B7R0.4 CC=CC=CC(=O)O MCULE-9397415946 [0,2,0,0,0,0|1,0,0]=3 2701 B7R0.4 CC=CC=CC(=O)[O-] MCULE-4983552708 [0,2,0,0,0,0|1,0,0]=3 2702 B7R0.4 CC=CC=CC(=O)[O-] MCULE-7794252065 [0,2,0,0,0,0|1,0,0]=3 2703 B7R0.4 CC=CCCC(=O)O MCULE-4275247668 [0,2,0,0,0,0|1,0,0]=3 2704 B7R0.4 CCC/C=C/C(=O)C MCULE-2005171902 [0,2,0,0,0,0|0,0,0]=2 2705 B7R0.4 CCC=CCC(=O)O MCULE-5031939966 [0,2,0,0,0,0|1,0,0]=3 2706 B7R0.4 CCC=CCC(C)C MCULE-6798729321 [0,2,0,0,0,0|1,0,1]=4 2707 B7R0.4 CCCC=CC(=O)C MCULE-5008490883 [0,2,0,0,0,0|0,0,0]=2 2708 B7R0.4 CCCC=CC(=O)Cl MCULE-6782906777 [0,2,0,0,0,0|1,0,0]=3 2709 B7R0.4 CCCC=CC(=O)O MCULE-6995077492 [0,2,0,0,0,0|1,0,0]=3 2710 B7R0.4 CCCC=CC(C)C MCULE-6546702510 [0,2,0,0,0,0|1,0,1]=4 2711 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [0,2,0,0,0,0|0,0,2]=4 2712 B7R0.4 CCCCNC(=O)C MCULE-7266335096 [0,2,0,0,0,0|0,0,2]=4 2713 B7R0.4 CCCCOC(=O)C MCULE-2107021121 [0,2,0,0,0,0|0,0,2]=4 2714 B7R0.4 CCCCSC(=O)C MCULE-2653182488 [0,2,0,0,0,0|0,0,2]=4 2715 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [0,2,0,0,0,0|0,0,2]=4 2716 B7R0.4 CCO/C=C/C(=N)N MCULE-5385104731 [0,2,0,0,0,0|2,0,0]=4 2717 B7R0.4 CCO/C=C/C(=N)N MCULE-9722827005 [0,2,0,0,0,0|2,0,0]=4 2718 B7R0.4 CCO/C=C/C(=O)Cl MCULE-5623807124 [0,2,0,0,0,0|1,0,0]=3 2719 B7R0.4 CCO/C=C/C(=O)O MCULE-6712227034 [0,2,0,0,0,0|1,0,0]=3 2720 B7R0.4 CCO/C=C/C(C)C MCULE-7416901605 [0,2,0,0,0,0|1,0,1]=4 2721 B7R0.4 CCOC=CC(=O)Cl MCULE-1242349133 [0,2,0,0,0,0|1,0,0]=3 2722 B7R0.4 CCOC=CC(=O)O MCULE-4776715351 [0,2,0,0,0,0|1,0,0]=3 2723 B7R0.4 CCOC=CC(C)C MCULE-3218868182 [0,2,0,0,0,0|1,0,1]=4 2724 B7R0.4 CCOCCC(=O)C MCULE-8449201493 [0,2,0,0,0,0|0,0,2]=4 2725 B7R0.4 CNCCNC(=O)C MCULE-5361712613 [0,2,0,0,0,0|0,0,2]=4 2726 B7R0.4 CNCCNC(=O)C MCULE-9798024696 [0,2,0,0,0,0|0,0,2]=4 2727 B7R0.4 CNCCOC(=O)C MCULE-1850077864 [0,2,0,0,0,0|0,0,2]=4 2728 B7R0.4 CNCCOC(=O)C MCULE-7023987942 [0,2,0,0,0,0|0,0,2]=4 2729 B7R0.4 COC/C=C/C(=O)O MCULE-7555080897 [0,2,0,0,0,0|1,0,0]=3 2730 B7R0.4 COCC=CC(=O)O MCULE-5702384430 [0,2,0,0,0,0|1,0,0]=3 2731 B7R0.4 COCCCC(=O)C MCULE-3606369396 [0,2,0,0,0,0|0,0,2]=4 2732 B7R0.4 COCCNC(=O)C MCULE-2794263612 [0,2,0,0,0,0|0,0,2]=4 2733 B7R0.4 COCCOC(=O)C MCULE-3221264060 [0,2,0,0,0,0|0,0,2]=4 2734 B7R0.4 CSCC=CC(=O)O MCULE-8220760222 [0,2,0,0,0,0|1,0,0]=3 2735 B7R0.4 CSCCNC(=O)C MCULE-2739431878 [0,2,0,0,0,0|0,0,2]=4 2736 B7R0.4 CSCCOC(=O)C MCULE-3742242959 [0,2,0,0,0,0|0,0,2]=4 2737 B7R0.4 O=C(O)CCC=CBr MCULE-1826887170 [0,2,0,0,0,0|2,0,0]=4 2738 B7R0.6 C=C(Br)CNC(=O)C MCULE-4123179812 [0,2,0,0,0,0|0,0,2]=4 2739 B7R0.6 C=C(C)CCC(=C)C MCULE-6018302318 [0,2,0,0,0,0|1,0,1]=4 2740 B7R0.6 C=C(C)CCC(=O)C MCULE-4201277876 [0,2,0,0,0,0|0,0,1]=3 2741 B7R0.6 C=C(C)CCC(=O)N MCULE-7602727888 [0,2,0,0,0,0|1,0,1]=4 2742 B7R0.6 C=C(C)CCC(=O)O MCULE-8738532812 [0,2,0,0,0,0|1,0,1]=4 2743 B7R0.6 C=C(C)COC(=O)C MCULE-7739945243 [0,2,0,0,0,0|0,0,1]=3 2744 B7R0.6 C=C(C)NCC(=O)O MCULE-6347105994 [0,2,0,0,0,0|1,0,1]=4 2745 B7R0.6 C=C(Cl)CSC(=O)C MCULE-4264447992 [0,2,0,0,0,0|0,0,2]=4 2746 B7R0.6 CC(=CC=C(C)C)C MCULE-9852692083 [0,2,0,0,0,0|1,0,0]=3 2747 B7R0.6 CC(=CCC(=O)O)C MCULE-2552993418 [0,2,0,0,0,0|1,0,0]=3 2748 B7R0.6 CC(=CCC(=O)[O-])C MCULE-6283758684 [0,2,0,0,0,0|1,0,0]=3 2749 B7R0.6 CC(=CCC(C)C)C MCULE-5578852998 [0,2,0,0,0,0|1,0,1]=4 2750 B7R0.6 CC(=NN=C(C)C)C MCULE-7791135415 [0,2,0,0,0,0|2,0,0]=4 2751 B7R0.6 CC(=NNC(=O)N)C MCULE-9452330207 [0,2,0,0,0,0|2,0,0]=4 2752 B7R0.6 CC(=O)/C=C/C(=O)O MCULE-8768861026 [0,2,0,0,0,0|0,0,1]=3 2753 B7R0.6 CC(=O)/C=C/N(C)C MCULE-7703636114 [0,2,0,0,0,0|0,0,0]=2 2754 B7R0.6 CC(=O)C=CC(=O)C MCULE-9472466140 [0,2,0,0,0,0|0,0,0]=2 2755 B7R0.6 CC(=O)C=CC(=O)Cl MCULE-8865772819 [0,2,0,0,0,0|0,0,1]=3 2756 B7R0.6 CC(=O)C=CC(=O)O MCULE-6867353277 [0,2,0,0,0,0|0,0,1]=3 2757 B7R0.6 CC(=O)C=CC(C)C MCULE-7908862390 [0,2,0,0,0,0|0,0,0]=2 2758 B7R0.6 CC(=O)C=CN(C)C MCULE-2800987098 [0,2,0,0,0,0|0,0,0]=2 2759 B7R0.6 CC(=O)CCC(=O)C MCULE-3166810473 [0,2,0,0,0,0|0,0,1]=3 2760 B7R0.6 CC(=O)CCC(=O)N MCULE-8943258659 [0,2,0,0,0,0|1,0,1]=4 2761 B7R0.6 CC(=O)CCC(=O)O MCULE-1392778065 [0,2,0,0,0,0|1,0,1]=4 2762 B7R0.6 CC(=O)CCC(=O)[O-] MCULE-4975344808 [0,2,0,0,0,0|1,0,1]=4 2763 B7R0.6 CC(=O)CCC(C)C MCULE-8518693213 [0,2,0,0,0,0|0,0,2]=4 2764 B7R0.6 CC(=O)CCC(F)F MCULE-3009814756 [0,2,0,0,0,0|0,0,2]=4 2765 B7R0.6 CC(=O)CCN(C)C MCULE-1601022082 [0,2,0,0,0,0|0,0,2]=4 2766 B7R0.6 CC(=O)CCN(C)C MCULE-2933383790 [0,2,0,0,0,0|0,0,2]=4 2767 B7R0.6 CC(=O)CNC(=O)C MCULE-7941086302 [0,2,0,0,0,0|0,0,1]=3 2768 B7R0.6 CC(=O)CNC(=O)Cl MCULE-2043888982 [0,2,0,0,0,0|1,0,1]=4 2769 B7R0.6 CC(=O)CNC(C)C MCULE-2033555652 [0,2,0,0,0,0|0,0,2]=4 2770 B7R0.6 CC(=O)CNC(C)C MCULE-2990661777 [0,2,0,0,0,0|0,0,2]=4 2771 B7R0.6 CC(=O)COC(=O)C MCULE-2994552521 [0,2,0,0,0,0|0,0,1]=3 2772 B7R0.6 CC(=O)COC(C)C MCULE-4426769810 [0,2,0,0,0,0|0,0,2]=4 2773 B7R0.6 CC(=O)CSC(C)C MCULE-6486341454 [0,2,0,0,0,0|0,0,2]=4 2774 B7R0.6 CC(=O)NC=C(Cl)Cl MCULE-8744236684 [0,2,0,0,0,0|1,0,0]=3 2775 B7R0.6 CC(=O)NCC(=O)Cl MCULE-3900899057 [0,2,0,0,0,0|1,0,1]=4 2776 B7R0.6 CC(=O)NCC(=O)N MCULE-7934502236 [0,2,0,0,0,0|1,0,1]=4 2777 B7R0.6 CC(=O)NCC(=O)O MCULE-5811325186 [0,2,0,0,0,0|1,0,1]=4 2778 B7R0.6 CC(=O)NCC(C)O MCULE-2406798273 [0,2,0,0,0,0|0,0,2]=4 2779 B7R0.6 CC(=O)NN=C(C)C MCULE-9759901228 [0,2,0,0,0,0|1,0,0]=3 2780 B7R0.6 CC(=O)NNC(=O)C MCULE-3292268906 [0,2,0,0,0,0|1,0,0]=3 2781 B7R0.6 CC(=O)NNC(=S)N MCULE-4923078693 [0,2,0,0,0,0|2,0,0]=4 2782 B7R0.6 CC(=O)NNC(C)C MCULE-8896858149 [0,2,0,0,0,0|1,0,1]=4 2783 B7R0.6 CC(=O)OCC(=O)Cl MCULE-3086938222 [0,2,0,0,0,0|1,0,1]=4 2784 B7R0.6 CC(=O)OCC(=O)O MCULE-6837320824 [0,2,0,0,0,0|1,0,1]=4 2785 B7R0.6 CC(=O)OCC(=S)N MCULE-7893306089 [0,2,0,0,0,0|1,0,1]=4 2786 B7R0.6 CC(=O)OCC(C)C MCULE-4530584087 [0,2,0,0,0,0|0,0,2]=4 2787 B7R0.6 CC(=O)OCC(C)O MCULE-3660209140 [0,2,0,0,0,0|0,0,2]=4 2788 B7R0.6 CC(=O)OCC(F)F MCULE-9491615455 [0,2,0,0,0,0|1,0,1]=4 2789 B7R0.6 CC(=O)ON=C(C)C MCULE-4373487613 [0,2,0,0,0,0|1,0,0]=3 2790 B7R0.6 CC(=O)SCC(=O)O MCULE-1974657694 [0,2,0,0,0,0|1,0,1]=4 2791 B7R0.6 CC(=S)NCC(=O)O MCULE-9052571833 [0,2,0,0,0,0|1,0,1]=4 2792 B7R0.6 CC(C)/C=C/C(=O)O MCULE-1713089516 [0,2,0,0,0,0|1,0,0]=3 2793 B7R0.6 CC(C)/C=C/N(=O)=O MCULE-8386755735 [0,2,0,0,0,0|2,0,0]=4 2794 B7R0.6 CC(C)C=CC(=O)O MCULE-3981825295 [0,2,0,0,0,0|1,0,0]=3 2795 B7R0.6 CC(C)C=C[N+](=O)[O-] MCULE-1892466644 [0,2,0,0,0,0|2,0,0]=4 2796 B7R0.6 CC(O)C=CC(C)O MCULE-1362403822 [0,2,0,0,0,0|0,0,2]=4 2797 B7R0.6 CN(C)/C=C/N(=O)=O MCULE-7969743170 [0,2,0,0,0,0|2,0,0]=4 2798 B7R0.6 CN(C)C=CC(=S)N MCULE-7137295535 [0,2,0,0,0,0|1,1,0]=4 2799 B7R0.6 CN(C)C=C[N+](=O)[O-] MCULE-6966490578 [0,2,0,0,0,0|2,0,0]=4 2800 B7R0.6 NC(=O)/C=C/C(=O)N MCULE-4395066945 [0,2,0,0,0,0|1,0,1]=4 2801 B7R0.6 NC(=O)/C=C/C(=O)O MCULE-4042951919 [0,2,0,0,0,0|1,0,1]=4 2802 B7R0.6 NC(=O)/C=C\C(=O)O MCULE-9066996879 [0,2,0,0,0,0|1,0,1]=4 2803 B7R0.6 NC(=O)C=CC(=O)N MCULE-6392282813 [0,2,0,0,0,0|1,0,1]=4 2804 B7R0.6 NC(=O)C=CC(=O)O MCULE-2401877342 [0,2,0,0,0,0|1,0,1]=4 2805 B7R0.6 O=C(Cl)/C=C/C(=O)Cl MCULE-6214609191 [0,2,0,0,0,0|1,0,1]=4 2806 B7R0.6 O=C(Cl)C=CC(=O)Cl MCULE-7022763562 [0,2,0,0,0,0|1,0,1]=4 2807 B7R0.6 O=C(O)/C=C/C(=O)O MCULE-3549142744 [0,2,0,0,0,0|1,0,1]=4 2808 B7R0.6 O=C(O)/C=C/C(=O)O MCULE-5263906793 [0,2,0,0,0,0|1,0,1]=4 2809 B7R0.6 O=C(O)/C=C\C(=O)O MCULE-1113222985 [0,2,0,0,0,0|1,0,1]=4 2810 B7R0.6 O=C(O)C=CC(=O)O MCULE-5329407890 [0,2,0,0,0,0|1,0,1]=4 2811 B7R0.6 O=C(O)C=CC(=O)O MCULE-7492596773 [0,2,0,0,0,0|1,0,1]=4 2812 B7R0.6 O=C(O)C=CC(=O)O MCULE-8076793268 [0,2,0,0,0,0|1,0,1]=4 2813 B7R0.6 O=C(O)C=CC(=O)O MCULE-9488315563 [0,2,0,0,0,0|1,0,1]=4 2814 B7R0.6 O=C(O)C=CC(=O)O MCULE-9920754312 [0,2,0,0,0,0|1,0,1]=4 2815 B7R0.6 O=C(O)C=CC(F)F MCULE-5853046592 [0,2,0,0,0,0|1,0,0]=3 2816 B7R0.6 O=C([O-])/C=C/C(=O)[O-] MCULE-2177227992 [0,2,0,0,0,0|1,0,1]=4 2817 B7R0.6 O=C([O-])C=CC(=O)[O-] MCULE-1618249570 [0,2,0,0,0,0|1,0,1]=4 2818 B7R0.6 O=C([O-])C=CC([O-])O MCULE-6492820393 [0,2,0,0,0,0|1,0,0]=3 2819 B7R0.8 C(=CC(C)(C)C)CC MCULE-9989939606 [0,2,0,0,0,0|1,0,1]=4 2820 B7R0.8 CC/C=C/P(=O)(O)O MCULE-7978096920 [0,2,0,0,0,0|2,0,0]=4 2821 B7R0.8 COC=CS(=O)(=O)F MCULE-5868691047 [0,2,0,0,0,0|2,0,0]=4 2822 B7R0.8 CS(=O)(=O)C=CC#N MCULE-8484089026 [0,2,0,0,0,0|1,0,1]=4 2823 B7R0.8 CS(=O)(=O)C=CCBr MCULE-2706306694 [0,2,0,0,0,0|1,0,0]=3 2824 B7R0.8 CS(=O)(=O)C=CCN MCULE-2459661826 [0,2,0,0,0,0|1,0,0]=3 2825 B7R0.8 CS(=O)(=O)C=CCN MCULE-8330183267 [0,2,0,0,0,0|1,0,0]=3 2826 B7R0.8 C[N+](C)(C)C=CCO MCULE-2439698184 [0,2,0,0,0,0|2,0,0]=4 2827 B7R0.8 C[N+](C)(C)C=CCO MCULE-5907002625 [0,2,0,0,0,0|2,0,0]=4 2828 B7R0.8 C[Si](C)(C)C=CCO MCULE-2183675950 [0,2,0,0,0,0|1,1,0]=4 2829 B7R0.8 O=S(=O)([O-])C=CCO MCULE-6757258095 [0,2,0,0,0,0|2,0,0]=4 2830 B7R0.8 O=S(=O)([O-])C=CCO MCULE-8698576668 [0,2,0,0,0,0|2,0,0]=4 2831 B5R1.2 BrC1=CCC1 MCULE-7839710306 [1,0,0,1,0,0|1,0,0]=3 2832 B5R1.2 C=C1CCC1 MCULE-8318650413 [1,0,0,1,0,0|1,0,1]=4 2833 B5R1.2 O=C1CCC1 MCULE-4870967355 [1,0,0,1,0,0|0,0,1]=3 2834 B5R1.2 O=C1CCN1 MCULE-9053067221 [1,0,0,1,0,0|1,0,0]=3 2835 B5R1.2 O=C1CCO1 MCULE-1277069147 [1,0,0,1,0,0|1,0,0]=3 2836 B5R1.2 O=C1CNC1 MCULE-5171659870 [1,0,0,1,0,0|1,0,1]=4 2837 B5R1.2 O=C1CNC1 MCULE-8293494956 [1,0,0,1,0,0|1,0,1]=4 2838 B5R1.2 O=C1COC1 MCULE-6847248632 [1,0,0,1,0,0|1,0,1]=4 2839 B5R1.2 O=C1CSC1 MCULE-4436071261 [1,0,0,1,0,0|1,0,1]=4 2840 B5R1.3 C=CC1CC1 MCULE-4323158851 [1,0,0,1,0,0|1,0,1]=4 2841 B5R1.3 C=CC1CO1 MCULE-1428696186 [1,0,0,1,0,0|0,0,2]=4 2842 B5R1.3 [C@@H]1(CO1)C=C MCULE-9776744095 [1,0,0,1,0,0|0,0,2]=4 2843 B5R1.3 [C@H]1(CO1)C=C MCULE-7934901088 [1,0,0,1,0,0|0,0,2]=4 2844 B5R1.1 C1=CCC=C1 MCULE-1776679581 [1,0,0,1,0,0|0,0,1]=3 2845 B5R1.1 C1=CCCC1 MCULE-8785635218 [1,0,0,1,0,0|0,0,1]=3 2846 B5R1.1 C1=CCNC1 MCULE-4645888757 [1,0,0,1,0,0|1,0,1]=4 2847 B5R1.1 C1=CCNC1 MCULE-7386427096 [1,0,0,1,0,0|1,0,1]=4 2848 B5R1.1 C1=CCOC1 MCULE-1252378718 [1,0,0,1,0,0|0,0,2]=4 2849 B5R1.1 C1=CCSC1 MCULE-7848219599 [1,0,0,1,0,0|0,1,1]=4 2850 B5R1.1 C1=CNC=C1 MCULE-7417495535 [1,0,0,1,0,0|1,0,1]=4 2851 B5R1.1 C1=CNN=C1 MCULE-9342475145 [1,0,0,1,0,0|2,0,0]=4 2852 B5R1.1 C1=COC=C1 MCULE-6076190179 [1,0,0,1,0,0|0,0,2]=4 2853 B5R1.1 C1=COCC1 MCULE-7714726225 [1,0,0,1,0,0|1,0,0]=3 2854 B5R1.1 C1=CON=C1 MCULE-4177650025 [1,0,0,1,0,0|1,0,1]=4 2855 B5R1.1 C1=CSC=C1 MCULE-5759025979 [1,0,0,1,0,0|0,1,1]=4 2856 B5R1.1 C1=CSN=C1 MCULE-7711497319 [1,0,0,1,0,0|1,1,0]=4 2857 B5R1.1 C1=C[Se]C=C1 MCULE-2438977476 [1,0,0,1,0,0|0,1,1]=4 2858 B5R1.1 C1=NCCN1 MCULE-6281004177 [1,0,0,1,0,0|2,0,0]=4 2859 B5R1.1 C1=NNCC1 MCULE-2270087414 [1,0,0,1,0,0|2,0,0]=4 2860 B7R1.1 BrCC1=CC=CO1 MCULE-5096860465 [0,1,0,1,0,0|0,0,2]=4 2861 B7R1.1 BrCC1=CC=CS1 MCULE-6293280067 [0,1,0,1,0,0|0,1,1]=4 2862 B7R1.1 BrCC1=CC=NO1 MCULE-4124334018 [0,1,0,1,0,0|1,0,1]=4 2863 B7R1.1 BrCC1=CC=NS1 MCULE-3188918692 [0,1,0,1,0,0|1,1,0]=4 2864 B7R1.1 BrCC1=CCCC1 MCULE-9208619526 [0,1,0,1,0,0|1,0,1]=4 2865 B7R1.1 BrCC1=COC=C1 MCULE-3143969430 [0,1,0,1,0,0|2,0,0]=4 2866 B7R1.1 BrCC1=CSC=C1 MCULE-1765288837 [0,1,0,1,0,0|2,0,0]=4 2867 B7R1.1 BrCC1=NNC=C1 MCULE-6526927748 [0,1,0,1,0,0|2,0,0]=4 2868 B7R1.1 BrCC1=NNC=C1 MCULE-9410968974 [0,1,0,1,0,0|2,0,0]=4 2869 B7R1.1 BrCC1=NOC=C1 MCULE-2989529472 [0,1,0,1,0,0|2,0,0]=4 2870 B7R1.1 BrCC1=NSC=C1 MCULE-8503387099 [0,1,0,1,0,0|2,0,0]=4 2871 B7R1.1 BrCC1C=CCC1 MCULE-4270104932 [0,1,0,1,0,0|1,0,1]=4 2872 B7R1.1 CCC1=CC=CN1 MCULE-9168935708 [0,1,0,1,0,0|1,0,1]=4 2873 B7R1.1 CCC1=CC=CO1 MCULE-6819919667 [0,1,0,1,0,0|0,0,2]=4 2874 B7R1.1 CCC1=CC=CS1 MCULE-1811294638 [0,1,0,1,0,0|0,1,1]=4 2875 B7R1.1 CCC1=CC=NO1 MCULE-9851288273 [0,1,0,1,0,0|1,0,1]=4 2876 B7R1.1 CCC1=CCCC1 MCULE-5154730597 [0,1,0,1,0,0|1,0,1]=4 2877 B7R1.1 CCC1=CNC=C1 MCULE-7105940220 [0,1,0,1,0,0|2,0,0]=4 2878 B7R1.1 CCC1=CSC=C1 MCULE-7192433774 [0,1,0,1,0,0|2,0,0]=4 2879 B7R1.1 CCC1=NNC=C1 MCULE-4688737607 [0,1,0,1,0,0|2,0,0]=4 2880 B7R1.1 CCC1C=CCN1 MCULE-4549893906 [0,1,0,1,0,0|1,0,1]=4 2881 B7R1.1 CCC1C=CCN1 MCULE-7209552603 [0,1,0,1,0,0|1,0,1]=4 2882 B7R1.1 CNC1=CC=CS1 MCULE-4218853022 [0,1,0,1,0,0|0,1,1]=4 2883 B7R1.1 CNC1=CC=NN1 MCULE-8114468592 [0,1,0,1,0,0|2,0,0]=4 2884 B7R1.1 CNC1=CSC=C1 MCULE-1287628025 [0,1,0,1,0,0|2,0,0]=4 2885 B7R1.1 CNC1=CSC=C1 MCULE-5325332143 [0,1,0,1,0,0|2,0,0]=4 2886 B7R1.1 CNC1=NOC=C1 MCULE-1266569249 [0,1,0,1,0,0|2,0,0]=4 2887 B7R1.1 CNC1=NOC=C1 MCULE-2599186829 [0,1,0,1,0,0|2,0,0]=4 2888 B7R1.1 COC1=CC=CO1 MCULE-4991744131 [0,1,0,1,0,0|0,0,2]=4 2889 B7R1.1 COC1=CC=CS1 MCULE-9593910029 [0,1,0,1,0,0|0,1,1]=4 2890 B7R1.1 COC1=CCCC1 MCULE-6260649761 [0,1,0,1,0,0|0,0,2]=4 2891 B7R1.1 COC1=CCCN1 MCULE-6283476666 [0,1,0,1,0,0|1,0,1]=4 2892 B7R1.1 COC1=COC=C1 MCULE-7798852925 [0,1,0,1,0,0|2,0,0]=4 2893 B7R1.1 COC1=CSC=C1 MCULE-3476811638 [0,1,0,1,0,0|2,0,0]=4 2894 B7R1.1 COC1=NNC=C1 MCULE-5382090787 [0,1,0,1,0,0|2,0,0]=4 2895 B7R1.1 COC1=NSC=C1 MCULE-5378872433 [0,1,0,1,0,0|2,0,0]=4 2896 B7R1.1 CSC1=CC=CO1 MCULE-6438587509 [0,1,0,1,0,0|0,0,2]=4 2897 B7R1.1 CSC1=CC=CS1 MCULE-7026431414 [0,1,0,1,0,0|0,1,1]=4 2898 B7R1.1 CSC1=CSC=C1 MCULE-2498616036 [0,1,0,1,0,0|2,0,0]=4 2899 B7R1.1 ClCC1=CC=CO1 MCULE-2683635266 [0,1,0,1,0,0|0,0,2]=4 2900 B7R1.1 ClCC1=CC=CS1 MCULE-8332782682 [0,1,0,1,0,0|0,1,1]=4 2901 B7R1.1 ClCC1=CC=NO1 MCULE-5240884287 [0,1,0,1,0,0|1,0,1]=4 2902 B7R1.1 ClCC1=CC=NS1 MCULE-1735467564 [0,1,0,1,0,0|1,1,0]=4 2903 B7R1.1 ClCC1=CSC=C1 MCULE-7066080407 [0,1,0,1,0,0|2,0,0]=4 2904 B7R1.1 ClCC1=NNC=C1 MCULE-1796939171 [0,1,0,1,0,0|2,0,0]=4 2905 B7R1.1 ClCC1=NNC=C1 MCULE-4973996041 [0,1,0,1,0,0|2,0,0]=4 2906 B7R1.1 ClCC1=NOC=C1 MCULE-2047090303 [0,1,0,1,0,0|2,0,0]=4 2907 B7R1.1 ClCC1=NSC=C1 MCULE-6780613233 [0,1,0,1,0,0|2,0,0]=4 2908 B7R1.1 ICC1=CC=CO1 MCULE-7510696289 [0,1,0,1,0,0|0,0,2]=4 2909 B7R1.1 N#CC1=CCCC1 MCULE-5654080085 [0,1,0,1,0,0|1,0,1]=4 2910 B7R1.1 NCC1=CC=CN1 MCULE-3221298054 [0,1,0,1,0,0|1,0,1]=4 2911 B7R1.1 NCC1=CC=CN1 MCULE-5686156853 [0,1,0,1,0,0|1,0,1]=4 2912 B7R1.1 NCC1=CC=CO1 MCULE-3035218209 [0,1,0,1,0,0|0,0,2]=4 2913 B7R1.1 NCC1=CC=CO1 MCULE-8280847881 [0,1,0,1,0,0|0,0,2]=4 2914 B7R1.1 NCC1=CC=CS1 MCULE-5730076896 [0,1,0,1,0,0|0,1,1]=4 2915 B7R1.1 NCC1=CC=CS1 MCULE-5815289362 [0,1,0,1,0,0|0,1,1]=4 2916 B7R1.1 NCC1=CC=NN1 MCULE-2352502395 [0,1,0,1,0,0|2,0,0]=4 2917 B7R1.1 NCC1=CC=NN1 MCULE-7934942905 [0,1,0,1,0,0|2,0,0]=4 2918 B7R1.1 NCC1=CC=NN1 MCULE-9469121087 [0,1,0,1,0,0|2,0,0]=4 2919 B7R1.1 NCC1=CC=NO1 MCULE-4504896342 [0,1,0,1,0,0|1,0,1]=4 2920 B7R1.1 NCC1=CC=NO1 MCULE-6113708508 [0,1,0,1,0,0|1,0,1]=4 2921 B7R1.1 NCC1=CC=NS1 MCULE-2457899011 [0,1,0,1,0,0|1,1,0]=4 2922 B7R1.1 NCC1=CC=NS1 MCULE-8286613579 [0,1,0,1,0,0|1,1,0]=4 2923 B7R1.1 NCC1=CC=NS1 MCULE-9144560486 [0,1,0,1,0,0|1,1,0]=4 2924 B7R1.1 NCC1=CNC=C1 MCULE-1100801530 [0,1,0,1,0,0|2,0,0]=4 2925 B7R1.1 NCC1=CNC=C1 MCULE-8377955542 [0,1,0,1,0,0|2,0,0]=4 2926 B7R1.1 NCC1=COC=C1 MCULE-2572059213 [0,1,0,1,0,0|2,0,0]=4 2927 B7R1.1 NCC1=COC=C1 MCULE-3826062772 [0,1,0,1,0,0|2,0,0]=4 2928 B7R1.1 NCC1=CSC=C1 MCULE-1358443205 [0,1,0,1,0,0|2,0,0]=4 2929 B7R1.1 NCC1=CSC=C1 MCULE-7400311305 [0,1,0,1,0,0|2,0,0]=4 2930 B7R1.1 NCC1=NOC=C1 MCULE-4678014837 [0,1,0,1,0,0|2,0,0]=4 2931 B7R1.1 NCC1=NOC=C1 MCULE-6900654675 [0,1,0,1,0,0|2,0,0]=4 2932 B7R1.1 NCC1=NSC=C1 MCULE-1665275335 [0,1,0,1,0,0|2,0,0]=4 2933 B7R1.1 NCC1=NSC=C1 MCULE-4779946656 [0,1,0,1,0,0|2,0,0]=4 2934 B7R1.1 NCC1C=CCC1 MCULE-5829076156 [0,1,0,1,0,0|1,0,1]=4 2935 B7R1.1 NCC1C=CCC1 MCULE-8381701177 [0,1,0,1,0,0|1,0,1]=4 2936 B7R1.1 O=CC1=CC=CN1 MCULE-4586543663 [0,1,0,1,0,0|1,0,1]=4 2937 B7R1.1 O=CC1=CC=CO1 MCULE-5757882837 [0,1,0,1,0,0|1,0,1]=4 2938 B7R1.1 O=CC1=CC=CS1 MCULE-8254409353 [0,1,0,1,0,0|1,0,1]=4 2939 B7R1.1 O=CC1=CC=C[Se]1 MCULE-2409744709 [0,1,0,1,0,0|1,0,1]=4 2940 B7R1.1 O=CC1=CC=NO1 MCULE-9603824695 [0,1,0,1,0,0|2,0,0]=4 2941 B7R1.1 O=CC1=CC=NS1 MCULE-1236687243 [0,1,0,1,0,0|2,0,0]=4 2942 B7R1.1 O=CC1=CCCC1 MCULE-2270030217 [0,1,0,1,0,0|0,0,1]=3 2943 B7R1.1 O=CC1=CCCO1 MCULE-3464963164 [0,1,0,1,0,0|1,0,1]=4 2944 B7R1.1 O=CC1=CCSC1 MCULE-9591036145 [0,1,0,1,0,0|1,0,1]=4 2945 B7R1.1 O=CC1=CNC=C1 MCULE-2454944558 [0,1,0,1,0,0|1,0,1]=4 2946 B7R1.1 O=CC1=COC=C1 MCULE-4433731812 [0,1,0,1,0,0|1,0,1]=4 2947 B7R1.1 O=CC1=CSC=C1 MCULE-4096224591 [0,1,0,1,0,0|1,0,1]=4 2948 B7R1.1 O=CC1=NNC=C1 MCULE-5970837649 [0,1,0,1,0,0|2,0,0]=4 2949 B7R1.1 O=CC1=NOC=C1 MCULE-6315054980 [0,1,0,1,0,0|2,0,0]=4 2950 B7R1.1 O=CC1=NSC=C1 MCULE-2006644927 [0,1,0,1,0,0|2,0,0]=4 2951 B7R1.1 OCC1=CC=CN1 MCULE-5325446270 [0,1,0,1,0,0|1,0,1]=4 2952 B7R1.1 OCC1=CC=CO1 MCULE-4977977402 [0,1,0,1,0,0|0,0,2]=4 2953 B7R1.1 OCC1=CC=CS1 MCULE-8365761000 [0,1,0,1,0,0|0,1,1]=4 2954 B7R1.1 OCC1=CC=NN1 MCULE-9206734976 [0,1,0,1,0,0|2,0,0]=4 2955 B7R1.1 OCC1=CC=NO1 MCULE-9887136642 [0,1,0,1,0,0|1,0,1]=4 2956 B7R1.1 OCC1=CC=NS1 MCULE-5309327051 [0,1,0,1,0,0|1,1,0]=4 2957 B7R1.1 OCC1=CCCC1 MCULE-8850570361 [0,1,0,1,0,0|0,0,2]=4 2958 B7R1.1 OCC1=CNC=C1 MCULE-3286092527 [0,1,0,1,0,0|2,0,0]=4 2959 B7R1.1 OCC1=COC=C1 MCULE-1188853308 [0,1,0,1,0,0|2,0,0]=4 2960 B7R1.1 OCC1=CSC=C1 MCULE-5715575511 [0,1,0,1,0,0|2,0,0]=4 2961 B7R1.1 OCC1=NNC=C1 MCULE-7625791296 [0,1,0,1,0,0|2,0,0]=4 2962 B7R1.1 OCC1=NOC=C1 MCULE-3216265153 [0,1,0,1,0,0|2,0,0]=4 2963 B7R1.1 OCC1=NSC=C1 MCULE-8963767199 [0,1,0,1,0,0|2,0,0]=4 2964 B7R1.1 OCC1C=CCC1 MCULE-1237002603 [0,1,0,1,0,0|0,0,2]=4 2965 B7R1.1 OCC1C=CCN1 MCULE-1461746159 [0,1,0,1,0,0|1,0,1]=4 2966 B7R1.1 OCC1C=CCN1 MCULE-5814337815 [0,1,0,1,0,0|1,0,1]=4 2967 B7R1.1 SCC1=CC=CO1 MCULE-3419389361 [0,1,0,1,0,0|0,0,2]=4 2968 B7R1.1 SCC1=CC=CS1 MCULE-8555593113 [0,1,0,1,0,0|0,1,1]=4 2969 B7R1.2 BrC1C=CC(C1)Br MCULE-1382581877 [0,1,0,1,0,0|1,0,1]=4 2970 B7R1.2 C1(CNC(=O)C1)N MCULE-6663942203 [0,1,0,1,0,0|1,0,1]=4 2971 B7R1.2 C1(CNC(=O)C1)N MCULE-7862049809 [0,1,0,1,0,0|1,0,1]=4 2972 B7R1.2 C1(CNC(=O)C1)O MCULE-5557473335 [0,1,0,1,0,0|1,0,1]=4 2973 B7R1.2 C1(COC(=O)N1)C MCULE-2821940224 [0,1,0,1,0,0|1,0,1]=4 2974 B7R1.2 C=C1C=CC(=O)O1 MCULE-1046353319 [0,1,0,1,0,0|1,0,1]=4 2975 B7R1.2 C=C1CCC(=O)O1 MCULE-2485348963 [0,1,0,1,0,0|1,0,0]=3 2976 B7R1.2 CC1=CC(=CO1)Br MCULE-1365881695 [0,1,0,1,0,0|0,0,2]=4 2977 B7R1.2 CC1=CC(=CS1)Br MCULE-9701843608 [0,1,0,1,0,0|0,1,1]=4 2978 B7R1.2 CC1=CC(=CS1)Cl MCULE-1661832667 [0,1,0,1,0,0|0,1,1]=4 2979 B7R1.2 CC1=CC(=CS1)N MCULE-4677626148 [0,1,0,1,0,0|0,1,1]=4 2980 B7R1.2 CC1=CC(=CS1)N MCULE-4954759044 [0,1,0,1,0,0|0,1,1]=4 2981 B7R1.2 CC1=CC(=NN1)Br MCULE-1516612696 [0,1,0,1,0,0|2,0,0]=4 2982 B7R1.2 CC1=CC(=NN1)C MCULE-4873265902 [0,1,0,1,0,0|1,0,0]=3 2983 B7R1.2 CC1=CC(=NN1)C MCULE-8100496522 [0,1,0,1,0,0|1,0,0]=3 2984 B7R1.2 CC1=CC(=NN1)F MCULE-1447632064 [0,1,0,1,0,0|2,0,0]=4 2985 B7R1.2 CC1=CC(=NN1)F MCULE-6096639447 [0,1,0,1,0,0|2,0,0]=4 2986 B7R1.2 CC1=CC(=NN1)I MCULE-9212614137 [0,1,0,1,0,0|2,0,0]=4 2987 B7R1.2 CC1=CC(=NO1)Br MCULE-8203630178 [0,1,0,1,0,0|1,0,1]=4 2988 B7R1.2 CC1=CC(=NO1)C MCULE-5128459474 [0,1,0,1,0,0|0,0,1]=3 2989 B7R1.2 CC1=CC(=NO1)N MCULE-4538523254 [0,1,0,1,0,0|1,0,1]=4 2990 B7R1.2 CC1=CC(=NS1)N MCULE-2006841208 [0,1,0,1,0,0|1,1,0]=4 2991 B7R1.2 CC1=CC(=NS1)N MCULE-5644544748 [0,1,0,1,0,0|1,1,0]=4 2992 B7R1.2 CC1=CC(=O)CC1 MCULE-5496838191 [0,1,0,1,0,0|0,0,0]=2 2993 B7R1.2 CC1=CC(=O)CO1 MCULE-6570401610 [0,1,0,1,0,0|0,0,0]=2 2994 B7R1.2 CC1=CC(=O)N=N1 MCULE-8356895370 [0,1,0,1,0,0|1,0,0]=3 2995 B7R1.2 CC1=CC(=O)NO1 MCULE-4569959155 [0,1,0,1,0,0|1,0,0]=3 2996 B7R1.2 CC1=CC(=O)OC1 MCULE-6549202383 [0,1,0,1,0,0|0,0,0]=2 2997 B7R1.2 CC1=CC=C(N1)C MCULE-2630115640 [0,1,0,1,0,0|1,0,0]=3 2998 B7R1.2 CC1=CC=C(N1)Cl MCULE-6650692655 [0,1,0,1,0,0|1,0,1]=4 2999 B7R1.2 CC1=CC=C(O1)Br MCULE-2815956180 [0,1,0,1,0,0|0,0,2]=4 3000 B7R1.2 CC1=CC=C(O1)C MCULE-2776549830 [0,1,0,1,0,0|0,0,1]=3 3001 B7R1.2 CC1=CC=C(O1)N MCULE-5583871788 [0,1,0,1,0,0|0,0,2]=4 3002 B7R1.2 CC1=CC=C(S1)Br MCULE-9870970320 [0,1,0,1,0,0|0,1,1]=4 3003 B7R1.2 CC1=CC=C(S1)C MCULE-6651491312 [0,1,0,1,0,0|0,1,0]=3 3004 B7R1.2 CC1=CC=C(S1)C MCULE-7283016932 [0,1,0,1,0,0|0,1,0]=3 3005 B7R1.2 CC1=CC=C(S1)Cl MCULE-9463412923 [0,1,0,1,0,0|0,1,1]=4 3006 B7R1.2 CC1=CC=C(S1)I MCULE-3339364572 [0,1,0,1,0,0|0,1,1]=4 3007 B7R1.2 CC1=CC=C(S1)N MCULE-1672887913 [0,1,0,1,0,0|0,1,1]=4 3008 B7R1.2 CC1=CC=C(S1)N MCULE-4947745341 [0,1,0,1,0,0|0,1,1]=4 3009 B7R1.2 CC1=CC=C(S1)O MCULE-7587913788 [0,1,0,1,0,0|0,1,1]=4 3010 B7R1.2 CC1=CC=C(S1)S MCULE-9072205252 [0,1,0,1,0,0|0,1,1]=4 3011 B7R1.2 CC1=CCC(=O)O1 MCULE-5954539189 [0,1,0,1,0,0|1,0,0]=3 3012 B7R1.2 CC1=CCC(=O)O1 MCULE-7236091694 [0,1,0,1,0,0|1,0,0]=3 3013 B7R1.2 CC1=CCC(=O)S1 MCULE-5812502919 [0,1,0,1,0,0|1,0,0]=3 3014 B7R1.2 CC1=CN(C=N1)C MCULE-2469544518 [0,1,0,1,0,0|2,0,0]=4 3015 B7R1.2 CC1=CN(N=C1)C MCULE-7303683364 [0,1,0,1,0,0|2,0,0]=4 3016 B7R1.2 CC1=CN(N=N1)C MCULE-6586051343 [0,1,0,1,0,0|2,0,0]=4 3017 B7R1.2 CC1=CN=C(N1)N MCULE-5849111364 [0,1,0,1,0,0|2,0,0]=4 3018 B7R1.2 CC1=CN=C(N1)N MCULE-9885122590 [0,1,0,1,0,0|2,0,0]=4 3019 B7R1.2 CC1=CN=C(O1)Br MCULE-3952379614 [0,1,0,1,0,0|1,0,1]=4 3020 B7R1.2 CC1=CN=C(O1)C MCULE-8416988900 [0,1,0,1,0,0|0,0,1]=3 3021 B7R1.2 CC1=CN=C(O1)Cl MCULE-1762464687 [0,1,0,1,0,0|1,0,1]=4 3022 B7R1.2 CC1=CN=C(O1)Cl MCULE-3921580627 [0,1,0,1,0,0|1,0,1]=4 3023 B7R1.2 CC1=CN=C(O1)I MCULE-4568617242 [0,1,0,1,0,0|1,0,1]=4 3024 B7R1.2 CC1=CN=C(O1)N MCULE-5846833894 [0,1,0,1,0,0|1,0,1]=4 3025 B7R1.2 CC1=CN=C(S1)Br MCULE-5024376122 [0,1,0,1,0,0|1,1,0]=4 3026 B7R1.2 CC1=CN=C(S1)C MCULE-9725720944 [0,1,0,1,0,0|0,1,0]=3 3027 B7R1.2 CC1=CN=C(S1)Cl MCULE-4868939891 [0,1,0,1,0,0|1,1,0]=4 3028 B7R1.2 CC1=CN=C(S1)I MCULE-2496302523 [0,1,0,1,0,0|1,1,0]=4 3029 B7R1.2 CC1=CN=C(S1)N MCULE-5408259983 [0,1,0,1,0,0|1,1,0]=4 3030 B7R1.2 CC1=CN=C(S1)N MCULE-8973432865 [0,1,0,1,0,0|1,1,0]=4 3031 B7R1.2 CC1=CN=C(S1)O MCULE-4228024619 [0,1,0,1,0,0|1,0,1]=4 3032 B7R1.2 CC1=CNC(=C1)C MCULE-6480137920 [0,1,0,1,0,0|1,0,0]=3 3033 B7R1.2 CC1=CNC(=N1)Br MCULE-2148866894 [0,1,0,1,0,0|2,0,0]=4 3034 B7R1.2 CC1=CNC(=N1)C MCULE-1883967566 [0,1,0,1,0,0|1,0,0]=3 3035 B7R1.2 CC1=CNC(=N1)I MCULE-7172464469 [0,1,0,1,0,0|2,0,0]=4 3036 B7R1.2 CC1=CNC(=N1)N MCULE-2945170552 [0,1,0,1,0,0|2,0,0]=4 3037 B7R1.2 CC1=CNC(=N1)S MCULE-1670645296 [0,1,0,1,0,0|1,1,0]=4 3038 B7R1.2 CC1=CNC(=O)N1 MCULE-7571832495 [0,1,0,1,0,0|1,0,0]=3 3039 B7R1.2 CC1=COC(=C1)C MCULE-9104872009 [0,1,0,1,0,0|0,0,1]=3 3040 B7R1.2 CC1=COC(=N)N1 MCULE-2875662146 [0,1,0,1,0,0|2,0,0]=4 3041 B7R1.2 CC1=COC(=N1)Br MCULE-3628895128 [0,1,0,1,0,0|2,0,0]=4 3042 B7R1.2 CC1=COC(=N1)C MCULE-3626673481 [0,1,0,1,0,0|1,0,0]=3 3043 B7R1.2 CC1=COC(=N1)Cl MCULE-8812650506 [0,1,0,1,0,0|2,0,0]=4 3044 B7R1.2 CC1=COC(=N1)S MCULE-7659225823 [0,1,0,1,0,0|1,1,0]=4 3045 B7R1.2 CC1=CSC(=C1)Br MCULE-1301546959 [0,1,0,1,0,0|1,0,1]=4 3046 B7R1.2 CC1=CSC(=C1)C MCULE-9938369670 [0,1,0,1,0,0|0,1,0]=3 3047 B7R1.2 CC1=CSC(=C1)Cl MCULE-8287471659 [0,1,0,1,0,0|1,0,1]=4 3048 B7R1.2 CC1=CSC(=C1)N MCULE-6517545234 [0,1,0,1,0,0|1,0,1]=4 3049 B7R1.2 CC1=CSC(=C1)N MCULE-8640058932 [0,1,0,1,0,0|1,0,1]=4 3050 B7R1.2 CC1=CSC(=C1)O MCULE-1324476521 [0,1,0,1,0,0|0,0,2]=4 3051 B7R1.2 CC1=CSC(=N1)Br MCULE-2425418650 [0,1,0,1,0,0|2,0,0]=4 3052 B7R1.2 CC1=CSC(=N1)C MCULE-2033387460 [0,1,0,1,0,0|1,0,0]=3 3053 B7R1.2 CC1=CSC(=N1)Cl MCULE-4864147999 [0,1,0,1,0,0|2,0,0]=4 3054 B7R1.2 CC1=CSC(=N1)F MCULE-7988737526 [0,1,0,1,0,0|2,0,0]=4 3055 B7R1.2 CC1=CSC(=N1)I MCULE-5254623055 [0,1,0,1,0,0|2,0,0]=4 3056 B7R1.2 CC1=CSC(=N1)N MCULE-3421653397 [0,1,0,1,0,0|2,0,0]=4 3057 B7R1.2 CC1=CSC(=N1)N MCULE-6034667920 [0,1,0,1,0,0|2,0,0]=4 3058 B7R1.2 CC1=CSC(=N1)S MCULE-4701705565 [0,1,0,1,0,0|1,1,0]=4 3059 B7R1.2 CC1=CSC(=O)N1 MCULE-6083480700 [0,1,0,1,0,0|1,0,0]=3 3060 B7R1.2 CC1=NC(=CN1)Br MCULE-7128800979 [0,1,0,1,0,0|2,0,0]=4 3061 B7R1.2 CC1=NC(=CN1)I MCULE-3668066625 [0,1,0,1,0,0|2,0,0]=4 3062 B7R1.2 CC1=NC(=CO1)Br MCULE-4921013012 [0,1,0,1,0,0|2,0,0]=4 3063 B7R1.2 CC1=NC(=CS1)Br MCULE-7210746643 [0,1,0,1,0,0|2,0,0]=4 3064 B7R1.2 CC1=NC(=CS1)N MCULE-3086911944 [0,1,0,1,0,0|2,0,0]=4 3065 B7R1.2 CC1=NC(=CS1)N MCULE-4543325094 [0,1,0,1,0,0|2,0,0]=4 3066 B7R1.2 CC1=NC(=CS1)O MCULE-2657600711 [0,1,0,1,0,0|1,0,1]=4 3067 B7R1.2 CC1=NC(=O)N=N1 MCULE-2642903272 [0,1,0,1,0,0|2,0,0]=4 3068 B7R1.2 CC1=NC(=O)NN1 MCULE-7112378155 [0,1,0,1,0,0|2,0,0]=4 3069 B7R1.2 CC1=NC=C(O1)Br MCULE-1770948017 [0,1,0,1,0,0|1,0,1]=4 3070 B7R1.2 CC1=NC=C(O1)Br MCULE-4635846619 [0,1,0,1,0,0|1,0,1]=4 3071 B7R1.2 CC1=NC=C(O1)N MCULE-9670426348 [0,1,0,1,0,0|1,0,1]=4 3072 B7R1.2 CC1=NC=C(S1)Br MCULE-7258487155 [0,1,0,1,0,0|1,1,0]=4 3073 B7R1.2 CC1=NC=C(S1)Cl MCULE-5653448054 [0,1,0,1,0,0|1,1,0]=4 3074 B7R1.2 CC1=NC=C(S1)I MCULE-1452945094 [0,1,0,1,0,0|1,1,0]=4 3075 B7R1.2 CC1=NC=C(S1)N MCULE-2117348978 [0,1,0,1,0,0|1,1,0]=4 3076 B7R1.2 CC1=NC=C(S1)N MCULE-3448900159 [0,1,0,1,0,0|1,1,0]=4 3077 B7R1.2 CC1=NN(C=C1)C MCULE-4991402354 [0,1,0,1,0,0|1,0,0]=3 3078 B7R1.2 CC1=NN(N=C1)C MCULE-4169729723 [0,1,0,1,0,0|2,0,0]=4 3079 B7R1.2 CC1=NN=C(C1)C MCULE-3200040203 [0,1,0,1,0,0|1,0,1]=4 3080 B7R1.2 CC1=NN=C(C1)N MCULE-4185535753 [0,1,0,1,0,0|2,0,0]=4 3081 B7R1.2 CC1=NN=C(O1)C MCULE-8675560585 [0,1,0,1,0,0|1,0,1]=4 3082 B7R1.2 CC1=NN=C(S1)C MCULE-1619155212 [0,1,0,1,0,0|1,1,0]=4 3083 B7R1.2 CC1=NNC(=C1)Cl MCULE-9047691966 [0,1,0,1,0,0|2,0,0]=4 3084 B7R1.2 CC1=NNC(=C1)I MCULE-7626013113 [0,1,0,1,0,0|2,0,0]=4 3085 B7R1.2 CC1=NNC(=C1)N MCULE-5982415678 [0,1,0,1,0,0|2,0,0]=4 3086 B7R1.2 CC1=NNC(=C1)N MCULE-8265446300 [0,1,0,1,0,0|2,0,0]=4 3087 B7R1.2 CC1=NNC(=C1)N MCULE-8755398394 [0,1,0,1,0,0|2,0,0]=4 3088 B7R1.2 CC1=NNC(=C1)O MCULE-6802545425 [0,1,0,1,0,0|1,0,1]=4 3089 B7R1.2 CC1=NNC(=N1)C MCULE-6761346776 [0,1,0,1,0,0|2,0,0]=4 3090 B7R1.2 CC1=NNC(=O)C1 MCULE-2406140611 [0,1,0,1,0,0|1,0,0]=3 3091 B7R1.2 CC1=NOC(=C1)Br MCULE-6794061121 [0,1,0,1,0,0|1,0,1]=4 3092 B7R1.2 CC1=NOC(=C1)I MCULE-5795495546 [0,1,0,1,0,0|1,0,1]=4 3093 B7R1.2 CC1=NOC(=C1)N MCULE-2719601999 [0,1,0,1,0,0|1,0,1]=4 3094 B7R1.2 CC1=NOC(=C1)O MCULE-4469914138 [0,1,0,1,0,0|1,0,1]=4 3095 B7R1.2 CC1=NOC(=C1)[O-] MCULE-1851467961 [0,1,0,1,0,0|1,0,1]=4 3096 B7R1.2 CC1=NOC(=O)C1 MCULE-2665741338 [0,1,0,1,0,0|1,0,0]=3 3097 B7R1.2 CC1=NOC(=O)C1 MCULE-3084424307 [0,1,0,1,0,0|1,0,0]=3 3098 B7R1.2 CC1=NOC(=O)O1 MCULE-5416417255 [0,1,0,1,0,0|2,0,0]=4 3099 B7R1.2 CC1=NSC(=C1)Br MCULE-5311430268 [0,1,0,1,0,0|1,1,0]=4 3100 B7R1.2 CC1=NSC(=C1)Cl MCULE-3765249333 [0,1,0,1,0,0|1,1,0]=4 3101 B7R1.2 CC1=NSC(=C1)I MCULE-9076472601 [0,1,0,1,0,0|1,1,0]=4 3102 B7R1.2 CC1=NSC(=C1)N MCULE-1333657417 [0,1,0,1,0,0|1,1,0]=4 3103 B7R1.2 CC1=NSC(=C1)N MCULE-4917388600 [0,1,0,1,0,0|1,1,0]=4 3104 B7R1.2 CC1=NSC(=C1)N MCULE-8270730297 [0,1,0,1,0,0|1,1,0]=4 3105 B7R1.2 CC1=NSC(=N1)C MCULE-4847029690 [0,1,0,1,0,0|1,1,0]=4 3106 B7R1.2 CC1C=CC(=O)O1 MCULE-7172637771 [0,1,0,1,0,0|1,0,0]=3 3107 B7R1.2 CC1CC(=O)CO1 MCULE-7022597277 [0,1,0,1,0,0|0,0,2]=4 3108 B7R1.2 CC1CC(=O)CS1 MCULE-7518365363 [0,1,0,1,0,0|0,0,2]=4 3109 B7R1.2 CC1CC(=O)NN1 MCULE-2056748401 [0,1,0,1,0,0|1,0,1]=4 3110 B7R1.2 CC1CC(=O)NN1 MCULE-8107476665 [0,1,0,1,0,0|1,0,1]=4 3111 B7R1.2 CC1CCC(=O)C1 MCULE-6716533429 [0,1,0,1,0,0|0,0,2]=4 3112 B7R1.2 CC1CCC(=O)N1 MCULE-8928464449 [0,1,0,1,0,0|1,0,1]=4 3113 B7R1.2 CC1CCC(=O)N1 MCULE-9236321365 [0,1,0,1,0,0|1,0,1]=4 3114 B7R1.2 CC1CCC(=O)O1 MCULE-3014789527 [0,1,0,1,0,0|1,0,1]=4 3115 B7R1.2 CC1CNC(=O)C1 MCULE-7180589009 [0,1,0,1,0,0|0,0,2]=4 3116 B7R1.2 CC1CNC(=O)N1 MCULE-3789430210 [0,1,0,1,0,0|1,0,1]=4 3117 B7R1.2 CC1CNC(=O)O1 MCULE-1288358267 [0,1,0,1,0,0|1,0,1]=4 3118 B7R1.2 CC1COC(=O)C1 MCULE-7226555218 [0,1,0,1,0,0|0,0,2]=4 3119 B7R1.2 CC1COC(=O)N1 MCULE-5787960105 [0,1,0,1,0,0|1,0,1]=4 3120 B7R1.2 CC1COC(=O)O1 MCULE-9055336051 [0,1,0,1,0,0|1,0,1]=4 3121 B7R1.2 CC1CSC(=O)S1 MCULE-5074098161 [0,1,0,1,0,0|1,0,1]=4 3122 B7R1.2 CC1NCC(=O)N1 MCULE-9790180398 [0,1,0,1,0,0|1,0,1]=4 3123 B7R1.2 CN1C=CC(=C1)Br MCULE-2020278293 [0,1,0,1,0,0|1,0,1]=4 3124 B7R1.2 CN1C=CC(=C1)N MCULE-2805426691 [0,1,0,1,0,0|1,0,1]=4 3125 B7R1.2 CN1C=CC(=C1)N MCULE-3443863095 [0,1,0,1,0,0|1,0,1]=4 3126 B7R1.2 CN1C=CC(=C1)O MCULE-2504745844 [0,1,0,1,0,0|0,0,2]=4 3127 B7R1.2 CN1C=CC(=N1)Br MCULE-2140706128 [0,1,0,1,0,0|2,0,0]=4 3128 B7R1.2 CN1C=CC(=N1)Cl MCULE-7765518388 [0,1,0,1,0,0|2,0,0]=4 3129 B7R1.2 CN1C=CC(=N1)F MCULE-7853118859 [0,1,0,1,0,0|2,0,0]=4 3130 B7R1.2 CN1C=CC(=N1)I MCULE-4809829389 [0,1,0,1,0,0|2,0,0]=4 3131 B7R1.2 CN1C=CC(=N1)N MCULE-3298296740 [0,1,0,1,0,0|2,0,0]=4 3132 B7R1.2 CN1C=CC(=N1)N MCULE-8862989081 [0,1,0,1,0,0|2,0,0]=4 3133 B7R1.2 CN1C=CC(=N1)O MCULE-5118805950 [0,1,0,1,0,0|1,0,1]=4 3134 B7R1.2 CN1C=CC(=N1)S MCULE-9185539300 [0,1,0,1,0,0|1,1,0]=4 3135 B7R1.2 CN1C=C[N+](=C1)C MCULE-1968168294 [0,1,0,1,0,0|2,0,0]=4 3136 B7R1.2 CN1C=C[N+](=C1)C MCULE-2761334934 [0,1,0,1,0,0|2,0,0]=4 3137 B7R1.2 CN1C=C[N+](=C1)C MCULE-2821798506 [0,1,0,1,0,0|2,0,0]=4 3138 B7R1.2 CN1C=C[N+](=C1)C MCULE-3728272572 [0,1,0,1,0,0|2,0,0]=4 3139 B7R1.2 CN1C=C[N+](=C1)C MCULE-4777249746 [0,1,0,1,0,0|2,0,0]=4 3140 B7R1.2 CN1C=C[N+](=C1)C MCULE-8370562401 [0,1,0,1,0,0|2,0,0]=4 3141 B7R1.2 CN1C=NC(=O)N1 MCULE-8089843600 [0,1,0,1,0,0|2,0,0]=4 3142 B7R1.2 CN1CCC(=O)C1 MCULE-4017029823 [0,1,0,1,0,0|0,0,2]=4 3143 B7R1.2 CN1CCC(=O)C1 MCULE-8684002131 [0,1,0,1,0,0|0,0,2]=4 3144 B7R1.2 CN1N=CC(=O)N1 MCULE-1498333804 [0,1,0,1,0,0|2,0,0]=4 3145 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-1621276410 [0,1,0,1,0,0|0,0,2]=4 3146 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-8721208019 [0,1,0,1,0,0|0,0,2]=4 3147 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-2915942259 [0,1,0,1,0,0|1,0,1]=4 3148 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-8123247569 [0,1,0,1,0,0|1,0,1]=4 3149 B7R1.2 C[C@@H]1CCC(=O)O1 MCULE-5934008113 [0,1,0,1,0,0|1,0,1]=4 3150 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-2439559922 [0,1,0,1,0,0|0,0,2]=4 3151 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-7246323100 [0,1,0,1,0,0|0,0,2]=4 3152 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-8336717940 [0,1,0,1,0,0|1,0,1]=4 3153 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-9661080313 [0,1,0,1,0,0|1,0,1]=4 3154 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1121808555 [0,1,0,1,0,0|0,0,2]=4 3155 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1627827491 [0,1,0,1,0,0|0,0,2]=4 3156 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-2439588002 [0,1,0,1,0,0|1,0,1]=4 3157 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-5329850427 [0,1,0,1,0,0|1,0,1]=4 3158 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-3187800510 [0,1,0,1,0,0|1,0,1]=4 3159 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-6719271655 [0,1,0,1,0,0|1,0,1]=4 3160 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-3272300487 [0,1,0,1,0,0|0,0,2]=4 3161 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-4583858198 [0,1,0,1,0,0|0,0,2]=4 3162 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-5135895304 [0,1,0,1,0,0|0,0,2]=4 3163 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-6058896534 [0,1,0,1,0,0|0,0,2]=4 3164 B7R1.2 C[C@H]1CCC(=O)C1 MCULE-7319626625 [0,1,0,1,0,0|0,0,2]=4 3165 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-2618122031 [0,1,0,1,0,0|1,0,1]=4 3166 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-6630066118 [0,1,0,1,0,0|1,0,1]=4 3167 B7R1.2 C[C@H]1CCC(=O)O1 MCULE-5274272771 [0,1,0,1,0,0|1,0,1]=4 3168 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-3395896178 [0,1,0,1,0,0|0,0,2]=4 3169 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-8492971593 [0,1,0,1,0,0|0,0,2]=4 3170 B7R1.2 C[C@H]1COC(=O)C1 MCULE-6050720348 [0,1,0,1,0,0|0,0,2]=4 3171 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7240884474 [0,1,0,1,0,0|1,0,1]=4 3172 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7811823319 [0,1,0,1,0,0|1,0,1]=4 3173 B7R1.2 C[C@H]1COC(=O)O1 MCULE-2416711374 [0,1,0,1,0,0|1,0,1]=4 3174 B7R1.2 C[C@H]1COC(=O)O1 MCULE-4223856214 [0,1,0,1,0,0|1,0,1]=4 3175 B7R1.2 N=C1CSC(=O)N1 MCULE-9647262906 [0,1,0,1,0,0|2,0,0]=4 3176 B7R1.2 NC1=CC(=O)CC1 MCULE-9465243079 [0,1,0,1,0,0|0,0,0]=2 3177 B7R1.2 NC1=CC(=O)CS1 MCULE-9118810823 [0,1,0,1,0,0|1,0,0]=3 3178 B7R1.2 NC1=CC(=O)NN1 MCULE-6721529473 [0,1,0,1,0,0|2,0,0]=4 3179 B7R1.2 NC1=NC(=O)C=N1 MCULE-2020007120 [0,1,0,1,0,0|2,0,0]=4 3180 B7R1.2 NC1=NC(=O)C=N1 MCULE-3303233815 [0,1,0,1,0,0|2,0,0]=4 3181 B7R1.2 NC1=NC(=O)CO1 MCULE-5739646901 [0,1,0,1,0,0|2,0,0]=4 3182 B7R1.2 NC1=NC(=O)CS1 MCULE-1329225872 [0,1,0,1,0,0|2,0,0]=4 3183 B7R1.2 NC1=NC(=O)CS1 MCULE-6008399337 [0,1,0,1,0,0|2,0,0]=4 3184 B7R1.2 NC1=NCC(=O)N1 MCULE-7816305365 [0,1,0,1,0,0|2,0,0]=4 3185 B7R1.2 NC1=NCC(=O)N1 MCULE-9546104284 [0,1,0,1,0,0|2,0,0]=4 3186 B7R1.2 NC1=NCC(=O)S1 MCULE-1885235061 [0,1,0,1,0,0|2,0,0]=4 3187 B7R1.2 NC1=NNC(=O)C1 MCULE-1000997494 [0,1,0,1,0,0|2,0,0]=4 3188 B7R1.2 NC1C=CC(C1)O MCULE-1250487700 [0,1,0,1,0,0|0,0,2]=4 3189 B7R1.2 NC1CCC(=O)C1 MCULE-5102535286 [0,1,0,1,0,0|0,0,2]=4 3190 B7R1.2 NC1CCC(=O)C1 MCULE-7722818264 [0,1,0,1,0,0|0,0,2]=4 3191 B7R1.2 NC1CCC(=O)N1 MCULE-1843033026 [0,1,0,1,0,0|1,0,1]=4 3192 B7R1.2 NC1CCC(=O)N1 MCULE-7671057220 [0,1,0,1,0,0|1,0,1]=4 3193 B7R1.2 NC1CNC(=O)C1 MCULE-1690074091 [0,1,0,1,0,0|1,0,1]=4 3194 B7R1.2 NC1CNC(=O)C1 MCULE-2563813057 [0,1,0,1,0,0|1,0,1]=4 3195 B7R1.2 NC1CNC(=O)C1 MCULE-5332234739 [0,1,0,1,0,0|1,0,1]=4 3196 B7R1.2 NC1CNC(=O)C1 MCULE-9955937074 [0,1,0,1,0,0|1,0,1]=4 3197 B7R1.2 NC1COC(=O)C1 MCULE-1027386953 [0,1,0,1,0,0|1,0,1]=4 3198 B7R1.2 NC1COC(=O)C1 MCULE-1493825051 [0,1,0,1,0,0|1,0,1]=4 3199 B7R1.2 NC1COC(=O)C1 MCULE-3118610284 [0,1,0,1,0,0|1,0,1]=4 3200 B7R1.2 NC1COC(=O)C1 MCULE-8194840985 [0,1,0,1,0,0|1,0,1]=4 3201 B7R1.2 NC1N=CC(=O)S1 MCULE-9874802810 [0,1,0,1,0,0|2,0,0]=4 3202 B7R1.2 N[C@@H]1C=C[C@@H](C1)O MCULE-3439280280 [0,1,0,1,0,0|0,0,2]=4 3203 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-1502944618 [0,1,0,1,0,0|1,0,1]=4 3204 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-2444469131 [0,1,0,1,0,0|1,0,1]=4 3205 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-7277309874 [0,1,0,1,0,0|1,0,1]=4 3206 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-8533160250 [0,1,0,1,0,0|1,0,1]=4 3207 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-2437548952 [0,1,0,1,0,0|1,0,1]=4 3208 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4215135536 [0,1,0,1,0,0|1,0,1]=4 3209 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4884145743 [0,1,0,1,0,0|1,0,1]=4 3210 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-9276068415 [0,1,0,1,0,0|1,0,1]=4 3211 B7R1.2 N[C@H]1C=C[C@H](C1)O MCULE-2880951702 [0,1,0,1,0,0|0,0,2]=4 3212 B7R1.2 N[C@H]1C=C[C@H](C1)O MCULE-7715311088 [0,1,0,1,0,0|0,0,2]=4 3213 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-1884894725 [0,1,0,1,0,0|1,0,1]=4 3214 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-2130809002 [0,1,0,1,0,0|1,0,1]=4 3215 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-3881338264 [0,1,0,1,0,0|1,0,1]=4 3216 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-4324375667 [0,1,0,1,0,0|1,0,1]=4 3217 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-5900761307 [0,1,0,1,0,0|1,0,1]=4 3218 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-6007209179 [0,1,0,1,0,0|1,0,1]=4 3219 B7R1.2 N[C@H]1COC(=O)C1 MCULE-2936782126 [0,1,0,1,0,0|1,0,1]=4 3220 B7R1.2 N[C@H]1COC(=O)C1 MCULE-4255876921 [0,1,0,1,0,0|1,0,1]=4 3221 B7R1.2 N[C@H]1COC(=O)C1 MCULE-5377151477 [0,1,0,1,0,0|1,0,1]=4 3222 B7R1.2 N[C@H]1COC(=O)C1 MCULE-6406960509 [0,1,0,1,0,0|1,0,1]=4 3223 B7R1.2 O=C1C=C(CC1)Br MCULE-8421005141 [0,1,0,1,0,0|0,0,0]=2 3224 B7R1.2 O=C1C=C(CC1)Cl MCULE-4481059890 [0,1,0,1,0,0|0,0,0]=2 3225 B7R1.2 O=C1C=C(CC1)I MCULE-9887353763 [0,1,0,1,0,0|0,0,0]=2 3226 B7R1.2 O=C1C=C(CC1)O MCULE-4815747510 [0,1,0,1,0,0|0,0,0]=2 3227 B7R1.2 O=C1C=C(CN1)Br MCULE-7250904402 [0,1,0,1,0,0|1,0,0]=3 3228 B7R1.2 O=C1C=C(CN1)O MCULE-4305405716 [0,1,0,1,0,0|1,0,0]=3 3229 B7R1.2 O=C1C=C(CO1)Br MCULE-8883097432 [0,1,0,1,0,0|1,0,0]=3 3230 B7R1.2 O=C1C=C(CO1)O MCULE-5095558101 [0,1,0,1,0,0|1,0,0]=3 3231 B7R1.2 O=C1C=C(SN1)Cl MCULE-6118293142 [0,1,0,1,0,0|2,0,0]=4 3232 B7R1.2 O=C1C=CC(=O)C1 MCULE-7662591278 [0,1,0,1,0,0|0,0,1]=3 3233 B7R1.2 O=C1C=CC(=O)N1 MCULE-3677915339 [0,1,0,1,0,0|1,0,1]=4 3234 B7R1.2 O=C1C=CC(=O)O1 MCULE-5322674641 [0,1,0,1,0,0|1,0,1]=4 3235 B7R1.2 O=C1C=CC(C1)O MCULE-6464451546 [0,1,0,1,0,0|0,0,0]=2 3236 B7R1.2 O=C1C=CC(O1)Br MCULE-3933464968 [0,1,0,1,0,0|1,0,0]=3 3237 B7R1.2 O=C1C=CC(O1)O MCULE-7170809381 [0,1,0,1,0,0|1,0,0]=3 3238 B7R1.2 O=C1C=C[C@@H](C1)O MCULE-4535052390 [0,1,0,1,0,0|0,0,0]=2 3239 B7R1.2 O=C1C=C[C@H](C1)O MCULE-9347047598 [0,1,0,1,0,0|0,0,0]=2 3240 B7R1.2 O=C1CC(=CO1)O MCULE-3691688750 [0,1,0,1,0,0|1,0,0]=3 3241 B7R1.2 O=C1CC(=O)NN1 MCULE-4591056937 [0,1,0,1,0,0|2,0,0]=4 3242 B7R1.2 O=C1CC(CN1)O MCULE-8498039777 [0,1,0,1,0,0|1,0,1]=4 3243 B7R1.2 O=C1CC(CN1)S MCULE-3257609096 [0,1,0,1,0,0|1,0,1]=4 3244 B7R1.2 O=C1CC(CO1)O MCULE-3779919332 [0,1,0,1,0,0|1,0,1]=4 3245 B7R1.2 O=C1CC(CO1)O MCULE-5609071664 [0,1,0,1,0,0|1,0,1]=4 3246 B7R1.2 O=C1CCC(=O)C1 MCULE-6436831689 [0,1,0,1,0,0|0,0,1]=3 3247 B7R1.2 O=C1CCC(=O)N1 MCULE-8278049979 [0,1,0,1,0,0|1,0,0]=3 3248 B7R1.2 O=C1CCC(=O)O1 MCULE-1458819618 [0,1,0,1,0,0|1,0,0]=3 3249 B7R1.2 O=C1CCC(C1)F MCULE-9585894610 [0,1,0,1,0,0|0,0,2]=4 3250 B7R1.2 O=C1CCC(C1)I MCULE-5558007377 [0,1,0,1,0,0|0,0,2]=4 3251 B7R1.2 O=C1CCC(C1)O MCULE-8500536547 [0,1,0,1,0,0|0,0,2]=4 3252 B7R1.2 O=C1CCC(N1)O MCULE-1790956080 [0,1,0,1,0,0|1,0,1]=4 3253 B7R1.2 O=C1CCC(O1)F MCULE-6874239017 [0,1,0,1,0,0|1,0,1]=4 3254 B7R1.2 O=C1CCC(O1)O MCULE-5296344468 [0,1,0,1,0,0|1,0,1]=4 3255 B7R1.2 O=C1CNC(=O)C1 MCULE-6981924013 [0,1,0,1,0,0|1,0,1]=4 3256 B7R1.2 O=C1CNC(=O)N1 MCULE-6812812243 [0,1,0,1,0,0|2,0,0]=4 3257 B7R1.2 O=C1CNC(=O)O1 MCULE-7702120642 [0,1,0,1,0,0|2,0,0]=4 3258 B7R1.2 O=C1CNC(=O)S1 MCULE-5050685903 [0,1,0,1,0,0|2,0,0]=4 3259 B7R1.2 O=C1CNC(=S)N1 MCULE-3766479597 [0,1,0,1,0,0|2,0,0]=4 3260 B7R1.2 O=C1CNC(=S)S1 MCULE-4359186239 [0,1,0,1,0,0|2,0,0]=4 3261 B7R1.2 O=C1COC(=O)C1 MCULE-3258090872 [0,1,0,1,0,0|1,0,1]=4 3262 B7R1.2 O=C1COC(=O)N1 MCULE-3103815953 [0,1,0,1,0,0|2,0,0]=4 3263 B7R1.2 O=C1COC(=O)[N-]1 MCULE-2786348217 [0,1,0,1,0,0|2,0,0]=4 3264 B7R1.2 O=C1CSC(=O)N1 MCULE-8206580994 [0,1,0,1,0,0|2,0,0]=4 3265 B7R1.2 O=C1CSC(=S)N1 MCULE-8840169234 [0,1,0,1,0,0|2,0,0]=4 3266 B7R1.2 O=C1C[C@@H](CN1)O MCULE-2016792324 [0,1,0,1,0,0|1,0,1]=4 3267 B7R1.2 O=C1C[C@@H](CN1)O MCULE-9756194758 [0,1,0,1,0,0|1,0,1]=4 3268 B7R1.2 O=C1C[C@@H](CO1)O MCULE-1467506377 [0,1,0,1,0,0|1,0,1]=4 3269 B7R1.2 O=C1C[C@@H](CO1)O MCULE-3668466479 [0,1,0,1,0,0|1,0,1]=4 3270 B7R1.2 O=C1C[C@H](CN1)O MCULE-2017150152 [0,1,0,1,0,0|1,0,1]=4 3271 B7R1.2 O=C1C[C@H](CN1)O MCULE-5168961542 [0,1,0,1,0,0|1,0,1]=4 3272 B7R1.2 O=C1C[C@H](CN1)S MCULE-6980612759 [0,1,0,1,0,0|1,0,1]=4 3273 B7R1.2 O=C1C[C@H](CN1)S MCULE-7205538285 [0,1,0,1,0,0|1,0,1]=4 3274 B7R1.2 O=C1C[C@H](CO1)O MCULE-5756899897 [0,1,0,1,0,0|1,0,1]=4 3275 B7R1.2 O=C1C[C@H](CO1)O MCULE-6247095672 [0,1,0,1,0,0|1,0,1]=4 3276 B7R1.2 O=C1NC(=CS1)O MCULE-2237666080 [0,1,0,1,0,0|2,0,0]=4 3277 B7R1.2 O=C1NC(=S)CS1 MCULE-8601205978 [0,1,0,1,0,0|2,0,0]=4 3278 B7R1.2 O=C1NC=C(S1)Cl MCULE-7571560638 [0,1,0,1,0,0|2,0,0]=4 3279 B7R1.2 O=C1NCC(=S)N1 MCULE-9753398150 [0,1,0,1,0,0|2,0,0]=4 3280 B7R1.2 OC1C=CC(C1)O MCULE-9792113599 [0,1,0,1,0,0|0,0,2]=4 3281 B7R1.2 O[C@@H]1C=C[C@@H](C1)O MCULE-7187295032 [0,1,0,1,0,0|0,0,2]=4 3282 B7R1.2 S=C1CCC(=S)N1 MCULE-1793012495 [0,1,0,1,0,0|1,1,0]=4 3283 B7R1.2 [C@H]1(CCC(=O)C1)C MCULE-3827565169 [0,1,0,1,0,0|0,0,2]=4 3284 B7R1.3 BrC1=CCCCC1 MCULE-6137796305 [0,1,0,1,0,0|1,0,1]=4 3285 B7R1.3 BrC1=CCCNC1 MCULE-1016336040 [0,1,0,1,0,0|1,0,1]=4 3286 B7R1.3 BrC1=CCCNC1 MCULE-9845052592 [0,1,0,1,0,0|1,0,1]=4 3287 B7R1.3 BrC1=CCOCC1 MCULE-7609274912 [0,1,0,1,0,0|1,0,1]=4 3288 B7R1.3 BrC1=CCSCC1 MCULE-6964400494 [0,1,0,1,0,0|1,0,1]=4 3289 B7R1.3 BrC1=COCCC1 MCULE-7754503978 [0,1,0,1,0,0|1,0,1]=4 3290 B7R1.3 BrC1C=CCCC1 MCULE-1210573604 [0,1,0,1,0,0|1,0,1]=4 3291 B7R1.3 CC1=CC=CC=C1 MCULE-4817136027 [0,1,0,1,0,0|1,0,1]=4 3292 B7R1.3 CC1=CC=CCC1 MCULE-3797800778 [0,1,0,1,0,0|1,0,0]=3 3293 B7R1.3 CC1=CC=NC=C1 MCULE-2244521363 [0,1,0,1,0,0|1,0,1]=4 3294 B7R1.3 CC1=CC=NC=C1 MCULE-5336385904 [0,1,0,1,0,0|1,0,1]=4 3295 B7R1.3 CC1=CC=NC=N1 MCULE-7063100764 [0,1,0,1,0,0|1,0,1]=4 3296 B7R1.3 CC1=CCC=CC1 MCULE-8148706670 [0,1,0,1,0,0|1,0,0]=3 3297 B7R1.3 CC1=CCCC=C1 MCULE-6224653152 [0,1,0,1,0,0|1,0,0]=3 3298 B7R1.3 CC1=CCCCC1 MCULE-2795172496 [0,1,0,1,0,0|1,0,1]=4 3299 B7R1.3 CC1=CCCNC1 MCULE-8145216779 [0,1,0,1,0,0|1,0,1]=4 3300 B7R1.3 CC1=CCCNC1 MCULE-9021954061 [0,1,0,1,0,0|1,0,1]=4 3301 B7R1.3 CC1=CCNCC1 MCULE-1503915992 [0,1,0,1,0,0|1,0,1]=4 3302 B7R1.3 CC1=CCNCC1 MCULE-3349815065 [0,1,0,1,0,0|1,0,1]=4 3303 B7R1.3 CC1=CN=CC=C1 MCULE-7651055603 [0,1,0,1,0,0|1,0,1]=4 3304 B7R1.3 CC1=CN=CN=C1 MCULE-7076758617 [0,1,0,1,0,0|2,0,0]=4 3305 B7R1.3 CC1=CN=NC=C1 MCULE-4894279826 [0,1,0,1,0,0|2,0,0]=4 3306 B7R1.3 CC1=NC=CC=C1 MCULE-3857746542 [0,1,0,1,0,0|1,0,1]=4 3307 B7R1.3 CC1=NC=CC=N1 MCULE-4218922171 [0,1,0,1,0,0|1,0,1]=4 3308 B7R1.3 CC1=NC=CN=C1 MCULE-8697656728 [0,1,0,1,0,0|1,0,1]=4 3309 B7R1.3 CC1=NC=CN=N1 MCULE-7324585353 [0,1,0,1,0,0|2,0,0]=4 3310 B7R1.3 CC1=NN=CC=C1 MCULE-3738378616 [0,1,0,1,0,0|1,0,1]=4 3311 B7R1.3 CC1C=CCCC1 MCULE-8057302830 [0,1,0,1,0,0|1,0,1]=4 3312 B7R1.3 CC1CC=CCC1 MCULE-6343106785 [0,1,0,1,0,0|1,0,1]=4 3313 B7R1.3 CN1CC=CCC1 MCULE-1566475259 [0,1,0,1,0,0|2,0,0]=4 3314 B7R1.3 CN1CC=CCC1 MCULE-7879022625 [0,1,0,1,0,0|2,0,0]=4 3315 B7R1.3 ClC1=CCCCC1 MCULE-6882712527 [0,1,0,1,0,0|1,0,1]=4 3316 B7R1.3 ClC1=CCCNC1 MCULE-2132976242 [0,1,0,1,0,0|1,0,1]=4 3317 B7R1.3 ClC1=CCCNC1 MCULE-9013141821 [0,1,0,1,0,0|1,0,1]=4 3318 B7R1.3 ClC1C=CCCC1 MCULE-7233887185 [0,1,0,1,0,0|1,0,1]=4 3319 B7R1.3 FC1=CCCNC1 MCULE-5131057553 [0,1,0,1,0,0|1,0,1]=4 3320 B7R1.3 FC1=CCCNC1 MCULE-8459145085 [0,1,0,1,0,0|1,0,1]=4 3321 B7R1.3 FC1=CCNCC1 MCULE-5573410633 [0,1,0,1,0,0|1,0,1]=4 3322 B7R1.3 FC1=CCNCC1 MCULE-9755070929 [0,1,0,1,0,0|1,0,1]=4 3323 B7R1.3 NC1C=CCCC1 MCULE-4482857573 [0,1,0,1,0,0|1,0,1]=4 3324 B7R1.3 NC1C=CCCC1 MCULE-5378769676 [0,1,0,1,0,0|1,0,1]=4 3325 B7R1.3 NC1CC=CCC1 MCULE-4040563231 [0,1,0,1,0,0|1,0,1]=4 3326 B7R1.3 NC1CC=CCC1 MCULE-9904098902 [0,1,0,1,0,0|1,0,1]=4 3327 B7R1.3 N[C@@H]1CC=CCC1 MCULE-7764023195 [0,1,0,1,0,0|1,0,1]=4 3328 B7R1.3 N[C@@H]1CC=CCC1 MCULE-7983408030 [0,1,0,1,0,0|1,0,1]=4 3329 B7R1.3 N[C@H]1CC=CCC1 MCULE-2054948922 [0,1,0,1,0,0|1,0,1]=4 3330 B7R1.3 N[C@H]1CC=CCC1 MCULE-6634059436 [0,1,0,1,0,0|1,0,1]=4 3331 B7R1.3 O=C1C=CC=CO1 MCULE-1962369480 [0,1,0,1,0,0|0,0,2]=4 3332 B7R1.3 O=C1C=CCCC1 MCULE-5207755083 [0,1,0,1,0,0|0,0,0]=2 3333 B7R1.3 O=C1C=CCCN1 MCULE-9815380990 [0,1,0,1,0,0|0,0,0]=2 3334 B7R1.3 O=C1C=CCCO1 MCULE-2962791770 [0,1,0,1,0,0|0,0,0]=2 3335 B7R1.3 O=C1C=CCOC1 MCULE-4817981961 [0,1,0,1,0,0|0,0,0]=2 3336 B7R1.3 O=C1C=COC=C1 MCULE-4737810636 [0,1,0,1,0,0|0,0,2]=4 3337 B7R1.3 O=C1C=COCC1 MCULE-2954829305 [0,1,0,1,0,0|0,0,0]=2 3338 B7R1.3 O=C1C=COCN1 MCULE-7471476237 [0,1,0,1,0,0|1,0,0]=3 3339 B7R1.3 O=C1C=NC=CN1 MCULE-1637832118 [0,1,0,1,0,0|1,0,1]=4 3340 B7R1.3 O=C1CC=CCN1 MCULE-7370958955 [0,1,0,1,0,0|1,0,0]=3 3341 B7R1.3 O=C1CC=CN=N1 MCULE-5717852017 [0,1,0,1,0,0|1,0,1]=4 3342 B7R1.3 O=C1CC=COC1 MCULE-3434064170 [0,1,0,1,0,0|1,0,0]=3 3343 B7R1.3 O=C1CCCCC1 MCULE-5664385838 [0,1,0,1,0,0|0,0,2]=4 3344 B7R1.3 O=C1CCCCN1 MCULE-9168245534 [0,1,0,1,0,0|0,0,2]=4 3345 B7R1.3 O=C1CCCCO1 MCULE-4682307363 [0,1,0,1,0,0|0,0,2]=4 3346 B7R1.3 O=C1CCCCS1 MCULE-5383777119 [0,1,0,1,0,0|0,0,2]=4 3347 B7R1.3 O=C1CCCNC1 MCULE-2774326662 [0,1,0,1,0,0|0,0,2]=4 3348 B7R1.3 O=C1CCCNC1 MCULE-8149766009 [0,1,0,1,0,0|0,0,2]=4 3349 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [0,1,0,1,0,0|0,0,2]=4 3350 B7R1.3 O=C1CCCSC1 MCULE-1649390503 [0,1,0,1,0,0|0,0,2]=4 3351 B7R1.3 O=C1CCNCC1 MCULE-7526186270 [0,1,0,1,0,0|0,0,2]=4 3352 B7R1.3 O=C1CCNCC1 MCULE-9761063200 [0,1,0,1,0,0|0,0,2]=4 3353 B7R1.3 O=C1CCNCN1 MCULE-5793765281 [0,1,0,1,0,0|1,0,1]=4 3354 B7R1.3 O=C1CCOCC1 MCULE-6728095514 [0,1,0,1,0,0|0,0,2]=4 3355 B7R1.3 O=C1CCSCC1 MCULE-8638366518 [0,1,0,1,0,0|0,0,2]=4 3356 B7R1.3 O=C1CNCCN1 MCULE-5599978871 [0,1,0,1,0,0|1,0,1]=4 3357 B7R1.3 O=C1CNCCO1 MCULE-2634056082 [0,1,0,1,0,0|1,0,1]=4 3358 B7R1.3 O=C1CNCCO1 MCULE-6420255529 [0,1,0,1,0,0|1,0,1]=4 3359 B7R1.3 O=C1COCCN1 MCULE-8242898041 [0,1,0,1,0,0|1,0,1]=4 3360 B7R1.3 O=C1COCCO1 MCULE-5754504096 [0,1,0,1,0,0|1,0,1]=4 3361 B7R1.3 O=C1CSC=CN1 MCULE-7195428643 [0,1,0,1,0,0|1,0,0]=3 3362 B7R1.3 O=C1CSCCN1 MCULE-1492056440 [0,1,0,1,0,0|1,0,1]=4 3363 B7R1.3 O=C1CSCSC1 MCULE-8034252746 [0,1,0,1,0,0|1,0,1]=4 3364 B7R1.3 O=C1N=CC=CN1 MCULE-7966583838 [0,1,0,1,0,0|1,0,1]=4 3365 B7R1.3 O=C1NCCCN1 MCULE-4876148406 [0,1,0,1,0,0|1,0,1]=4 3366 B7R1.3 O=C1NCCCO1 MCULE-9333383492 [0,1,0,1,0,0|1,0,1]=4 3367 B7R1.3 O=C1NNCCO1 MCULE-2913818828 [0,1,0,1,0,0|2,0,0]=4 3368 B7R1.3 O=C1OCCCO1 MCULE-7728322911 [0,1,0,1,0,0|1,0,1]=4 3369 B7R1.3 OC1=CN=NCC1 MCULE-3904781537 [0,1,0,1,0,0|1,0,1]=4 3370 B7R1.3 OC1C=CCCC1 MCULE-3255466542 [0,1,0,1,0,0|0,0,2]=4 3371 B7R1.3 OC1C=CCNC1 MCULE-1616136732 [0,1,0,1,0,0|0,0,2]=4 3372 B7R1.3 OC1C=CCNC1 MCULE-6073391464 [0,1,0,1,0,0|0,0,2]=4 3373 B7R1.3 OC1C=CCOC1 MCULE-7810293257 [0,1,0,1,0,0|0,0,2]=4 3374 B7R1.3 OC1CC=CCC1 MCULE-9472259407 [0,1,0,1,0,0|0,0,2]=4 3375 B7R1.3 O[C@H]1C=CCCC1 MCULE-5543899109 [0,1,0,1,0,0|0,0,2]=4 3376 B7R1.4 BrC1=C(CCC1)Br MCULE-2617233515 [0,1,0,1,0,0|1,0,1]=4 3377 B7R1.4 C1(CCNC1=O)N MCULE-4906952813 [0,1,0,1,0,0|1,0,1]=4 3378 B7R1.4 C1(CCNC1=O)N MCULE-9500853209 [0,1,0,1,0,0|1,0,1]=4 3379 B7R1.4 C=C1CCNC1=O MCULE-2729105523 [0,1,0,1,0,0|1,0,1]=4 3380 B7R1.4 C=C1CCOC1=O MCULE-5907828600 [0,1,0,1,0,0|1,0,1]=4 3381 B7R1.4 CC1=C(C=CO1)Br MCULE-5272760073 [0,1,0,1,0,0|0,0,2]=4 3382 B7R1.4 CC1=C(C=CO1)N MCULE-8304976100 [0,1,0,1,0,0|0,0,2]=4 3383 B7R1.4 CC1=C(C=CO1)S MCULE-3331659980 [0,1,0,1,0,0|0,0,2]=4 3384 B7R1.4 CC1=C(C=CO1)S MCULE-8172133853 [0,1,0,1,0,0|0,0,2]=4 3385 B7R1.4 CC1=C(C=CS1)Br MCULE-6374195818 [0,1,0,1,0,0|0,1,1]=4 3386 B7R1.4 CC1=C(C=CS1)Cl MCULE-9362082266 [0,1,0,1,0,0|0,1,1]=4 3387 B7R1.4 CC1=C(C=CS1)N MCULE-4152889855 [0,1,0,1,0,0|0,1,1]=4 3388 B7R1.4 CC1=C(C=CS1)N MCULE-4377439924 [0,1,0,1,0,0|0,1,1]=4 3389 B7R1.4 CC1=C(C=NO1)Br MCULE-3480380556 [0,1,0,1,0,0|1,0,1]=4 3390 B7R1.4 CC1=C(C=NO1)I MCULE-1012314205 [0,1,0,1,0,0|1,0,1]=4 3391 B7R1.4 CC1=C(C=NO1)N MCULE-4982899453 [0,1,0,1,0,0|1,0,1]=4 3392 B7R1.4 CC1=C(C=NO1)N MCULE-8792251798 [0,1,0,1,0,0|1,0,1]=4 3393 B7R1.4 CC1=C(NC=C1)C MCULE-3747569551 [0,1,0,1,0,0|1,0,1]=4 3394 B7R1.4 CC1=C(OC=C1)Br MCULE-4484142471 [0,1,0,1,0,0|2,0,0]=4 3395 B7R1.4 CC1=C(OC=C1)C MCULE-1944160075 [0,1,0,1,0,0|0,0,2]=4 3396 B7R1.4 CC1=C(ON=C1)C MCULE-2037233742 [0,1,0,1,0,0|1,0,1]=4 3397 B7R1.4 CC1=C(SC=C1)Br MCULE-3746729659 [0,1,0,1,0,0|2,0,0]=4 3398 B7R1.4 CC1=C(SC=C1)C MCULE-6742776055 [0,1,0,1,0,0|0,1,1]=4 3399 B7R1.4 CC1=C(SC=C1)Cl MCULE-4683627316 [0,1,0,1,0,0|2,0,0]=4 3400 B7R1.4 CC1=C(SC=C1)I MCULE-4074297086 [0,1,0,1,0,0|2,0,0]=4 3401 B7R1.4 CC1=C(SC=C1)S MCULE-6807943440 [0,1,0,1,0,0|1,1,0]=4 3402 B7R1.4 CC1=CC=CN1C MCULE-7997774693 [0,1,0,1,0,0|1,0,1]=4 3403 B7R1.4 CC1=CC=NN1C MCULE-9285969175 [0,1,0,1,0,0|2,0,0]=4 3404 B7R1.4 CC1=CCCC1=O MCULE-3713655264 [0,1,0,1,0,0|0,0,0]=2 3405 B7R1.4 CC1=CCOC1=O MCULE-9785490540 [0,1,0,1,0,0|1,0,0]=3 3406 B7R1.4 CC1=CNC=C1C MCULE-4758724479 [0,1,0,1,0,0|2,0,0]=4 3407 B7R1.4 CC1=CNN=C1C MCULE-2020565239 [0,1,0,1,0,0|2,0,0]=4 3408 B7R1.4 CC1=CNN=C1C MCULE-5379672633 [0,1,0,1,0,0|2,0,0]=4 3409 B7R1.4 CC1=CNN=C1C MCULE-8376501296 [0,1,0,1,0,0|2,0,0]=4 3410 B7R1.4 CC1=CNNC1=O MCULE-9098077492 [0,1,0,1,0,0|2,0,0]=4 3411 B7R1.4 CC1=COC=C1Br MCULE-5316317633 [0,1,0,1,0,0|2,0,0]=4 3412 B7R1.4 CC1=CSC=C1Br MCULE-5733157832 [0,1,0,1,0,0|2,0,0]=4 3413 B7R1.4 CC1=CSC=C1C MCULE-2505833521 [0,1,0,1,0,0|2,0,0]=4 3414 B7R1.4 CC1=CSC=C1N MCULE-2229858743 [0,1,0,1,0,0|2,0,0]=4 3415 B7R1.4 CC1=CSC=C1N MCULE-9678851280 [0,1,0,1,0,0|2,0,0]=4 3416 B7R1.4 CC1=CSC=C1N MCULE-9850701502 [0,1,0,1,0,0|2,0,0]=4 3417 B7R1.4 CC1=NNC=C1Br MCULE-1749367684 [0,1,0,1,0,0|2,0,0]=4 3418 B7R1.4 CC1=NNC=C1Br MCULE-5959094368 [0,1,0,1,0,0|2,0,0]=4 3419 B7R1.4 CC1=NNC=C1Cl MCULE-1754129627 [0,1,0,1,0,0|2,0,0]=4 3420 B7R1.4 CC1=NNC=C1Cl MCULE-4343252949 [0,1,0,1,0,0|2,0,0]=4 3421 B7R1.4 CC1=NNC=C1I MCULE-9590566058 [0,1,0,1,0,0|2,0,0]=4 3422 B7R1.4 CC1=NNC=C1N MCULE-2511920915 [0,1,0,1,0,0|2,0,0]=4 3423 B7R1.4 CC1=NNC=C1N MCULE-5966078729 [0,1,0,1,0,0|2,0,0]=4 3424 B7R1.4 CC1=NNC=C1N MCULE-6524486526 [0,1,0,1,0,0|2,0,0]=4 3425 B7R1.4 CC1=NOC=C1Br MCULE-7195499083 [0,1,0,1,0,0|2,0,0]=4 3426 B7R1.4 CC1=NOC=C1N MCULE-4953481155 [0,1,0,1,0,0|2,0,0]=4 3427 B7R1.4 CC1=NOC=C1N MCULE-7158422089 [0,1,0,1,0,0|2,0,0]=4 3428 B7R1.4 CC1=NSC=C1Br MCULE-5960176770 [0,1,0,1,0,0|2,0,0]=4 3429 B7R1.4 CC1=NSC=C1N MCULE-1714579639 [0,1,0,1,0,0|2,0,0]=4 3430 B7R1.4 CC1=NSC=C1N MCULE-8952603976 [0,1,0,1,0,0|2,0,0]=4 3431 B7R1.4 CC1CCCC1=O MCULE-3710290162 [0,1,0,1,0,0|0,0,2]=4 3432 B7R1.4 CC1CCNC1=O MCULE-7799644249 [0,1,0,1,0,0|1,0,1]=4 3433 B7R1.4 CC1CCOC1=O MCULE-2223078294 [0,1,0,1,0,0|1,0,1]=4 3434 B7R1.4 CC1CNCC1=O MCULE-2728909327 [0,1,0,1,0,0|1,0,1]=4 3435 B7R1.4 CC1CNCC1=O MCULE-9172381840 [0,1,0,1,0,0|1,0,1]=4 3436 B7R1.4 CC1COCC1=O MCULE-8115238635 [0,1,0,1,0,0|1,0,1]=4 3437 B7R1.4 CC1CSCC1=O MCULE-5611423322 [0,1,0,1,0,0|1,0,1]=4 3438 B7R1.4 CC1NCCC1=O MCULE-4206844406 [0,1,0,1,0,0|1,0,1]=4 3439 B7R1.4 CC1NCCC1=O MCULE-7025918222 [0,1,0,1,0,0|1,0,1]=4 3440 B7R1.4 CC1OCCC1=O MCULE-8278816952 [0,1,0,1,0,0|1,0,1]=4 3441 B7R1.4 CC1SCCC1=O MCULE-5264322365 [0,1,0,1,0,0|1,0,1]=4 3442 B7R1.4 CN1C=CC=C1Cl MCULE-2760073099 [0,1,0,1,0,0|1,0,1]=4 3443 B7R1.4 CN1C=CC=C1O MCULE-1520569878 [0,1,0,1,0,0|0,0,2]=4 3444 B7R1.4 CN1C=CNC1=O MCULE-9198950029 [0,1,0,1,0,0|1,0,1]=4 3445 B7R1.4 CN1CC=CC1=O MCULE-7879549885 [0,1,0,1,0,0|0,0,0]=2 3446 B7R1.4 CN1CCCC1=O MCULE-1381506705 [0,1,0,1,0,0|0,0,2]=4 3447 B7R1.4 CN1CCNC1=O MCULE-9774864412 [0,1,0,1,0,0|1,0,1]=4 3448 B7R1.4 CN1CCOC1=O MCULE-7467321799 [0,1,0,1,0,0|1,0,1]=4 3449 B7R1.4 CN1CNCC1=O MCULE-2252466841 [0,1,0,1,0,0|1,0,1]=4 3450 B7R1.4 CN1N=CC=C1Br MCULE-7101001570 [0,1,0,1,0,0|2,0,0]=4 3451 B7R1.4 CN1N=CC=C1Cl MCULE-8962391076 [0,1,0,1,0,0|2,0,0]=4 3452 B7R1.4 CN1N=CC=C1F MCULE-6023753197 [0,1,0,1,0,0|2,0,0]=4 3453 B7R1.4 CN1N=CC=C1I MCULE-2407065536 [0,1,0,1,0,0|2,0,0]=4 3454 B7R1.4 CN1N=CC=C1N MCULE-1453941617 [0,1,0,1,0,0|2,0,0]=4 3455 B7R1.4 CN1N=CC=C1N MCULE-2315795709 [0,1,0,1,0,0|2,0,0]=4 3456 B7R1.4 CN1N=CC=C1O MCULE-1012956210 [0,1,0,1,0,0|1,0,1]=4 3457 B7R1.4 CN1N=CC=C1O MCULE-9024912006 [0,1,0,1,0,0|1,0,1]=4 3458 B7R1.4 CN1N=CCC1=O MCULE-2362806196 [0,1,0,1,0,0|1,0,1]=4 3459 B7R1.4 CN1NC=CC1=O MCULE-4425265471 [0,1,0,1,0,0|1,0,0]=3 3460 B7R1.4 CN1NC=NC1=O MCULE-2476320995 [0,1,0,1,0,0|2,0,0]=4 3461 B7R1.4 CN1SC=CC1=O MCULE-3887229553 [0,1,0,1,0,0|1,0,0]=3 3462 B7R1.4 CN1SC=CC1=O MCULE-5825912822 [0,1,0,1,0,0|1,0,0]=3 3463 B7R1.4 CN1SC=CC1=S MCULE-4327458448 [0,1,0,1,0,0|1,1,0]=4 3464 B7R1.4 C[C@@H]1CCNC1=O MCULE-1037883660 [0,1,0,1,0,0|1,0,1]=4 3465 B7R1.4 C[C@H]1CCNC1=O MCULE-9500360544 [0,1,0,1,0,0|1,0,1]=4 3466 B7R1.4 NC1=CCOC1=O MCULE-9089854091 [0,1,0,1,0,0|1,0,0]=3 3467 B7R1.4 NC1=CNNC1=O MCULE-5341060497 [0,1,0,1,0,0|2,0,0]=4 3468 B7R1.4 NC1=CNNC1=O MCULE-9560987259 [0,1,0,1,0,0|2,0,0]=4 3469 B7R1.4 NC1CCCC1=O MCULE-3654949473 [0,1,0,1,0,0|0,0,2]=4 3470 B7R1.4 NC1CCCC1=O MCULE-6579965788 [0,1,0,1,0,0|0,0,2]=4 3471 B7R1.4 NC1CCNC1=O MCULE-2061829370 [0,1,0,1,0,0|1,0,1]=4 3472 B7R1.4 NC1CCNC1=O MCULE-4272585488 [0,1,0,1,0,0|1,0,1]=4 3473 B7R1.4 NC1CCOC1=O MCULE-1011670330 [0,1,0,1,0,0|1,0,1]=4 3474 B7R1.4 NC1CCOC1=O MCULE-1366805966 [0,1,0,1,0,0|1,0,1]=4 3475 B7R1.4 NC1CCOC1=O MCULE-1874490478 [0,1,0,1,0,0|1,0,1]=4 3476 B7R1.4 NC1CCOC1=O MCULE-4434379753 [0,1,0,1,0,0|1,0,1]=4 3477 B7R1.4 NC1CCOC1=O MCULE-7302633352 [0,1,0,1,0,0|1,0,1]=4 3478 B7R1.4 NC1CCOC1=O MCULE-8009953591 [0,1,0,1,0,0|1,0,1]=4 3479 B7R1.4 NC1CCSC1=O MCULE-5181497015 [0,1,0,1,0,0|1,0,1]=4 3480 B7R1.4 NC1CCSC1=O MCULE-8775141567 [0,1,0,1,0,0|1,0,1]=4 3481 B7R1.4 NC1CONC1=O MCULE-3118867985 [0,1,0,1,0,0|2,0,0]=4 3482 B7R1.4 NC1CONC1=O MCULE-3159218372 [0,1,0,1,0,0|2,0,0]=4 3483 B7R1.4 NN1CCCC1=O MCULE-2994786381 [0,1,0,1,0,0|1,0,1]=4 3484 B7R1.4 NN1CCCC1=O MCULE-5599329775 [0,1,0,1,0,0|1,0,1]=4 3485 B7R1.4 N[C@@H]1CCNC1=O MCULE-2357766642 [0,1,0,1,0,0|1,0,1]=4 3486 B7R1.4 N[C@@H]1CCNC1=O MCULE-9089591546 [0,1,0,1,0,0|1,0,1]=4 3487 B7R1.4 N[C@@H]1CCNC1=O MCULE-9558758567 [0,1,0,1,0,0|1,0,1]=4 3488 B7R1.4 N[C@@H]1CCNC1=O MCULE-9668255740 [0,1,0,1,0,0|1,0,1]=4 3489 B7R1.4 N[C@@H]1CCOC1=O MCULE-1027751896 [0,1,0,1,0,0|1,0,1]=4 3490 B7R1.4 N[C@@H]1CCOC1=O MCULE-4034349263 [0,1,0,1,0,0|1,0,1]=4 3491 B7R1.4 N[C@@H]1CCOC1=O MCULE-8790782772 [0,1,0,1,0,0|1,0,1]=4 3492 B7R1.4 N[C@@H]1CCOC1=O MCULE-9300265861 [0,1,0,1,0,0|1,0,1]=4 3493 B7R1.4 N[C@@H]1CCSC1=O MCULE-1269968791 [0,1,0,1,0,0|1,0,1]=4 3494 B7R1.4 N[C@@H]1CCSC1=O MCULE-5374422420 [0,1,0,1,0,0|1,0,1]=4 3495 B7R1.4 N[C@@H]1CCSC1=O MCULE-8203732076 [0,1,0,1,0,0|1,0,1]=4 3496 B7R1.4 N[C@@H]1CCSC1=O MCULE-8418670804 [0,1,0,1,0,0|1,0,1]=4 3497 B7R1.4 N[C@@H]1CONC1=O MCULE-4212827696 [0,1,0,1,0,0|2,0,0]=4 3498 B7R1.4 N[C@@H]1CONC1=O MCULE-6014142329 [0,1,0,1,0,0|2,0,0]=4 3499 B7R1.4 N[C@H]1CCNC1=O MCULE-2327147408 [0,1,0,1,0,0|1,0,1]=4 3500 B7R1.4 N[C@H]1CCNC1=O MCULE-2923469662 [0,1,0,1,0,0|1,0,1]=4 3501 B7R1.4 N[C@H]1CCNC1=O MCULE-5882745021 [0,1,0,1,0,0|1,0,1]=4 3502 B7R1.4 N[C@H]1CCNC1=O MCULE-7846724738 [0,1,0,1,0,0|1,0,1]=4 3503 B7R1.4 N[C@H]1CCOC1=O MCULE-4393293388 [0,1,0,1,0,0|1,0,1]=4 3504 B7R1.4 N[C@H]1CCOC1=O MCULE-4751602783 [0,1,0,1,0,0|1,0,1]=4 3505 B7R1.4 N[C@H]1CCOC1=O MCULE-7924572479 [0,1,0,1,0,0|1,0,1]=4 3506 B7R1.4 N[C@H]1CCOC1=O MCULE-8545644747 [0,1,0,1,0,0|1,0,1]=4 3507 B7R1.4 N[C@H]1CCOC1=O MCULE-8634641228 [0,1,0,1,0,0|1,0,1]=4 3508 B7R1.4 N[C@H]1CCSC1=O MCULE-4497814170 [0,1,0,1,0,0|1,0,1]=4 3509 B7R1.4 N[C@H]1CCSC1=O MCULE-6209097230 [0,1,0,1,0,0|1,0,1]=4 3510 B7R1.4 N[C@H]1CCSC1=O MCULE-6419348515 [0,1,0,1,0,0|1,0,1]=4 3511 B7R1.4 N[C@H]1CCSC1=O MCULE-9091827364 [0,1,0,1,0,0|1,0,1]=4 3512 B7R1.4 N[C@H]1CONC1=O MCULE-4286940154 [0,1,0,1,0,0|2,0,0]=4 3513 B7R1.4 N[C@H]1CONC1=O MCULE-9925977120 [0,1,0,1,0,0|2,0,0]=4 3514 B7R1.4 O=C1CCC=C1Br MCULE-1509582125 [0,1,0,1,0,0|0,0,0]=2 3515 B7R1.4 O=C1CCC=C1I MCULE-2710048446 [0,1,0,1,0,0|0,0,0]=2 3516 B7R1.4 O=C1CCC=C1O MCULE-8745661989 [0,1,0,1,0,0|0,0,0]=2 3517 B7R1.4 O=C1CCCC1=O MCULE-8040167119 [0,1,0,1,0,0|0,0,1]=3 3518 B7R1.4 O=C1CCCC1Br MCULE-3651373380 [0,1,0,1,0,0|0,0,2]=4 3519 B7R1.4 O=C1CCCC1Cl MCULE-7745647260 [0,1,0,1,0,0|0,0,2]=4 3520 B7R1.4 O=C1CCCC1F MCULE-8001765295 [0,1,0,1,0,0|0,0,2]=4 3521 B7R1.4 O=C1CCCC1O MCULE-6795188798 [0,1,0,1,0,0|0,0,2]=4 3522 B7R1.4 O=C1CCNC1=O MCULE-6243503430 [0,1,0,1,0,0|1,0,0]=3 3523 B7R1.4 O=C1NCCC1Br MCULE-5321265801 [0,1,0,1,0,0|1,0,1]=4 3524 B7R1.4 O=C1NCCC1Cl MCULE-1663035789 [0,1,0,1,0,0|1,0,1]=4 3525 B7R1.4 O=C1NCCC1F MCULE-2209899044 [0,1,0,1,0,0|1,0,1]=4 3526 B7R1.4 O=C1NCCC1O MCULE-8818841339 [0,1,0,1,0,0|1,0,1]=4 3527 B7R1.4 O=C1NCCC1O MCULE-9662824811 [0,1,0,1,0,0|1,0,1]=4 3528 B7R1.4 O=C1NCC[C@@H]1O MCULE-3212474164 [0,1,0,1,0,0|1,0,1]=4 3529 B7R1.4 O=C1NCC[C@@H]1O MCULE-7816291255 [0,1,0,1,0,0|1,0,1]=4 3530 B7R1.4 O=C1NCC[C@H]1O MCULE-1281835510 [0,1,0,1,0,0|1,0,1]=4 3531 B7R1.4 O=C1NCC[C@H]1O MCULE-6809356348 [0,1,0,1,0,0|1,0,1]=4 3532 B7R1.4 O=C1OCC=C1Br MCULE-9287853531 [0,1,0,1,0,0|1,0,0]=3 3533 B7R1.4 O=C1OCCC1Br MCULE-8316114331 [0,1,0,1,0,0|1,0,1]=4 3534 B7R1.4 O=C1OCCC1O MCULE-2144002601 [0,1,0,1,0,0|1,0,1]=4 3535 B7R1.4 O=C1OCCC1S MCULE-2130434062 [0,1,0,1,0,0|1,0,1]=4 3536 B7R1.4 O=C1OCC[C@@H]1O MCULE-7764011790 [0,1,0,1,0,0|1,0,1]=4 3537 B7R1.4 O=C1OCC[C@@H]1O MCULE-9001729998 [0,1,0,1,0,0|1,0,1]=4 3538 B7R1.4 O=C1OCC[C@H]1O MCULE-6949645282 [0,1,0,1,0,0|1,0,1]=4 3539 B7R1.4 O=C1OCC[C@H]1O MCULE-7110242636 [0,1,0,1,0,0|1,0,1]=4 3540 B7R1.4 OC1CCC=C1Br MCULE-2577502971 [0,1,0,1,0,0|0,0,2]=4 3541 B7R1.4 [NH3+][C@H]1CCOC1=O MCULE-8903471982 [0,1,0,1,0,0|1,0,1]=4 3542 B7R1.6 COC=C1COC1 MCULE-5631176777 [0,1,0,1,0,0|1,0,1]=4 3543 B7R1.6 O=CC=C1COC1 MCULE-3826519058 [0,1,0,1,0,0|1,0,1]=4 3544 B7R1.8 CCC1CCC1=O MCULE-5109615435 [0,1,0,1,0,0|0,0,2]=4 3545 B7R1.8 COC1CCC1=O MCULE-6511996246 [0,1,0,1,0,0|1,0,1]=4 3546 B7R1.8 CSC1CCC1=O MCULE-3892720319 [0,1,0,1,0,0|1,0,1]=4 3547 B7R1.10 C=CC1CC(=O)C1 MCULE-2741892250 [0,1,0,1,0,0|0,0,2]=4 3548 B7R1.10 C=CC1CC(=O)N1 MCULE-2790457728 [0,1,0,1,0,0|0,0,2]=4 3549 B7R1.10 CCC1CC(=O)C1 MCULE-6356390328 [0,1,0,1,0,0|0,0,2]=4 3550 B7R1.10 COC1CC(=O)C1 MCULE-3488458490 [0,1,0,1,0,0|0,0,2]=4 3551 B7R1.10 CSC1CC(=O)C1 MCULE-4578180421 [0,1,0,1,0,0|0,0,2]=4 3552 B7R1.10 NCC1CC(=O)C1 MCULE-2475090953 [0,1,0,1,0,0|0,0,2]=4 3553 B7R1.10 NCC1CC(=O)C1 MCULE-3448735299 [0,1,0,1,0,0|0,0,2]=4 3554 B7R1.10 NCC1CC(=O)N1 MCULE-6099913032 [0,1,0,1,0,0|1,0,1]=4 3555 B7R1.10 O=C1CC(C1)CBr MCULE-3146426428 [0,1,0,1,0,0|0,0,2]=4 3556 B7R1.10 O=C1CC(C1)CCl MCULE-9945216137 [0,1,0,1,0,0|0,0,2]=4 3557 B7R1.10 O=C1CC(C1)CF MCULE-5064337976 [0,1,0,1,0,0|0,0,2]=4 3558 B7R1.10 O=C1CC(C1)CO MCULE-6785243243 [0,1,0,1,0,0|0,0,2]=4 3559 B7R1.10 O=C1CC(N1)CI MCULE-8223453504 [0,1,0,1,0,0|1,0,1]=4 3560 B7R1.10 O=C1CC(N1)CO MCULE-5966757004 [0,1,0,1,0,0|1,0,1]=4 3561 B7R1.10 O=C1CC(N1)CO MCULE-7672639952 [0,1,0,1,0,0|1,0,1]=4 3562 B7R1.10 O=C1CC(O1)CBr MCULE-1451058371 [0,1,0,1,0,0|1,0,1]=4 3563 B7R1.10 O=C1C[C@@H](N1)CO MCULE-7235908958 [0,1,0,1,0,0|1,0,1]=4 3564 B7R1.10 O=C1C[C@@H](N1)CO MCULE-9940834935 [0,1,0,1,0,0|1,0,1]=4 3565 B7R1.10 O=C1C[C@H](N1)CO MCULE-1643787736 [0,1,0,1,0,0|1,0,1]=4 3566 B7R1.15 CC1CC(=O)C1C MCULE-1068922218 [0,1,0,1,0,0|0,0,2]=4 3567 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2032555036 [0,1,0,1,0,0|1,0,1]=4 3568 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2738127555 [0,1,0,1,0,0|1,0,1]=4 3569 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-5044901082 [0,1,0,1,0,0|1,0,1]=4 3570 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-7632990759 [0,1,0,1,0,0|1,0,1]=4 3571 B7R1.15 O=C1C=C(C1=O)O MCULE-3440355716 [0,1,0,1,0,0|1,0,1]=4 3572 B7R1.15 O=C1C=C(C1=O)[O-] MCULE-9991893223 [0,1,0,1,0,0|1,0,1]=4 3573 B7R1.22 C1(CO1)C(=O)OC MCULE-1350193594 [0,1,0,1,0,0|1,0,1]=4 3574 B7R1.22 CCC(=O)C1CC1 MCULE-6231785303 [0,1,0,1,0,0|0,0,2]=4 3575 B7R1.22 CNC(=O)C1CC1 MCULE-5799863193 [0,1,0,1,0,0|0,0,2]=4 3576 B7R1.22 COC(=O)C1CC1 MCULE-3338113454 [0,1,0,1,0,0|0,0,2]=4 3577 B7R1.22 COC(=O)C1CN1 MCULE-2166427972 [0,1,0,1,0,0|1,0,1]=4 3578 B7R1.22 COC(=O)C1CO1 MCULE-1745412030 [0,1,0,1,0,0|1,0,1]=4 3579 B7R1.22 COC(=O)N1CC1 MCULE-2788788116 [0,1,0,1,0,0|1,0,1]=4 3580 B7R1.22 COC(=O)[C@@H]1CN1 MCULE-1955059175 [0,1,0,1,0,0|1,0,1]=4 3581 B7R1.22 COC(=O)[C@@H]1CN1 MCULE-5011635876 [0,1,0,1,0,0|1,0,1]=4 3582 B7R1.22 COC(=O)[C@@H]1CO1 MCULE-2259836812 [0,1,0,1,0,0|1,0,1]=4 3583 B7R1.22 COC(=O)[C@H]1CN1 MCULE-5882979938 [0,1,0,1,0,0|1,0,1]=4 3584 B7R1.22 COC(=O)[C@H]1CN1 MCULE-8601280412 [0,1,0,1,0,0|1,0,1]=4 3585 B7R1.22 COC(=O)[C@H]1CO1 MCULE-5568309714 [0,1,0,1,0,0|1,0,1]=4 3586 B7R1.22 COC(=O)[C@H]1CO1 MCULE-9432053348 [0,1,0,1,0,0|1,0,1]=4 3587 B7R1.22 NCC(=O)C1CC1 MCULE-1927654168 [0,1,0,1,0,0|0,0,2]=4 3588 B7R1.22 NCC(=O)C1CC1 MCULE-4415662894 [0,1,0,1,0,0|0,0,2]=4 3589 B7R1.22 O=C(CBr)C1CC1 MCULE-1037373080 [0,1,0,1,0,0|0,0,2]=4 3590 B7R1.22 O=C(CCl)C1CC1 MCULE-9791345328 [0,1,0,1,0,0|0,0,2]=4 3591 B7R1.22 O=C(CCl)N1CC1 MCULE-3092013537 [0,1,0,1,0,0|1,0,1]=4 3592 B7R1.22 O=C(CO)C1CC1 MCULE-4276266642 [0,1,0,1,0,0|0,0,2]=4 3593 B7R1.22 [C@H]1(CO1)C(=O)OC MCULE-2114123664 [0,1,0,1,0,0|1,0,1]=4 3594 B7R1.12 C=C1CC1C(=O)O MCULE-4330944573 [0,1,0,1,0,0|1,0,1]=4 3595 B7R1.12 CC(=O)C1CC1C MCULE-5857709747 [0,1,0,1,0,0|0,0,2]=4 3596 B7R1.12 CC(=O)[C@@H]1C[C@H]1C MCULE-4367650211 [0,1,0,1,0,0|0,0,2]=4 3597 B7R1.12 CC1=CC1C(=O)O MCULE-6979504623 [0,1,0,1,0,0|1,0,0]=3 3598 B7R1.16 CC1(CC(=O)C1)C MCULE-4306266527 [0,1,0,1,0,0|0,0,2]=4 3599 B7R1.16 CC1(CC(=O)C1)N MCULE-1739432720 [0,1,0,1,0,0|0,0,2]=4 3600 B7R1.16 CC1(CC(=O)C1)N MCULE-2529462721 [0,1,0,1,0,0|0,0,2]=4 3601 B7R1.16 CC1(CC(=O)N1)C MCULE-5555898363 [0,1,0,1,0,0|1,0,1]=4 3602 B7R1.20 CC(=O)CC1CC1 MCULE-3465510397 [0,1,0,1,0,0|0,0,2]=4 3603 B7R1.20 CC(=O)NC1CC1 MCULE-7553641762 [0,1,0,1,0,0|0,0,2]=4 3604 B7R1.20 O=C(O)C=C1CC1 MCULE-7214971091 [0,1,0,1,0,0|1,0,0]=3 3605 B7R1.18 CC(=O)C1CCC1 MCULE-5770046789 [0,1,0,1,0,0|0,0,2]=4 3606 B7R1.18 CC(=O)C1CNC1 MCULE-2354733934 [0,1,0,1,0,0|0,0,2]=4 3607 B7R1.18 CC(=O)C1CNC1 MCULE-3110609785 [0,1,0,1,0,0|0,0,2]=4 3608 B7R1.18 CC(=O)C1CNC1 MCULE-4112322251 [0,1,0,1,0,0|0,0,2]=4 3609 B7R1.18 CC(=O)C1COC1 MCULE-3416774210 [0,1,0,1,0,0|0,0,2]=4 3610 B7R1.18 CC(=O)N1C=CC1 MCULE-4207230175 [0,1,0,1,0,0|0,0,0]=2 3611 B7R1.18 CC(=O)N1CCC1 MCULE-6467100562 [0,1,0,1,0,0|0,0,2]=4 3612 B7R1.18 O=C(O)C1=CCC1 MCULE-4244912351 [0,1,0,1,0,0|1,0,0]=3 3613 B7R1.19 CC(=O)C1(CC1)Br MCULE-6185731473 [0,1,0,1,0,0|0,0,2]=4 3614 B7R1.19 CC(=O)C1(CC1)C MCULE-8745387740 [0,1,0,1,0,0|0,0,2]=4 3615 B7R1.19 CC(=O)C1(CC1)Cl MCULE-5975776904 [0,1,0,1,0,0|0,0,2]=4 3616 B7R1.19 CC(=O)C1(CC1)F MCULE-5848997919 [0,1,0,1,0,0|0,0,2]=4 3617 B7R1.19 CC(=O)C1(CC1)N MCULE-2138315633 [0,1,0,1,0,0|0,0,2]=4 3618 B7R1.19 CC(=O)C1(CC1)N MCULE-4094057841 [0,1,0,1,0,0|0,0,2]=4 3619 B7R1.19 CC(=O)C1(CO1)C MCULE-3263824467 [0,1,0,1,0,0|1,0,1]=4 3620 B7R1.7 CC/C=C/[C@H]1CO1 MCULE-2083815927 [0,1,0,1,0,0|0,0,2]=4 3621 B7R1.7 COC=CC1CC1 MCULE-6861075225 [0,1,0,1,0,0|1,0,1]=4 3622 B7R1.7 OCC=CC1CC1 MCULE-8179220972 [0,1,0,1,0,0|1,0,1]=4 3623 B7R1.14 CC1(C=CCC1)C MCULE-9154912302 [0,1,0,1,0,0|1,0,1]=4 3624 B7R1.14 CC1(CC=CC1)N MCULE-4544025985 [0,1,0,1,0,0|1,0,1]=4 3625 B7R1.14 CC1(CC=CC1)N MCULE-5362076886 [0,1,0,1,0,0|1,0,1]=4 3626 B7R1.14 CP1(=O)CC=CC1 MCULE-4152900149 [0,1,0,1,0,0|1,0,0]=3 3627 B7R1.14 O=P1(C=CCC1)Cl MCULE-4153870806 [0,1,0,1,0,0|1,0,0]=3 3628 B7R1.14 O=P1(CC=CC1)Cl MCULE-8307035489 [0,1,0,1,0,0|2,0,0]=4 3629 B7R1.14 O=S1(=O)C=CCC1 MCULE-7689521769 [0,1,0,1,0,0|1,0,0]=3 3630 B7R1.14 O=S1(=O)C=CCN1 MCULE-1393327309 [0,1,0,1,0,0|2,0,0]=4 3631 B7R1.14 O=S1(=O)C=CCO1 MCULE-5410343136 [0,1,0,1,0,0|2,0,0]=4 3632 B7R1.14 O=S1(=O)CC=CC1 MCULE-5003570891 [0,1,0,1,0,0|2,0,0]=4 3633 B7R1.14 O=S1(=O)CCC=N1 MCULE-3928927688 [0,1,0,1,0,0|2,0,0]=4 3634 B7R2.13 C1=CC2OC2C1 MCULE-9601635666 [0,0,0,2,0,0|0,0,2]=4