0 B5R0.1 C#CCC(=O)O MCULE-4680699666 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.1 C#CCC(C)C MCULE-2506063278 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.1 C#CCC(C)N MCULE-1523044787 [0,0,0,0,0,0|2,0,2]=4 3 B5R0.1 C#CCC(C)N MCULE-3399522488 [0,0,0,0,0,0|2,0,2]=4 4 B5R0.1 C#CCC(C)O MCULE-2487589857 [0,0,0,0,0,0|1,0,3]=4 5 B5R0.1 C#CCN(C)C MCULE-1589925874 [0,0,0,0,0,0|3,0,1]=4 6 B5R0.1 C(C)(N)CCC MCULE-4800297905 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.1 C(C)(N)CCC MCULE-7674864567 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.1 C(C)(N)CCO MCULE-5545469271 [0,0,0,0,0,0|1,0,1]=2 9 B5R0.1 C/C(=C/C#N)/N MCULE-2195544039 [0,0,0,0,0,0|2,0,2]=4 10 B5R0.1 C/C(=C/CI)/I MCULE-4907089043 [0,0,0,0,0,0|2,0,1]=3 11 B5R0.1 C/C(=C/CN)/Cl MCULE-1091573118 [0,0,0,0,0,0|2,0,1]=3 12 B5R0.1 C/C(=C/CN)/Cl MCULE-8112023611 [0,0,0,0,0,0|2,0,1]=3 13 B5R0.1 C/C(=C\CCl)/Cl MCULE-6679259233 [0,0,0,0,0,0|2,0,1]=3 14 B5R0.1 C/C=C/C(=O)C MCULE-2109656516 [0,0,0,0,0,0|1,0,2]=3 15 B5R0.1 C/C=C/C(=O)Cl MCULE-8378824386 [0,0,0,0,0,0|2,0,2]=4 16 B5R0.1 C/C=C/C(=O)N MCULE-2532228624 [0,0,0,0,0,0|2,0,2]=4 17 B5R0.1 C/C=C/C(=O)O MCULE-6937494852 [0,0,0,0,0,0|2,0,2]=4 18 B5R0.1 C=C(Br)CCBr MCULE-7638627279 [0,0,0,0,0,0|2,0,1]=3 19 B5R0.1 C=C(Br)CCO MCULE-3743908958 [0,0,0,0,0,0|1,0,1]=2 20 B5R0.1 C=C(Br)COC MCULE-5349428431 [0,0,0,0,0,0|3,0,1]=4 21 B5R0.1 C=C(C)CCBr MCULE-3439794005 [0,0,0,0,0,0|2,0,0]=2 22 B5R0.1 C=C(C)CCC MCULE-8225129744 [0,0,0,0,0,0|2,0,0]=2 23 B5R0.1 C=C(C)CCCl MCULE-2816016781 [0,0,0,0,0,0|2,0,0]=2 24 B5R0.1 C=C(C)CCI MCULE-6317205481 [0,0,0,0,0,0|2,0,0]=2 25 B5R0.1 C=C(C)CCN MCULE-4037025602 [0,0,0,0,0,0|2,0,0]=2 26 B5R0.1 C=C(C)CCN MCULE-5001503744 [0,0,0,0,0,0|2,0,0]=2 27 B5R0.1 C=C(C)CCO MCULE-2689800711 [0,0,0,0,0,0|1,0,0]=1 28 B5R0.1 C=C(C)CNC MCULE-6783886553 [0,0,0,0,0,0|3,0,0]=3 29 B5R0.1 C=C(C)CNC MCULE-8292313282 [0,0,0,0,0,0|3,0,0]=3 30 B5R0.1 C=C(C)CNN MCULE-1117931770 [0,0,0,0,0,0|3,0,0]=3 31 B5R0.1 C=C(C)CON MCULE-2773974323 [0,0,0,0,0,0|3,0,0]=3 32 B5R0.1 C=C(C)CON MCULE-5978680243 [0,0,0,0,0,0|3,0,0]=3 33 B5R0.1 C=C(C)OCC MCULE-5303468686 [0,0,0,0,0,0|3,0,0]=3 34 B5R0.1 C=CC=C(C)C MCULE-7590870659 [0,0,0,0,0,0|2,0,2]=4 35 B5R0.1 C=CCC(=C)C MCULE-6294070836 [0,0,0,0,0,0|2,0,1]=3 36 B5R0.1 C=CCC(=N)N MCULE-6305125234 [0,0,0,0,0,0|3,0,1]=4 37 B5R0.1 C=CCC(=O)Cl MCULE-6033189203 [0,0,0,0,0,0|2,0,1]=3 38 B5R0.1 C=CCC(=O)N MCULE-1205335257 [0,0,0,0,0,0|2,0,1]=3 39 B5R0.1 C=CCC(=O)O MCULE-6288979337 [0,0,0,0,0,0|2,0,1]=3 40 B5R0.1 C=CCC(C)Br MCULE-5638987302 [0,0,0,0,0,0|2,0,2]=4 41 B5R0.1 C=CCC(C)C MCULE-4586731422 [0,0,0,0,0,0|2,0,2]=4 42 B5R0.1 C=CCC(C)N MCULE-5354228552 [0,0,0,0,0,0|2,0,2]=4 43 B5R0.1 C=CCC(C)N MCULE-9454660067 [0,0,0,0,0,0|2,0,2]=4 44 B5R0.1 C=CCC(C)O MCULE-7724200334 [0,0,0,0,0,0|1,0,3]=4 45 B5R0.1 C=CCC(C)O MCULE-9910771503 [0,0,0,0,0,0|1,0,3]=4 46 B5R0.1 C=CCN(C)C MCULE-6958853335 [0,0,0,0,0,0|3,0,1]=4 47 B5R0.1 C=CC[C@@H](C)O MCULE-1663575568 [0,0,0,0,0,0|1,0,3]=4 48 B5R0.1 C=CC[C@@H](C)O MCULE-3971480179 [0,0,0,0,0,0|1,0,3]=4 49 B5R0.1 C=CC[C@H](C)N MCULE-2398654329 [0,0,0,0,0,0|2,0,2]=4 50 B5R0.1 C=CC[C@H](C)N MCULE-5817451810 [0,0,0,0,0,0|2,0,2]=4 51 B5R0.1 C=CC[C@H](C)O MCULE-5783959808 [0,0,0,0,0,0|1,0,3]=4 52 B5R0.1 C=CC[C@H](C)O MCULE-6146696600 [0,0,0,0,0,0|1,0,3]=4 53 B5R0.1 C=CNC(=O)C MCULE-1260296806 [0,0,0,0,0,0|2,0,1]=3 54 B5R0.1 C=CNC(=O)N MCULE-4235216182 [0,0,0,0,0,0|3,0,1]=4 55 B5R0.1 C=COC(=O)C MCULE-7626795765 [0,0,0,0,0,0|2,0,1]=3 56 B5R0.1 C=COC(=O)Cl MCULE-9915729615 [0,0,0,0,0,0|3,0,1]=4 57 B5R0.1 C=C[CH+]C(=O)[O-] MCULE-7935071431 [0,0,0,0,0,0|2,0,2]=4 58 B5R0.1 C=NCC(=O)N MCULE-7609497329 [0,0,0,0,0,0|3,0,0]=3 59 B5R0.1 C=NCC(=S)N MCULE-6261527142 [0,0,0,0,0,0|3,1,0]=4 60 B5R0.1 CC#CC(=O)C MCULE-4083248904 [0,0,0,0,0,0|1,0,2]=3 61 B5R0.1 CC#CC(=O)Cl MCULE-6807810093 [0,0,0,0,0,0|2,0,2]=4 62 B5R0.1 CC#CC(=O)O MCULE-9994142213 [0,0,0,0,0,0|2,0,2]=4 63 B5R0.1 CC(=CC#N)C MCULE-7179601066 [0,0,0,0,0,0|2,0,2]=4 64 B5R0.1 CC(=CC#N)N MCULE-7342293837 [0,0,0,0,0,0|2,0,2]=4 65 B5R0.1 CC(=CC=O)C MCULE-7002222435 [0,0,0,0,0,0|1,0,3]=4 66 B5R0.1 CC(=CC=O)Cl MCULE-2279693190 [0,0,0,0,0,0|1,0,3]=4 67 B5R0.1 CC(=CC=O)N MCULE-2659507627 [0,0,0,0,0,0|1,0,3]=4 68 B5R0.1 CC(=CCBr)C MCULE-7961276795 [0,0,0,0,0,0|2,0,1]=3 69 B5R0.1 CC(=CCCl)C MCULE-1110417103 [0,0,0,0,0,0|2,0,1]=3 70 B5R0.1 CC(=CCCl)Cl MCULE-9735045489 [0,0,0,0,0,0|2,0,1]=3 71 B5R0.1 CC(=CCI)I MCULE-4204968539 [0,0,0,0,0,0|2,0,1]=3 72 B5R0.1 CC(=CCN)C MCULE-7220252581 [0,0,0,0,0,0|2,0,1]=3 73 B5R0.1 CC(=CCN)C MCULE-8394581250 [0,0,0,0,0,0|2,0,1]=3 74 B5R0.1 CC(=CCN)Cl MCULE-1749173363 [0,0,0,0,0,0|2,0,1]=3 75 B5R0.1 CC(=CCN)Cl MCULE-5722512850 [0,0,0,0,0,0|2,0,1]=3 76 B5R0.1 CC(=CCO)C MCULE-3984123588 [0,0,0,0,0,0|1,0,1]=2 77 B5R0.1 CC(=CCO)Cl MCULE-6459066496 [0,0,0,0,0,0|1,0,1]=2 78 B5R0.1 CC(=CCO)I MCULE-4600854759 [0,0,0,0,0,0|1,0,1]=2 79 B5R0.1 CC(=CCS)C MCULE-4180446913 [0,0,0,0,0,0|1,1,1]=3 80 B5R0.1 CC(=N)NC#N MCULE-7065360421 [0,0,0,0,0,0|3,0,1]=4 81 B5R0.1 CC(=O)/C=N/O MCULE-5424156575 [0,0,0,0,0,0|1,0,1]=2 82 B5R0.1 CC(=O)/C=N\O MCULE-9083768531 [0,0,0,0,0,0|1,0,1]=2 83 B5R0.1 CC(=O)C=C=O MCULE-4335598177 [0,0,0,0,0,0|0,0,3]=3 84 B5R0.1 CC(=O)C=NO MCULE-5513006918 [0,0,0,0,0,0|1,0,1]=2 85 B5R0.1 CC(=O)CC#N MCULE-7203242552 [0,0,0,0,0,0|1,0,1]=2 86 B5R0.1 CC(=O)CCBr MCULE-2615300206 [0,0,0,0,0,0|1,0,0]=1 87 B5R0.1 CC(=O)CCCl MCULE-8019748964 [0,0,0,0,0,0|1,0,0]=1 88 B5R0.1 CC(=O)CCN MCULE-7550348751 [0,0,0,0,0,0|1,0,0]=1 89 B5R0.1 CC(=O)CCN MCULE-9519063810 [0,0,0,0,0,0|1,0,0]=1 90 B5R0.1 CC(=O)CCO MCULE-6328537335 [0,0,0,0,0,0|0,0,0]=0 91 B5R0.1 CC(=O)N=C=S MCULE-7540453687 [0,0,0,0,0,0|1,1,1]=3 92 B5R0.1 CC(=O)N=S=O MCULE-1420371815 [0,0,0,0,0,0|2,0,1]=3 93 B5R0.1 CC(=O)NC#N MCULE-8444599659 [0,0,0,0,0,0|2,0,1]=3 94 B5R0.1 CC(=O)NCO MCULE-4563335540 [0,0,0,0,0,0|1,0,0]=1 95 B5R0.1 CC(=O)OCBr MCULE-9842804945 [0,0,0,0,0,0|2,0,0]=2 96 B5R0.1 CC(=O)OCCl MCULE-6822222026 [0,0,0,0,0,0|2,0,0]=2 97 B5R0.1 CC(=O)SCBr MCULE-9794607323 [0,0,0,0,0,0|2,0,0]=2 98 B5R0.1 CC(Br)CC#N MCULE-6321379216 [0,0,0,0,0,0|2,0,2]=4 99 B5R0.1 CC(Br)CCBr MCULE-1045475402 [0,0,0,0,0,0|2,0,1]=3 100 B5R0.1 CC(C)/C=N/O MCULE-3201457095 [0,0,0,0,0,0|2,0,2]=4 101 B5R0.1 CC(C)C=NO MCULE-9842574696 [0,0,0,0,0,0|2,0,2]=4 102 B5R0.1 CC(C)CC#N MCULE-4346986727 [0,0,0,0,0,0|2,0,2]=4 103 B5R0.1 CC(C)CC=O MCULE-2939497534 [0,0,0,0,0,0|1,0,3]=4 104 B5R0.1 CC(C)CCBr MCULE-7163010428 [0,0,0,0,0,0|2,0,1]=3 105 B5R0.1 CC(C)CCCl MCULE-8360122696 [0,0,0,0,0,0|2,0,1]=3 106 B5R0.1 CC(C)CCCl MCULE-9017922949 [0,0,0,0,0,0|2,0,1]=3 107 B5R0.1 CC(C)CCI MCULE-4934529500 [0,0,0,0,0,0|2,0,1]=3 108 B5R0.1 CC(C)CCN MCULE-3081003576 [0,0,0,0,0,0|2,0,1]=3 109 B5R0.1 CC(C)CCN MCULE-5118782389 [0,0,0,0,0,0|2,0,1]=3 110 B5R0.1 CC(C)CCN MCULE-5217981670 [0,0,0,0,0,0|2,0,1]=3 111 B5R0.1 CC(C)CCN MCULE-6280940933 [0,0,0,0,0,0|2,0,1]=3 112 B5R0.1 CC(C)CCO MCULE-7411270401 [0,0,0,0,0,0|1,0,1]=2 113 B5R0.1 CC(C)CCS MCULE-7115473363 [0,0,0,0,0,0|1,1,1]=3 114 B5R0.1 CC(C)CNN MCULE-6797887001 [0,0,0,0,0,0|3,0,1]=4 115 B5R0.1 CC(C)CNN MCULE-9592971233 [0,0,0,0,0,0|3,0,1]=4 116 B5R0.1 CC(C)CNN MCULE-9725792452 [0,0,0,0,0,0|3,0,1]=4 117 B5R0.1 CC(C)CON MCULE-3476786246 [0,0,0,0,0,0|3,0,1]=4 118 B5R0.1 CC(C)CON MCULE-4450654727 [0,0,0,0,0,0|3,0,1]=4 119 B5R0.1 CC(C)OCCl MCULE-3680602217 [0,0,0,0,0,0|3,0,1]=4 120 B5R0.1 CC(C)SCCl MCULE-3836735379 [0,0,0,0,0,0|3,0,1]=4 121 B5R0.1 CC(Cl)CCCl MCULE-3656498608 [0,0,0,0,0,0|2,0,1]=3 122 B5R0.1 CC(Cl)CCO MCULE-1955496242 [0,0,0,0,0,0|1,0,1]=2 123 B5R0.1 CC(F)CCBr MCULE-3035340901 [0,0,0,0,0,0|2,0,1]=3 124 B5R0.1 CC(F)CCI MCULE-6469250150 [0,0,0,0,0,0|2,0,1]=3 125 B5R0.1 CC(F)CCN MCULE-2805813131 [0,0,0,0,0,0|2,0,1]=3 126 B5R0.1 CC(F)CCN MCULE-5849913362 [0,0,0,0,0,0|2,0,1]=3 127 B5R0.1 CC(N)CC#N MCULE-2350352782 [0,0,0,0,0,0|2,0,2]=4 128 B5R0.1 CC(N)CC#N MCULE-7269201059 [0,0,0,0,0,0|2,0,2]=4 129 B5R0.1 CC(N)CCN MCULE-5308134596 [0,0,0,0,0,0|2,0,1]=3 130 B5R0.1 CC(N)CCN MCULE-5880045507 [0,0,0,0,0,0|2,0,1]=3 131 B5R0.1 CC(N)CCN MCULE-7827515430 [0,0,0,0,0,0|2,0,1]=3 132 B5R0.1 CC(N)CCO MCULE-1771399942 [0,0,0,0,0,0|1,0,1]=2 133 B5R0.1 CC(N)CCO MCULE-7239872808 [0,0,0,0,0,0|1,0,1]=2 134 B5R0.1 CC(O)CC#N MCULE-7172428142 [0,0,0,0,0,0|1,0,3]=4 135 B5R0.1 CC(O)CCBr MCULE-7983169885 [0,0,0,0,0,0|1,0,2]=3 136 B5R0.1 CC(O)CCCl MCULE-2952545606 [0,0,0,0,0,0|1,0,2]=3 137 B5R0.1 CC(O)CCN MCULE-6836791276 [0,0,0,0,0,0|1,0,2]=3 138 B5R0.1 CC(O)CCN MCULE-7186260925 [0,0,0,0,0,0|1,0,2]=3 139 B5R0.1 CC(O)CCO MCULE-1694239851 [0,0,0,0,0,0|0,0,2]=2 140 B5R0.1 CC(O)CCO MCULE-7784884948 [0,0,0,0,0,0|0,0,2]=2 141 B5R0.1 CC(O)CNN MCULE-4956670781 [0,0,0,0,0,0|2,0,2]=4 142 B5R0.1 CC(O)CNN MCULE-7917439573 [0,0,0,0,0,0|2,0,2]=4 143 B5R0.1 CC(O)CON MCULE-1051091134 [0,0,0,0,0,0|2,0,2]=4 144 B5R0.1 CC(O)CON MCULE-6722092589 [0,0,0,0,0,0|2,0,2]=4 145 B5R0.1 CC(S)CCO MCULE-5702212503 [0,0,0,0,0,0|0,1,1]=2 146 B5R0.1 CC=CC(=O)C MCULE-4826977340 [0,0,0,0,0,0|1,0,2]=3 147 B5R0.1 CC=CC(=O)Cl MCULE-2747622237 [0,0,0,0,0,0|2,0,2]=4 148 B5R0.1 CC=CC(=O)N MCULE-9693879476 [0,0,0,0,0,0|2,0,2]=4 149 B5R0.1 CC=CC(=O)O MCULE-7970410217 [0,0,0,0,0,0|2,0,2]=4 150 B5R0.1 CCC=C(C)C MCULE-2405063894 [0,0,0,0,0,0|2,0,1]=3 151 B5R0.1 CCC=C(F)F MCULE-5180612061 [0,0,0,0,0,0|3,0,1]=4 152 B5R0.1 CCCB(O)O MCULE-4994980798 [0,0,0,0,0,0|3,0,1]=4 153 B5R0.1 CCCC(=N)N MCULE-5974105638 [0,0,0,0,0,0|3,0,0]=3 154 B5R0.1 CCCC(=N)N MCULE-9230704591 [0,0,0,0,0,0|3,0,0]=3 155 B5R0.1 CCCC(=O)C MCULE-7174095676 [0,0,0,0,0,0|1,0,0]=1 156 B5R0.1 CCCC(=O)Cl MCULE-3288175193 [0,0,0,0,0,0|2,0,0]=2 157 B5R0.1 CCCC(=O)N MCULE-2712067671 [0,0,0,0,0,0|2,0,0]=2 158 B5R0.1 CCCC(=O)O MCULE-4116382006 [0,0,0,0,0,0|2,0,0]=2 159 B5R0.1 CCCC(=O)[O-] MCULE-8706538802 [0,0,0,0,0,0|2,0,0]=2 160 B5R0.1 CCCC(=O)[O-] MCULE-9764702574 [0,0,0,0,0,0|2,0,0]=2 161 B5R0.1 CCCC(=S)N MCULE-3529335988 [0,0,0,0,0,0|2,1,0]=3 162 B5R0.1 CCCC(=S)O MCULE-3382199964 [0,0,0,0,0,0|2,0,1]=3 163 B5R0.1 CCCC(C)Br MCULE-3178073667 [0,0,0,0,0,0|2,0,1]=3 164 B5R0.1 CCCC(C)C MCULE-9604552974 [0,0,0,0,0,0|2,0,1]=3 165 B5R0.1 CCCC(C)N MCULE-2640298430 [0,0,0,0,0,0|2,0,1]=3 166 B5R0.1 CCCC(C)N MCULE-7225905167 [0,0,0,0,0,0|2,0,1]=3 167 B5R0.1 CCCC(C)O MCULE-8205906299 [0,0,0,0,0,0|1,0,2]=3 168 B5R0.1 CCCC(C)S MCULE-1649095713 [0,0,0,0,0,0|1,1,1]=3 169 B5R0.1 CCCC(O)Cl MCULE-3188577082 [0,0,0,0,0,0|2,0,2]=4 170 B5R0.1 CCCN(=O)=O MCULE-5615753372 [0,0,0,0,0,0|3,0,0]=3 171 B5R0.1 CCCN(C)C MCULE-8702643596 [0,0,0,0,0,0|3,0,0]=3 172 B5R0.1 CCCS(=O)[O-] MCULE-4306915022 [0,0,0,0,0,0|3,0,0]=3 173 B5R0.1 CCCS(=O)[O-] MCULE-9775151913 [0,0,0,0,0,0|3,0,0]=3 174 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [0,0,0,0,0,0|2,0,1]=3 175 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [0,0,0,0,0,0|2,0,1]=3 176 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [0,0,0,0,0,0|2,0,1]=3 177 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [0,0,0,0,0,0|2,0,1]=3 178 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [0,0,0,0,0,0|1,0,2]=3 179 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [0,0,0,0,0,0|2,0,1]=3 180 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [0,0,0,0,0,0|2,0,1]=3 181 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [0,0,0,0,0,0|2,0,1]=3 182 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [0,0,0,0,0,0|2,0,1]=3 183 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [0,0,0,0,0,0|1,0,2]=3 184 B5R0.1 CCNC(=N)N MCULE-4729418155 [0,0,0,0,0,0|4,0,0]=4 185 B5R0.1 CCNC(=N)N MCULE-5123343071 [0,0,0,0,0,0|4,0,0]=4 186 B5R0.1 CCNC(=O)C MCULE-7543656350 [0,0,0,0,0,0|2,0,0]=2 187 B5R0.1 CCNC(=O)Cl MCULE-5831262934 [0,0,0,0,0,0|3,0,0]=3 188 B5R0.1 CCNC(=O)N MCULE-1913599861 [0,0,0,0,0,0|3,0,0]=3 189 B5R0.1 CCNC(=S)N MCULE-3849517146 [0,0,0,0,0,0|3,1,0]=4 190 B5R0.1 CCNC(C)C MCULE-8064118469 [0,0,0,0,0,0|3,0,1]=4 191 B5R0.1 CCOC(=N)C MCULE-3060267072 [0,0,0,0,0,0|3,0,0]=3 192 B5R0.1 CCOC(=N)C MCULE-3943786182 [0,0,0,0,0,0|3,0,0]=3 193 B5R0.1 CCOC(=N)N MCULE-3570858508 [0,0,0,0,0,0|4,0,0]=4 194 B5R0.1 CCOC(=N)N MCULE-6061063856 [0,0,0,0,0,0|4,0,0]=4 195 B5R0.1 CCOC(=O)C MCULE-6628539781 [0,0,0,0,0,0|2,0,0]=2 196 B5R0.1 CCOC(=O)Cl MCULE-4167904934 [0,0,0,0,0,0|3,0,0]=3 197 B5R0.1 CCOC(=O)N MCULE-1776877276 [0,0,0,0,0,0|3,0,0]=3 198 B5R0.1 CCOC(=S)C MCULE-3358897597 [0,0,0,0,0,0|2,1,0]=3 199 B5R0.1 CCOC(=S)N MCULE-4649285010 [0,0,0,0,0,0|3,1,0]=4 200 B5R0.1 CCOC(=S)[S-] MCULE-6247969567 [0,0,0,0,0,0|3,1,0]=4 201 B5R0.1 CCOC(=S)[S-] MCULE-6902289618 [0,0,0,0,0,0|3,1,0]=4 202 B5R0.1 CCOC(=S)[S-] MCULE-9105300958 [0,0,0,0,0,0|3,1,0]=4 203 B5R0.1 CCOC(C)C MCULE-1934548340 [0,0,0,0,0,0|3,0,1]=4 204 B5R0.1 CCOC(C)Cl MCULE-8486994638 [0,0,0,0,0,0|3,0,1]=4 205 B5R0.1 CCSC(=N)N MCULE-2161729152 [0,0,0,0,0,0|4,0,0]=4 206 B5R0.1 CCSC(=N)N MCULE-2547252984 [0,0,0,0,0,0|4,0,0]=4 207 B5R0.1 CCSC(=O)C MCULE-8015440229 [0,0,0,0,0,0|2,0,0]=2 208 B5R0.1 CCSC(=S)C MCULE-1502137460 [0,0,0,0,0,0|2,1,0]=3 209 B5R0.1 CCSC(=S)[S-] MCULE-2573650807 [0,0,0,0,0,0|3,1,0]=4 210 B5R0.1 CCSC(=S)[S-] MCULE-6172057982 [0,0,0,0,0,0|3,1,0]=4 211 B5R0.1 CCSC(C)C MCULE-3738251898 [0,0,0,0,0,0|3,0,1]=4 212 B5R0.1 CC[NH2+]C(=N)N MCULE-1701852752 [0,0,0,0,0,0|4,0,0]=4 213 B5R0.1 CC[O+]=C(N)N MCULE-2484225131 [0,0,0,0,0,0|4,0,0]=4 214 B5R0.1 CC[O+]=C(N)N MCULE-6688774534 [0,0,0,0,0,0|4,0,0]=4 215 B5R0.1 CN(C)CC#N MCULE-7617361185 [0,0,0,0,0,0|3,0,1]=4 216 B5R0.1 CN(C)CC=O MCULE-1229218563 [0,0,0,0,0,0|2,0,2]=4 217 B5R0.1 CN(C)CC=O MCULE-3577561950 [0,0,0,0,0,0|2,0,2]=4 218 B5R0.1 CN(C)CC=O MCULE-4493766862 [0,0,0,0,0,0|2,0,2]=4 219 B5R0.1 CN(C)CC=O MCULE-8123455398 [0,0,0,0,0,0|2,0,2]=4 220 B5R0.1 CN(C)CCBr MCULE-4844398053 [0,0,0,0,0,0|3,0,0]=3 221 B5R0.1 CN(C)CCCl MCULE-4297554717 [0,0,0,0,0,0|3,0,0]=3 222 B5R0.1 CN(C)CCCl MCULE-4465544992 [0,0,0,0,0,0|3,0,0]=3 223 B5R0.1 CN(C)CCI MCULE-4687894526 [0,0,0,0,0,0|3,0,0]=3 224 B5R0.1 CN(C)CCI MCULE-7464680246 [0,0,0,0,0,0|3,0,0]=3 225 B5R0.1 CN(C)CCI MCULE-9051868668 [0,0,0,0,0,0|3,0,0]=3 226 B5R0.1 CN(C)CCN MCULE-6693759372 [0,0,0,0,0,0|3,0,0]=3 227 B5R0.1 CN(C)CCN MCULE-6929925748 [0,0,0,0,0,0|3,0,0]=3 228 B5R0.1 CN(C)CCN MCULE-7881547574 [0,0,0,0,0,0|3,0,0]=3 229 B5R0.1 CN(C)CCO MCULE-5715813465 [0,0,0,0,0,0|2,0,0]=2 230 B5R0.1 CN(C)CCO MCULE-7567469160 [0,0,0,0,0,0|2,0,0]=2 231 B5R0.1 CN(C)CCO MCULE-9024108074 [0,0,0,0,0,0|2,0,0]=2 232 B5R0.1 CN(C)CCS MCULE-4356815596 [0,0,0,0,0,0|2,1,0]=3 233 B5R0.1 CN(C)CCS MCULE-4611688723 [0,0,0,0,0,0|2,1,0]=3 234 B5R0.1 CN(C)CCS MCULE-6259585517 [0,0,0,0,0,0|2,1,0]=3 235 B5R0.1 CN(N)CCN MCULE-2782966878 [0,0,0,0,0,0|3,0,0]=3 236 B5R0.1 CNCC(=O)C MCULE-3695443024 [0,0,0,0,0,0|2,0,0]=2 237 B5R0.1 CNCC(=O)C MCULE-7402723072 [0,0,0,0,0,0|2,0,0]=2 238 B5R0.1 CNCC(=O)N MCULE-2328887394 [0,0,0,0,0,0|3,0,0]=3 239 B5R0.1 CNCC(=O)N MCULE-3031605853 [0,0,0,0,0,0|3,0,0]=3 240 B5R0.1 CNCC(=O)N MCULE-7300977677 [0,0,0,0,0,0|3,0,0]=3 241 B5R0.1 CNCC(=O)O MCULE-3448356048 [0,0,0,0,0,0|3,0,0]=3 242 B5R0.1 CNCC(=O)O MCULE-4484444573 [0,0,0,0,0,0|3,0,0]=3 243 B5R0.1 CNCC(=O)[O-] MCULE-7993701866 [0,0,0,0,0,0|3,0,0]=3 244 B5R0.1 CNCC(C)C MCULE-6582386339 [0,0,0,0,0,0|3,0,1]=4 245 B5R0.1 CNCC(C)C MCULE-6856717783 [0,0,0,0,0,0|3,0,1]=4 246 B5R0.1 CNCC(C)F MCULE-4381138647 [0,0,0,0,0,0|3,0,1]=4 247 B5R0.1 CNCC(C)F MCULE-9018181183 [0,0,0,0,0,0|3,0,1]=4 248 B5R0.1 CNCC(C)O MCULE-3671071529 [0,0,0,0,0,0|2,0,2]=4 249 B5R0.1 CNCC(C)O MCULE-4171705304 [0,0,0,0,0,0|2,0,2]=4 250 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [0,0,0,0,0,0|2,0,2]=4 251 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [0,0,0,0,0,0|2,0,2]=4 252 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [0,0,0,0,0,0|2,0,2]=4 253 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [0,0,0,0,0,0|2,0,2]=4 254 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [0,0,0,0,0,0|2,0,2]=4 255 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [0,0,0,0,0,0|2,0,2]=4 256 B5R0.1 CNN=C(C)C MCULE-6307375856 [0,0,0,0,0,0|4,0,0]=4 257 B5R0.1 CNOC(=O)C MCULE-1464426541 [0,0,0,0,0,0|3,0,0]=3 258 B5R0.1 CNOC(=O)C MCULE-2976282666 [0,0,0,0,0,0|3,0,0]=3 259 B5R0.1 COC=C(C)C MCULE-6348538911 [0,0,0,0,0,0|3,0,1]=4 260 B5R0.1 COCC(=N)N MCULE-4711728356 [0,0,0,0,0,0|4,0,0]=4 261 B5R0.1 COCC(=N)N MCULE-7163250467 [0,0,0,0,0,0|4,0,0]=4 262 B5R0.1 COCC(=O)C MCULE-7262197587 [0,0,0,0,0,0|2,0,0]=2 263 B5R0.1 COCC(=O)Cl MCULE-5449267495 [0,0,0,0,0,0|3,0,0]=3 264 B5R0.1 COCC(=O)N MCULE-6674958132 [0,0,0,0,0,0|3,0,0]=3 265 B5R0.1 COCC(=O)O MCULE-3945589151 [0,0,0,0,0,0|3,0,0]=3 266 B5R0.1 COCC(=S)N MCULE-2046809269 [0,0,0,0,0,0|3,1,0]=4 267 B5R0.1 COCC(C)Br MCULE-6850689931 [0,0,0,0,0,0|3,0,1]=4 268 B5R0.1 COCC(C)I MCULE-8608265714 [0,0,0,0,0,0|3,0,1]=4 269 B5R0.1 COCC(C)N MCULE-1896873634 [0,0,0,0,0,0|3,0,1]=4 270 B5R0.1 COCC(C)N MCULE-2549420211 [0,0,0,0,0,0|3,0,1]=4 271 B5R0.1 COCC(C)N MCULE-3490410444 [0,0,0,0,0,0|3,0,1]=4 272 B5R0.1 COCC(C)N MCULE-7089888882 [0,0,0,0,0,0|3,0,1]=4 273 B5R0.1 COCC(C)O MCULE-4022733014 [0,0,0,0,0,0|2,0,2]=4 274 B5R0.1 COCC(C)O MCULE-7513310960 [0,0,0,0,0,0|2,0,2]=4 275 B5R0.1 COCN(C)C MCULE-1963225930 [0,0,0,0,0,0|4,0,0]=4 276 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [0,0,0,0,0,0|3,0,1]=4 277 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [0,0,0,0,0,0|3,0,1]=4 278 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [0,0,0,0,0,0|3,0,1]=4 279 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [0,0,0,0,0,0|3,0,1]=4 280 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [0,0,0,0,0,0|2,0,2]=4 281 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [0,0,0,0,0,0|2,0,2]=4 282 B5R0.1 COC[C@H](C)N MCULE-2465679418 [0,0,0,0,0,0|3,0,1]=4 283 B5R0.1 COC[C@H](C)N MCULE-2998593539 [0,0,0,0,0,0|3,0,1]=4 284 B5R0.1 COC[C@H](C)N MCULE-3161045661 [0,0,0,0,0,0|3,0,1]=4 285 B5R0.1 COC[C@H](C)N MCULE-9550165578 [0,0,0,0,0,0|3,0,1]=4 286 B5R0.1 COC[C@H](C)O MCULE-5908531683 [0,0,0,0,0,0|2,0,2]=4 287 B5R0.1 COC[C@H](C)O MCULE-8619138238 [0,0,0,0,0,0|2,0,2]=4 288 B5R0.1 CONC(=O)C MCULE-6601866630 [0,0,0,0,0,0|3,0,0]=3 289 B5R0.1 CONC(=O)N MCULE-3063713861 [0,0,0,0,0,0|4,0,0]=4 290 B5R0.1 CONC(=S)C MCULE-1876042939 [0,0,0,0,0,0|3,1,0]=4 291 B5R0.1 CS(=O)CC#N MCULE-1246621507 [0,0,0,0,0,0|2,0,1]=3 292 B5R0.1 CS(=O)CCBr MCULE-7846126230 [0,0,0,0,0,0|2,0,0]=2 293 B5R0.1 CS(=O)CCCl MCULE-7012781505 [0,0,0,0,0,0|2,0,0]=2 294 B5R0.1 CS(=O)CCN MCULE-6497874560 [0,0,0,0,0,0|2,0,0]=2 295 B5R0.1 CS(=O)CCN MCULE-8275663766 [0,0,0,0,0,0|2,0,0]=2 296 B5R0.1 CS(=O)CCN MCULE-8330490290 [0,0,0,0,0,0|2,0,0]=2 297 B5R0.1 CS(=O)CCO MCULE-8331553582 [0,0,0,0,0,0|1,0,0]=1 298 B5R0.1 CSCC(=N)N MCULE-7800929509 [0,0,0,0,0,0|4,0,0]=4 299 B5R0.1 CSCC(=N)N MCULE-8499985777 [0,0,0,0,0,0|4,0,0]=4 300 B5R0.1 CSCC(=O)C MCULE-4131794172 [0,0,0,0,0,0|2,0,0]=2 301 B5R0.1 CSCC(=O)Cl MCULE-9750052685 [0,0,0,0,0,0|3,0,0]=3 302 B5R0.1 CSCC(=O)N MCULE-4865579476 [0,0,0,0,0,0|3,0,0]=3 303 B5R0.1 CSCC(=O)O MCULE-7003418159 [0,0,0,0,0,0|3,0,0]=3 304 B5R0.1 CSCC(=S)N MCULE-5029100305 [0,0,0,0,0,0|3,1,0]=4 305 B5R0.1 CSCC(C)N MCULE-7985946030 [0,0,0,0,0,0|3,0,1]=4 306 B5R0.1 CSCC(C)O MCULE-2227652351 [0,0,0,0,0,0|2,0,2]=4 307 B5R0.1 CSCN(C)C MCULE-2931143051 [0,0,0,0,0,0|4,0,0]=4 308 B5R0.1 CSCS(=O)C MCULE-3167702486 [0,0,0,0,0,0|3,0,0]=3 309 B5R0.1 CSNC(=O)C MCULE-7350061514 [0,0,0,0,0,0|3,0,0]=3 310 B5R0.1 C[C@@H](N)CC#N MCULE-1923686728 [0,0,0,0,0,0|2,0,2]=4 311 B5R0.1 C[C@@H](N)CC#N MCULE-5694530830 [0,0,0,0,0,0|2,0,2]=4 312 B5R0.1 C[C@@H](N)CC#N MCULE-8880445785 [0,0,0,0,0,0|2,0,2]=4 313 B5R0.1 C[C@@H](N)CC#N MCULE-9410509782 [0,0,0,0,0,0|2,0,2]=4 314 B5R0.1 C[C@@H](N)CCO MCULE-4224878672 [0,0,0,0,0,0|1,0,1]=2 315 B5R0.1 C[C@@H](N)CCO MCULE-5727539473 [0,0,0,0,0,0|1,0,1]=2 316 B5R0.1 C[C@@H](O)CC#N MCULE-2879004464 [0,0,0,0,0,0|1,0,3]=4 317 B5R0.1 C[C@@H](O)CCN MCULE-7588849994 [0,0,0,0,0,0|1,0,2]=3 318 B5R0.1 C[C@@H](O)CCN MCULE-7895006310 [0,0,0,0,0,0|1,0,2]=3 319 B5R0.1 C[C@@H](O)CCN MCULE-9071323255 [0,0,0,0,0,0|1,0,2]=3 320 B5R0.1 C[C@@H](O)CCN MCULE-9627550610 [0,0,0,0,0,0|1,0,2]=3 321 B5R0.1 C[C@@H](O)CCO MCULE-6277947442 [0,0,0,0,0,0|0,0,2]=2 322 B5R0.1 C[C@@H](O)CCO MCULE-9742368348 [0,0,0,0,0,0|0,0,2]=2 323 B5R0.1 C[C@@H](O)CON MCULE-3740397343 [0,0,0,0,0,0|2,0,2]=4 324 B5R0.1 C[C@@H](O)CON MCULE-8274376872 [0,0,0,0,0,0|2,0,2]=4 325 B5R0.1 C[C@H](N)CC#N MCULE-1876010727 [0,0,0,0,0,0|2,0,2]=4 326 B5R0.1 C[C@H](N)CC#N MCULE-6927344020 [0,0,0,0,0,0|2,0,2]=4 327 B5R0.1 C[C@H](N)CC#N MCULE-9082410813 [0,0,0,0,0,0|2,0,2]=4 328 B5R0.1 C[C@H](N)CC#N MCULE-9498047771 [0,0,0,0,0,0|2,0,2]=4 329 B5R0.1 C[C@H](N)CCO MCULE-1496375567 [0,0,0,0,0,0|1,0,1]=2 330 B5R0.1 C[C@H](N)CCO MCULE-4744824708 [0,0,0,0,0,0|1,0,1]=2 331 B5R0.1 C[C@H](N)CCO MCULE-7219173683 [0,0,0,0,0,0|1,0,1]=2 332 B5R0.1 C[C@H](N)CCO MCULE-9164942837 [0,0,0,0,0,0|1,0,1]=2 333 B5R0.1 C[C@H](O)CC#N MCULE-1968982761 [0,0,0,0,0,0|1,0,3]=4 334 B5R0.1 C[C@H](O)CCN MCULE-7570743309 [0,0,0,0,0,0|1,0,2]=3 335 B5R0.1 C[C@H](O)CCN MCULE-9428853702 [0,0,0,0,0,0|1,0,2]=3 336 B5R0.1 C[C@H](O)CCO MCULE-2504912618 [0,0,0,0,0,0|0,0,2]=2 337 B5R0.1 C[C@H](O)CCO MCULE-2958119786 [0,0,0,0,0,0|0,0,2]=2 338 B5R0.1 C[C@H](O)CON MCULE-4216605221 [0,0,0,0,0,0|2,0,2]=4 339 B5R0.1 C[C@H](O)CON MCULE-9863094719 [0,0,0,0,0,0|2,0,2]=4 340 B5R0.1 C[NH+](C)CCBr MCULE-4990293495 [0,0,0,0,0,0|3,0,0]=3 341 B5R0.1 C[S+](C)CCCl MCULE-1305595131 [0,0,0,0,0,0|3,0,0]=3 342 B5R0.1 C[S+](C)CCCl MCULE-9761617787 [0,0,0,0,0,0|3,0,0]=3 343 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [0,0,0,0,0,0|1,0,0]=1 344 B5R0.1 ClC(=CCBr)Cl MCULE-5947456231 [0,0,0,0,0,0|3,0,1]=4 345 B5R0.1 ClCC=C(Cl)Cl MCULE-8294724084 [0,0,0,0,0,0|3,0,1]=4 346 B5R0.1 FC(=CCBr)F MCULE-1770710917 [0,0,0,0,0,0|3,0,1]=4 347 B5R0.1 N#CCC(=O)Cl MCULE-7971055738 [0,0,0,0,0,0|2,0,1]=3 348 B5R0.1 N#CCC(=O)N MCULE-8538286230 [0,0,0,0,0,0|2,0,1]=3 349 B5R0.1 N#CCC(=O)O MCULE-3440765061 [0,0,0,0,0,0|2,0,1]=3 350 B5R0.1 N#CCC(=O)[O-] MCULE-2598625909 [0,0,0,0,0,0|2,0,1]=3 351 B5R0.1 N#CCC(=O)[O-] MCULE-3532110520 [0,0,0,0,0,0|2,0,1]=3 352 B5R0.1 N#CCC(=S)N MCULE-6348216099 [0,0,0,0,0,0|2,1,1]=4 353 B5R0.1 N#CCC(=[Se])N MCULE-7730610345 [0,0,0,0,0,0|2,1,1]=4 354 B5R0.1 N#CCN(=O)=O MCULE-1994427033 [0,0,0,0,0,0|3,0,1]=4 355 B5R0.1 N=C(N)CCCl MCULE-2314996365 [0,0,0,0,0,0|3,0,0]=3 356 B5R0.1 N=C(N)CCCl MCULE-3129838313 [0,0,0,0,0,0|3,0,0]=3 357 B5R0.1 N=C(N)CCO MCULE-4567824707 [0,0,0,0,0,0|2,0,0]=2 358 B5R0.1 N=C(N)CCO MCULE-7139693715 [0,0,0,0,0,0|2,0,0]=2 359 B5R0.1 NC(=O)C=CCl MCULE-3595468874 [0,0,0,0,0,0|2,0,2]=4 360 B5R0.1 NC(=O)C=NO MCULE-6447662753 [0,0,0,0,0,0|2,0,1]=3 361 B5R0.1 NC(=O)CCBr MCULE-3930714776 [0,0,0,0,0,0|2,0,0]=2 362 B5R0.1 NC(=O)CCCl MCULE-8300320959 [0,0,0,0,0,0|2,0,0]=2 363 B5R0.1 NC(=O)CCO MCULE-4026170350 [0,0,0,0,0,0|1,0,0]=1 364 B5R0.1 NC(=O)CCS MCULE-7451827717 [0,0,0,0,0,0|1,1,0]=2 365 B5R0.1 NC(=O)NCO MCULE-7403641101 [0,0,0,0,0,0|2,0,0]=2 366 B5R0.1 NC(=O)NN=O MCULE-2820469915 [0,0,0,0,0,0|3,0,1]=4 367 B5R0.1 NCC=C(Cl)Cl MCULE-6555955942 [0,0,0,0,0,0|3,0,1]=4 368 B5R0.1 NCC=C(Cl)Cl MCULE-9019653665 [0,0,0,0,0,0|3,0,1]=4 369 B5R0.1 NCCC(=O)Cl MCULE-1298355499 [0,0,0,0,0,0|2,0,0]=2 370 B5R0.1 NCCC(=O)N MCULE-2899414135 [0,0,0,0,0,0|2,0,0]=2 371 B5R0.1 NCCC(=O)N MCULE-6993286668 [0,0,0,0,0,0|2,0,0]=2 372 B5R0.1 NCCC(=O)O MCULE-1344289084 [0,0,0,0,0,0|2,0,0]=2 373 B5R0.1 NCCC(=O)O MCULE-2298605337 [0,0,0,0,0,0|2,0,0]=2 374 B5R0.1 NCCC(=O)O MCULE-9375577631 [0,0,0,0,0,0|2,0,0]=2 375 B5R0.1 NCCC(=O)[O-] MCULE-2492250086 [0,0,0,0,0,0|2,0,0]=2 376 B5R0.1 NCCC(F)F MCULE-3610134573 [0,0,0,0,0,0|3,0,1]=4 377 B5R0.1 NCCC(F)F MCULE-5561095460 [0,0,0,0,0,0|3,0,1]=4 378 B5R0.1 NCCN(=O)=O MCULE-8137427440 [0,0,0,0,0,0|3,0,0]=3 379 B5R0.1 NCCP(=O)O MCULE-7093964616 [0,0,0,0,0,0|3,0,0]=3 380 B5R0.1 NCCS(=O)O MCULE-4372248641 [0,0,0,0,0,0|3,0,0]=3 381 B5R0.1 NNCC(=O)N MCULE-2794619708 [0,0,0,0,0,0|3,0,0]=3 382 B5R0.1 NNCC(=O)N MCULE-6773156087 [0,0,0,0,0,0|3,0,0]=3 383 B5R0.1 NNCC(=O)O MCULE-4908184724 [0,0,0,0,0,0|3,0,0]=3 384 B5R0.1 NNCC(=O)O MCULE-6315598774 [0,0,0,0,0,0|3,0,0]=3 385 B5R0.1 NOCC(=O)O MCULE-4566186819 [0,0,0,0,0,0|3,0,0]=3 386 B5R0.1 NOCC(=O)O MCULE-4824237418 [0,0,0,0,0,0|3,0,0]=3 387 B5R0.1 NOCC(=O)O MCULE-8132180423 [0,0,0,0,0,0|3,0,0]=3 388 B5R0.1 O=C(Cl)C=CCl MCULE-7984379237 [0,0,0,0,0,0|2,0,2]=4 389 B5R0.1 O=C(Cl)CCBr MCULE-4659506608 [0,0,0,0,0,0|2,0,0]=2 390 B5R0.1 O=C(Cl)CCCl MCULE-3313924878 [0,0,0,0,0,0|2,0,0]=2 391 B5R0.1 O=C(Cl)CCF MCULE-3316397790 [0,0,0,0,0,0|2,0,0]=2 392 B5R0.1 O=C(Cl)OCCl MCULE-2130588147 [0,0,0,0,0,0|3,0,0]=3 393 B5R0.1 O=C(O)/C=C/Br MCULE-7284519266 [0,0,0,0,0,0|2,0,2]=4 394 B5R0.1 O=C(O)/C=C/Cl MCULE-1625781671 [0,0,0,0,0,0|2,0,2]=4 395 B5R0.1 O=C(O)/C=C/I MCULE-3339607379 [0,0,0,0,0,0|2,0,2]=4 396 B5R0.1 O=C(O)/C=C\Br MCULE-6149049313 [0,0,0,0,0,0|2,0,2]=4 397 B5R0.1 O=C(O)/C=C\Cl MCULE-1221996674 [0,0,0,0,0,0|2,0,2]=4 398 B5R0.1 O=C(O)/C=C\I MCULE-3065405012 [0,0,0,0,0,0|2,0,2]=4 399 B5R0.1 O=C(O)/C=N/O MCULE-2471349844 [0,0,0,0,0,0|2,0,1]=3 400 B5R0.1 O=C(O)C#CBr MCULE-1997285471 [0,0,0,0,0,0|2,0,2]=4 401 B5R0.1 O=C(O)C=CBr MCULE-2956464856 [0,0,0,0,0,0|2,0,2]=4 402 B5R0.1 O=C(O)C=CCl MCULE-6369812151 [0,0,0,0,0,0|2,0,2]=4 403 B5R0.1 O=C(O)C=CI MCULE-7162332129 [0,0,0,0,0,0|2,0,2]=4 404 B5R0.1 O=C(O)C=NO MCULE-2039309679 [0,0,0,0,0,0|2,0,1]=3 405 B5R0.1 O=C(O)CCBr MCULE-2816055853 [0,0,0,0,0,0|2,0,0]=2 406 B5R0.1 O=C(O)CCCl MCULE-8511144183 [0,0,0,0,0,0|2,0,0]=2 407 B5R0.1 O=C(O)CCF MCULE-4382025684 [0,0,0,0,0,0|2,0,0]=2 408 B5R0.1 O=C(O)CCI MCULE-3371354708 [0,0,0,0,0,0|2,0,0]=2 409 B5R0.1 O=C(O)CCO MCULE-3428604829 [0,0,0,0,0,0|1,0,0]=1 410 B5R0.1 O=C(O)CCS MCULE-3211932163 [0,0,0,0,0,0|1,1,0]=2 411 B5R0.1 O=C(O)CNO MCULE-4437067339 [0,0,0,0,0,0|2,0,0]=2 412 B5R0.1 O=C([O-])C#CO MCULE-3725047218 [0,0,0,0,0,0|1,0,2]=3 413 B5R0.1 O=C([O-])C#CO MCULE-9125153565 [0,0,0,0,0,0|1,0,2]=3 414 B5R0.1 O=C([O-])C=CCl MCULE-4750072789 [0,0,0,0,0,0|2,0,2]=4 415 B5R0.1 O=C([O-])CCO MCULE-4429611588 [0,0,0,0,0,0|1,0,0]=1 416 B5R0.1 O=N(=O)CCO MCULE-2060841405 [0,0,0,0,0,0|2,0,0]=2 417 B5R0.1 O=N(=O)CCS MCULE-4845430658 [0,0,0,0,0,0|2,1,0]=3 418 B5R0.1 OCC=C(Cl)Cl MCULE-6473037027 [0,0,0,0,0,0|2,0,1]=3 419 B5R0.1 OCCC(F)F MCULE-9207688926 [0,0,0,0,0,0|2,0,1]=3 420 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [0,0,0,0,0,0|1,0,2]=3 421 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [0,0,0,0,0,0|2,0,2]=4 422 B5R0.1 [C@H](C)(O)CC#N MCULE-6894178072 [0,0,0,0,0,0|1,0,3]=4 423 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [0,0,0,0,0,0|1,0,2]=3 424 B4R0.1 C#CC(=C)C MCULE-6826835331 [1,0,0,0,0,0|1,0,2]=4 425 B4R0.1 C#CC(=O)C MCULE-1296030711 [1,0,0,0,0,0|0,0,2]=3 426 B4R0.1 C#CC(=O)N MCULE-1832868146 [1,0,0,0,0,0|1,0,2]=4 427 B4R0.1 C#CC(=O)O MCULE-8764256624 [1,0,0,0,0,0|1,0,2]=4 428 B4R0.1 C#CC(=O)[O-] MCULE-3356498679 [1,0,0,0,0,0|1,0,2]=4 429 B4R0.1 C#CC(=O)[O-] MCULE-3490087346 [1,0,0,0,0,0|1,0,2]=4 430 B4R0.1 C(C)(N)CN MCULE-5877041140 [1,0,0,0,0,0|2,0,1]=4 431 B4R0.1 C(C)(N)CO MCULE-5844242932 [1,0,0,0,0,0|1,0,1]=3 432 B4R0.1 C/C(=N/O)/N MCULE-5595239824 [1,0,0,0,0,0|2,0,0]=3 433 B4R0.1 C/C(=N\O)/N MCULE-8004142092 [1,0,0,0,0,0|2,0,0]=3 434 B4R0.1 C/C=C(/C)\Cl MCULE-6841426098 [1,0,0,0,0,0|1,0,1]=3 435 B4R0.1 C/C=C(\C)/Br MCULE-3045523462 [1,0,0,0,0,0|1,0,1]=3 436 B4R0.1 C/C=C(\C)/Cl MCULE-4683862502 [1,0,0,0,0,0|1,0,1]=3 437 B4R0.1 C=C(Br)CBr MCULE-1222617820 [1,0,0,0,0,0|2,0,1]=4 438 B4R0.1 C=C(Br)CC MCULE-6271946451 [1,0,0,0,0,0|1,0,1]=3 439 B4R0.1 C=C(Br)CN MCULE-1170417597 [1,0,0,0,0,0|2,0,1]=4 440 B4R0.1 C=C(Br)CN MCULE-9190049156 [1,0,0,0,0,0|2,0,1]=4 441 B4R0.1 C=C(Br)CO MCULE-7763893047 [1,0,0,0,0,0|1,0,1]=3 442 B4R0.1 C=C(C)C#N MCULE-9177849910 [1,0,0,0,0,0|2,0,1]=4 443 B4R0.1 C=C(C)C=O MCULE-3758355501 [1,0,0,0,0,0|1,0,2]=4 444 B4R0.1 C=C(C)CBr MCULE-1361893863 [1,0,0,0,0,0|2,0,0]=3 445 B4R0.1 C=C(C)CCl MCULE-5586406339 [1,0,0,0,0,0|2,0,0]=3 446 B4R0.1 C=C(C)CI MCULE-3678124406 [1,0,0,0,0,0|2,0,0]=3 447 B4R0.1 C=C(C)CN MCULE-1033495975 [1,0,0,0,0,0|2,0,0]=3 448 B4R0.1 C=C(C)CN MCULE-8730181300 [1,0,0,0,0,0|2,0,0]=3 449 B4R0.1 C=C(C)CO MCULE-8641288398 [1,0,0,0,0,0|1,0,0]=2 450 B4R0.1 C=C(C)CS MCULE-5174170431 [1,0,0,0,0,0|1,1,0]=3 451 B4R0.1 C=C(C)OC MCULE-7344104255 [1,0,0,0,0,0|2,0,0]=3 452 B4R0.1 C=C(Cl)CBr MCULE-9398157024 [1,0,0,0,0,0|2,0,1]=4 453 B4R0.1 C=C(Cl)CCl MCULE-4210429118 [1,0,0,0,0,0|2,0,1]=4 454 B4R0.1 C=C(Cl)CI MCULE-1908004565 [1,0,0,0,0,0|2,0,1]=4 455 B4R0.1 C=C(Cl)CN MCULE-2159410121 [1,0,0,0,0,0|2,0,1]=4 456 B4R0.1 C=C(Cl)CN MCULE-3454023553 [1,0,0,0,0,0|2,0,1]=4 457 B4R0.1 C=C(Cl)CO MCULE-8813337564 [1,0,0,0,0,0|1,0,1]=3 458 B4R0.1 C=C(F)CBr MCULE-6528430141 [1,0,0,0,0,0|2,0,1]=4 459 B4R0.1 C=C(F)CCl MCULE-4499400030 [1,0,0,0,0,0|2,0,1]=4 460 B4R0.1 C=C(F)CN MCULE-1603171858 [1,0,0,0,0,0|2,0,1]=4 461 B4R0.1 C=C(F)CN MCULE-3878727292 [1,0,0,0,0,0|2,0,1]=4 462 B4R0.1 C=C(F)CO MCULE-2779963696 [1,0,0,0,0,0|1,0,1]=3 463 B4R0.1 C=C(I)CO MCULE-2533897125 [1,0,0,0,0,0|1,0,1]=3 464 B4R0.1 C=C=C(C)C MCULE-8705186354 [1,0,0,0,0,0|1,0,2]=4 465 B4R0.1 C=CC(=C)C MCULE-1668999564 [1,0,0,0,0,0|1,0,2]=4 466 B4R0.1 C=CC(=O)C MCULE-4924646293 [1,0,0,0,0,0|0,0,2]=3 467 B4R0.1 C=CC(=O)Cl MCULE-3579233798 [1,0,0,0,0,0|1,0,2]=4 468 B4R0.1 C=CC(=O)N MCULE-4309430654 [1,0,0,0,0,0|1,0,2]=4 469 B4R0.1 C=CC(=O)O MCULE-9352227082 [1,0,0,0,0,0|1,0,2]=4 470 B4R0.1 C=CC(=O)[O-] MCULE-3928960314 [1,0,0,0,0,0|1,0,2]=4 471 B4R0.1 C=CC(=O)[O-] MCULE-4331301308 [1,0,0,0,0,0|1,0,2]=4 472 B4R0.1 C=CC(=O)[O-] MCULE-5516854555 [1,0,0,0,0,0|1,0,2]=4 473 B4R0.1 CC(=CBr)C MCULE-9508381610 [1,0,0,0,0,0|2,0,1]=4 474 B4R0.1 CC(=CCl)C MCULE-4321554138 [1,0,0,0,0,0|2,0,1]=4 475 B4R0.1 CC(=CCl)Cl MCULE-3528888685 [1,0,0,0,0,0|2,0,1]=4 476 B4R0.1 CC(=N)NN MCULE-2302306720 [1,0,0,0,0,0|3,0,0]=4 477 B4R0.1 CC(=N)NN MCULE-5362481009 [1,0,0,0,0,0|3,0,0]=4 478 B4R0.1 CC(=NN)C MCULE-8828852790 [1,0,0,0,0,0|3,0,0]=4 479 B4R0.1 CC(=NO)C MCULE-3243100216 [1,0,0,0,0,0|2,0,0]=3 480 B4R0.1 CC(=O)C#N MCULE-6317771757 [1,0,0,0,0,0|1,0,1]=3 481 B4R0.1 CC(=O)C=O MCULE-2718961814 [1,0,0,0,0,0|0,0,2]=3 482 B4R0.1 CC(=O)CBr MCULE-7812920675 [1,0,0,0,0,0|1,0,0]=2 483 B4R0.1 CC(=O)CCl MCULE-2501365933 [1,0,0,0,0,0|1,0,0]=2 484 B4R0.1 CC(=O)CF MCULE-7417279999 [1,0,0,0,0,0|1,0,0]=2 485 B4R0.1 CC(=O)CN MCULE-2715277783 [1,0,0,0,0,0|1,0,0]=2 486 B4R0.1 CC(=O)CN MCULE-6004541862 [1,0,0,0,0,0|1,0,0]=2 487 B4R0.1 CC(=O)CO MCULE-2989526028 [1,0,0,0,0,0|0,0,0]=1 488 B4R0.1 CC(=O)CS MCULE-9736174016 [1,0,0,0,0,0|0,1,0]=2 489 B4R0.1 CC(=O)NBr MCULE-6502070876 [1,0,0,0,0,0|2,0,0]=3 490 B4R0.1 CC(=O)NN MCULE-9183467120 [1,0,0,0,0,0|2,0,0]=3 491 B4R0.1 CC(=O)NO MCULE-2682231025 [1,0,0,0,0,0|1,0,0]=2 492 B4R0.1 CC(=O)OO MCULE-6028338742 [1,0,0,0,0,0|1,0,0]=2 493 B4R0.1 CC(Br)CBr MCULE-6304574748 [1,0,0,0,0,0|2,0,1]=4 494 B4R0.1 CC(Br)CCl MCULE-8021380791 [1,0,0,0,0,0|2,0,1]=4 495 B4R0.1 CC(Br)CN MCULE-5214613046 [1,0,0,0,0,0|2,0,1]=4 496 B4R0.1 CC(Br)CN MCULE-6326218362 [1,0,0,0,0,0|2,0,1]=4 497 B4R0.1 CC(Br)CO MCULE-8344365003 [1,0,0,0,0,0|1,0,1]=3 498 B4R0.1 CC(C)CBr MCULE-6039420480 [1,0,0,0,0,0|2,0,1]=4 499 B4R0.1 CC(C)CCl MCULE-6524976746 [1,0,0,0,0,0|2,0,1]=4 500 B4R0.1 CC(C)CI MCULE-5280589461 [1,0,0,0,0,0|2,0,1]=4 501 B4R0.1 CC(C)CN MCULE-2158650588 [1,0,0,0,0,0|2,0,1]=4 502 B4R0.1 CC(C)CN MCULE-6751437658 [1,0,0,0,0,0|2,0,1]=4 503 B4R0.1 CC(C)CN MCULE-8319193456 [1,0,0,0,0,0|2,0,1]=4 504 B4R0.1 CC(C)CN MCULE-8705657065 [1,0,0,0,0,0|2,0,1]=4 505 B4R0.1 CC(C)CO MCULE-6294327194 [1,0,0,0,0,0|1,0,1]=3 506 B4R0.1 CC(C)CP MCULE-3724358658 [1,0,0,0,0,0|2,0,1]=4 507 B4R0.1 CC(C)CS MCULE-7978911055 [1,0,0,0,0,0|1,1,1]=4 508 B4R0.1 CC(C)NO MCULE-6516566403 [1,0,0,0,0,0|2,0,1]=4 509 B4R0.1 CC(C)NO MCULE-8545146035 [1,0,0,0,0,0|2,0,1]=4 510 B4R0.1 CC(Cl)CBr MCULE-8474943880 [1,0,0,0,0,0|2,0,1]=4 511 B4R0.1 CC(Cl)CCl MCULE-1548912109 [1,0,0,0,0,0|2,0,1]=4 512 B4R0.1 CC(Cl)CN MCULE-2637316379 [1,0,0,0,0,0|2,0,1]=4 513 B4R0.1 CC(Cl)CN MCULE-5591419030 [1,0,0,0,0,0|2,0,1]=4 514 B4R0.1 CC(Cl)CO MCULE-3857255988 [1,0,0,0,0,0|1,0,1]=3 515 B4R0.1 CC(Cl)CO MCULE-7538548427 [1,0,0,0,0,0|1,0,1]=3 516 B4R0.1 CC(F)CN MCULE-6584490651 [1,0,0,0,0,0|2,0,1]=4 517 B4R0.1 CC(F)CN MCULE-9499916116 [1,0,0,0,0,0|2,0,1]=4 518 B4R0.1 CC(F)CO MCULE-6006763378 [1,0,0,0,0,0|1,0,1]=3 519 B4R0.1 CC(N)CBr MCULE-1783493149 [1,0,0,0,0,0|2,0,1]=4 520 B4R0.1 CC(N)CBr MCULE-2775398297 [1,0,0,0,0,0|2,0,1]=4 521 B4R0.1 CC(N)CCl MCULE-8652434595 [1,0,0,0,0,0|2,0,1]=4 522 B4R0.1 CC(N)CCl MCULE-9580466630 [1,0,0,0,0,0|2,0,1]=4 523 B4R0.1 CC(N)CF MCULE-1603143200 [1,0,0,0,0,0|2,0,1]=4 524 B4R0.1 CC(N)CF MCULE-3787216870 [1,0,0,0,0,0|2,0,1]=4 525 B4R0.1 CC(N)CF MCULE-4138869746 [1,0,0,0,0,0|2,0,1]=4 526 B4R0.1 CC(N)CF MCULE-8611760275 [1,0,0,0,0,0|2,0,1]=4 527 B4R0.1 CC(N)CN MCULE-2119036110 [1,0,0,0,0,0|2,0,1]=4 528 B4R0.1 CC(N)CN MCULE-6286216576 [1,0,0,0,0,0|2,0,1]=4 529 B4R0.1 CC(N)CN MCULE-9919433465 [1,0,0,0,0,0|2,0,1]=4 530 B4R0.1 CC(N)CO MCULE-1361379423 [1,0,0,0,0,0|1,0,1]=3 531 B4R0.1 CC(N)CO MCULE-2098440985 [1,0,0,0,0,0|1,0,1]=3 532 B4R0.1 CC(N)CS MCULE-1396853557 [1,0,0,0,0,0|1,1,1]=4 533 B4R0.1 CC(N)CS MCULE-4094732666 [1,0,0,0,0,0|1,1,1]=4 534 B4R0.1 CC(O)CBr MCULE-7835094737 [1,0,0,0,0,0|1,0,2]=4 535 B4R0.1 CC(O)CCl MCULE-9140807958 [1,0,0,0,0,0|1,0,2]=4 536 B4R0.1 CC(O)CF MCULE-1023052065 [1,0,0,0,0,0|1,0,2]=4 537 B4R0.1 CC(O)CN MCULE-4370440652 [1,0,0,0,0,0|1,0,2]=4 538 B4R0.1 CC(O)CN MCULE-5694317743 [1,0,0,0,0,0|1,0,2]=4 539 B4R0.1 CC(O)CN MCULE-6406041538 [1,0,0,0,0,0|1,0,2]=4 540 B4R0.1 CC(O)CN MCULE-6636652305 [1,0,0,0,0,0|1,0,2]=4 541 B4R0.1 CC(O)CO MCULE-5574440784 [1,0,0,0,0,0|0,0,2]=3 542 B4R0.1 CC(O)CO MCULE-8743139013 [1,0,0,0,0,0|0,0,2]=3 543 B4R0.1 CC(O)CS MCULE-7881083356 [1,0,0,0,0,0|0,1,2]=4 544 B4R0.1 CC(O)C[NH3+] MCULE-6871369474 [1,0,0,0,0,0|1,0,2]=4 545 B4R0.1 CC(S)CN MCULE-1957568322 [1,0,0,0,0,0|1,1,1]=4 546 B4R0.1 CC(S)CN MCULE-7469442412 [1,0,0,0,0,0|1,1,1]=4 547 B4R0.1 CC(S)CO MCULE-5090908062 [1,0,0,0,0,0|0,1,1]=3 548 B4R0.1 CC(S)CS MCULE-9264694858 [1,0,0,0,0,0|0,2,1]=4 549 B4R0.1 CC=C(C)Br MCULE-1371905211 [1,0,0,0,0,0|1,0,1]=3 550 B4R0.1 CC=C(C)C MCULE-4230157245 [1,0,0,0,0,0|1,0,1]=3 551 B4R0.1 CC=C(C)Cl MCULE-3844314543 [1,0,0,0,0,0|1,0,1]=3 552 B4R0.1 CC=C(Cl)Cl MCULE-3741261135 [1,0,0,0,0,0|2,0,1]=4 553 B4R0.1 CC=C(F)F MCULE-5544510852 [1,0,0,0,0,0|2,0,1]=4 554 B4R0.1 CCB(O)O MCULE-1650960999 [1,0,0,0,0,0|2,0,1]=4 555 B4R0.1 CCC(=N)N MCULE-1856575742 [1,0,0,0,0,0|2,0,0]=3 556 B4R0.1 CCC(=N)N MCULE-2534386807 [1,0,0,0,0,0|2,0,0]=3 557 B4R0.1 CCC(=O)Br MCULE-7870678619 [1,0,0,0,0,0|1,0,0]=2 558 B4R0.1 CCC(=O)C MCULE-8276670748 [1,0,0,0,0,0|0,0,0]=1 559 B4R0.1 CCC(=O)Cl MCULE-3081874391 [1,0,0,0,0,0|1,0,0]=2 560 B4R0.1 CCC(=O)F MCULE-8783887670 [1,0,0,0,0,0|1,0,0]=2 561 B4R0.1 CCC(=O)N MCULE-3730796130 [1,0,0,0,0,0|1,0,0]=2 562 B4R0.1 CCC(=O)O MCULE-2199051150 [1,0,0,0,0,0|1,0,0]=2 563 B4R0.1 CCC(=O)O MCULE-9800054040 [1,0,0,0,0,0|1,0,0]=2 564 B4R0.1 CCC(=O)S MCULE-3392119766 [1,0,0,0,0,0|1,0,0]=2 565 B4R0.1 CCC(=O)[O-] MCULE-6321502767 [1,0,0,0,0,0|1,0,0]=2 566 B4R0.1 CCC(=S)N MCULE-3921479699 [1,0,0,0,0,0|1,1,0]=3 567 B4R0.1 CCC(C)Br MCULE-9661620259 [1,0,0,0,0,0|1,0,1]=3 568 B4R0.1 CCC(C)C MCULE-5376105936 [1,0,0,0,0,0|1,0,1]=3 569 B4R0.1 CCC(C)Cl MCULE-2954418486 [1,0,0,0,0,0|1,0,1]=3 570 B4R0.1 CCC(C)I MCULE-5239699587 [1,0,0,0,0,0|1,0,1]=3 571 B4R0.1 CCC(C)N MCULE-5041676035 [1,0,0,0,0,0|1,0,1]=3 572 B4R0.1 CCC(C)N MCULE-5835091553 [1,0,0,0,0,0|1,0,1]=3 573 B4R0.1 CCC(C)N MCULE-6631606230 [1,0,0,0,0,0|1,0,1]=3 574 B4R0.1 CCC(C)N MCULE-8165681721 [1,0,0,0,0,0|1,0,1]=3 575 B4R0.1 CCC(C)O MCULE-4099350806 [1,0,0,0,0,0|0,0,2]=3 576 B4R0.1 CCC(C)O MCULE-5005120003 [1,0,0,0,0,0|0,0,2]=3 577 B4R0.1 CCC(C)S MCULE-4988033753 [1,0,0,0,0,0|0,1,1]=3 578 B4R0.1 CCN(=O)=O MCULE-6603591614 [1,0,0,0,0,0|2,0,0]=3 579 B4R0.1 CCN(C)C MCULE-5825033552 [1,0,0,0,0,0|2,0,0]=3 580 B4R0.1 CCN(C)N MCULE-2279492356 [1,0,0,0,0,0|2,0,0]=3 581 B4R0.1 CCN(C)N MCULE-5660338703 [1,0,0,0,0,0|2,0,0]=3 582 B4R0.1 CCN(C)N MCULE-9839987578 [1,0,0,0,0,0|2,0,0]=3 583 B4R0.1 CCS(=O)C MCULE-4400935745 [1,0,0,0,0,0|1,0,0]=2 584 B4R0.1 CCS(=O)O MCULE-9872932319 [1,0,0,0,0,0|2,0,0]=3 585 B4R0.1 CCS(=O)[O-] MCULE-4386198822 [1,0,0,0,0,0|2,0,0]=3 586 B4R0.1 CC[C@@H](C)N MCULE-2017255826 [1,0,0,0,0,0|1,0,1]=3 587 B4R0.1 CC[C@@H](C)N MCULE-3555707512 [1,0,0,0,0,0|1,0,1]=3 588 B4R0.1 CC[C@@H](C)N MCULE-6783735598 [1,0,0,0,0,0|1,0,1]=3 589 B4R0.1 CC[C@@H](C)N MCULE-7004219201 [1,0,0,0,0,0|1,0,1]=3 590 B4R0.1 CC[C@@H](C)O MCULE-2661481448 [1,0,0,0,0,0|0,0,2]=3 591 B4R0.1 CC[C@@H](C)O MCULE-6785232833 [1,0,0,0,0,0|0,0,2]=3 592 B4R0.1 CC[C@H](C)N MCULE-2450201533 [1,0,0,0,0,0|1,0,1]=3 593 B4R0.1 CC[C@H](C)N MCULE-2998961427 [1,0,0,0,0,0|1,0,1]=3 594 B4R0.1 CC[C@H](C)N MCULE-6692190471 [1,0,0,0,0,0|1,0,1]=3 595 B4R0.1 CC[C@H](C)N MCULE-6904795465 [1,0,0,0,0,0|1,0,1]=3 596 B4R0.1 CC[C@H](C)O MCULE-3700911573 [1,0,0,0,0,0|0,0,2]=3 597 B4R0.1 CC[C@H](C)O MCULE-6063716138 [1,0,0,0,0,0|0,0,2]=3 598 B4R0.1 CN(C)CCl MCULE-4906480184 [1,0,0,0,0,0|3,0,0]=4 599 B4R0.1 CN(C)CCl MCULE-5465672480 [1,0,0,0,0,0|3,0,0]=4 600 B4R0.1 CNC(=N)N MCULE-1074994749 [1,0,0,0,0,0|3,0,0]=4 601 B4R0.1 CNC(=N)N MCULE-6149731862 [1,0,0,0,0,0|3,0,0]=4 602 B4R0.1 CNC(=N)N MCULE-7667364021 [1,0,0,0,0,0|3,0,0]=4 603 B4R0.1 CNC(=N)N MCULE-7854448694 [1,0,0,0,0,0|3,0,0]=4 604 B4R0.1 CNC(=O)C MCULE-2612997941 [1,0,0,0,0,0|1,0,0]=2 605 B4R0.1 CNC(=O)Cl MCULE-7743744606 [1,0,0,0,0,0|2,0,0]=3 606 B4R0.1 CNC(=O)N MCULE-6422331704 [1,0,0,0,0,0|2,0,0]=3 607 B4R0.1 CNC(=S)C MCULE-8699171591 [1,0,0,0,0,0|1,1,0]=3 608 B4R0.1 CNC(=S)N MCULE-7103250725 [1,0,0,0,0,0|2,1,0]=4 609 B4R0.1 CNC(=S)[S-] MCULE-4072880135 [1,0,0,0,0,0|2,1,0]=4 610 B4R0.1 CNC(=S)[S-] MCULE-4924829934 [1,0,0,0,0,0|2,1,0]=4 611 B4R0.1 CNC(C)C MCULE-3849513543 [1,0,0,0,0,0|2,0,1]=4 612 B4R0.1 CNN(C)C MCULE-7120869955 [1,0,0,0,0,0|3,0,0]=4 613 B4R0.1 CNN(C)C MCULE-8318926099 [1,0,0,0,0,0|3,0,0]=4 614 B4R0.1 COC(=N)C MCULE-2752794913 [1,0,0,0,0,0|2,0,0]=3 615 B4R0.1 COC(=N)C MCULE-2904991083 [1,0,0,0,0,0|2,0,0]=3 616 B4R0.1 COC(=N)N MCULE-1611076737 [1,0,0,0,0,0|3,0,0]=4 617 B4R0.1 COC(=N)N MCULE-4923904579 [1,0,0,0,0,0|3,0,0]=4 618 B4R0.1 COC(=N)N MCULE-6696789855 [1,0,0,0,0,0|3,0,0]=4 619 B4R0.1 COC(=N)N MCULE-9171600210 [1,0,0,0,0,0|3,0,0]=4 620 B4R0.1 COC(=O)C MCULE-7368066093 [1,0,0,0,0,0|1,0,0]=2 621 B4R0.1 COC(=O)Cl MCULE-8022274771 [1,0,0,0,0,0|2,0,0]=3 622 B4R0.1 COC(=O)N MCULE-4070607369 [1,0,0,0,0,0|2,0,0]=3 623 B4R0.1 COC(=S)N MCULE-9414558443 [1,0,0,0,0,0|2,1,0]=4 624 B4R0.1 COC(=S)[S-] MCULE-4829872223 [1,0,0,0,0,0|2,1,0]=4 625 B4R0.1 COC(=S)[S-] MCULE-6509496630 [1,0,0,0,0,0|2,1,0]=4 626 B4R0.1 COC(C)Cl MCULE-9043930044 [1,0,0,0,0,0|2,0,1]=4 627 B4R0.1 CSC(=N)N MCULE-1471368384 [1,0,0,0,0,0|3,0,0]=4 628 B4R0.1 CSC(=N)N MCULE-3394284504 [1,0,0,0,0,0|3,0,0]=4 629 B4R0.1 CSC(=N)N MCULE-3752198299 [1,0,0,0,0,0|3,0,0]=4 630 B4R0.1 CSC(=N)N MCULE-5672446896 [1,0,0,0,0,0|3,0,0]=4 631 B4R0.1 CSC(=N)N MCULE-8409992127 [1,0,0,0,0,0|3,0,0]=4 632 B4R0.1 CSC(=O)C MCULE-7061634598 [1,0,0,0,0,0|1,0,0]=2 633 B4R0.1 CSC(=S)C MCULE-4836153374 [1,0,0,0,0,0|1,1,0]=3 634 B4R0.1 CSC(C)C MCULE-5932565699 [1,0,0,0,0,0|2,0,1]=4 635 B4R0.1 CSS(=O)C MCULE-6515592458 [1,0,0,0,0,0|2,0,0]=3 636 B4R0.1 CS[S+](C)C MCULE-1869043585 [1,0,0,0,0,0|3,0,0]=4 637 B4R0.1 CS[S+](C)C MCULE-4164877790 [1,0,0,0,0,0|3,0,0]=4 638 B4R0.1 C[C@@H](Cl)CO MCULE-4834664531 [1,0,0,0,0,0|1,0,1]=3 639 B4R0.1 C[C@@H](Cl)CO MCULE-8797955903 [1,0,0,0,0,0|1,0,1]=3 640 B4R0.1 C[C@@H](F)CO MCULE-3312305972 [1,0,0,0,0,0|1,0,1]=3 641 B4R0.1 C[C@@H](F)CO MCULE-4754825872 [1,0,0,0,0,0|1,0,1]=3 642 B4R0.1 C[C@@H](N)CF MCULE-2227343602 [1,0,0,0,0,0|2,0,1]=4 643 B4R0.1 C[C@@H](N)CF MCULE-2283243747 [1,0,0,0,0,0|2,0,1]=4 644 B4R0.1 C[C@@H](N)CF MCULE-6326763354 [1,0,0,0,0,0|2,0,1]=4 645 B4R0.1 C[C@@H](N)CF MCULE-6630824972 [1,0,0,0,0,0|2,0,1]=4 646 B4R0.1 C[C@@H](N)CN MCULE-5207840256 [1,0,0,0,0,0|2,0,1]=4 647 B4R0.1 C[C@@H](N)CN MCULE-5332214014 [1,0,0,0,0,0|2,0,1]=4 648 B4R0.1 C[C@@H](N)CN MCULE-7816211809 [1,0,0,0,0,0|2,0,1]=4 649 B4R0.1 C[C@@H](N)CN MCULE-7982492466 [1,0,0,0,0,0|2,0,1]=4 650 B4R0.1 C[C@@H](N)CO MCULE-5655560645 [1,0,0,0,0,0|1,0,1]=3 651 B4R0.1 C[C@@H](N)CO MCULE-8066658004 [1,0,0,0,0,0|1,0,1]=3 652 B4R0.1 C[C@@H](O)CCl MCULE-4669677883 [1,0,0,0,0,0|1,0,2]=4 653 B4R0.1 C[C@@H](O)CCl MCULE-7670590902 [1,0,0,0,0,0|1,0,2]=4 654 B4R0.1 C[C@@H](O)CN MCULE-9301041927 [1,0,0,0,0,0|1,0,2]=4 655 B4R0.1 C[C@@H](O)CO MCULE-4464598400 [1,0,0,0,0,0|0,0,2]=3 656 B4R0.1 C[C@@H](O)CO MCULE-9914833832 [1,0,0,0,0,0|0,0,2]=3 657 B4R0.1 C[C@@H](O)CS MCULE-8817452889 [1,0,0,0,0,0|0,1,2]=4 658 B4R0.1 C[C@H](Cl)CO MCULE-6747279587 [1,0,0,0,0,0|1,0,1]=3 659 B4R0.1 C[C@H](Cl)CO MCULE-8509218918 [1,0,0,0,0,0|1,0,1]=3 660 B4R0.1 C[C@H](F)CO MCULE-1024261541 [1,0,0,0,0,0|1,0,1]=3 661 B4R0.1 C[C@H](F)CO MCULE-7028098137 [1,0,0,0,0,0|1,0,1]=3 662 B4R0.1 C[C@H](N)CF MCULE-1053227516 [1,0,0,0,0,0|2,0,1]=4 663 B4R0.1 C[C@H](N)CF MCULE-4024916343 [1,0,0,0,0,0|2,0,1]=4 664 B4R0.1 C[C@H](N)CF MCULE-6312285034 [1,0,0,0,0,0|2,0,1]=4 665 B4R0.1 C[C@H](N)CF MCULE-7630744199 [1,0,0,0,0,0|2,0,1]=4 666 B4R0.1 C[C@H](N)CN MCULE-2048837128 [1,0,0,0,0,0|2,0,1]=4 667 B4R0.1 C[C@H](N)CN MCULE-4105152552 [1,0,0,0,0,0|2,0,1]=4 668 B4R0.1 C[C@H](N)CN MCULE-7106390536 [1,0,0,0,0,0|2,0,1]=4 669 B4R0.1 C[C@H](N)CN MCULE-9863306005 [1,0,0,0,0,0|2,0,1]=4 670 B4R0.1 C[C@H](N)CO MCULE-2471107013 [1,0,0,0,0,0|1,0,1]=3 671 B4R0.1 C[C@H](N)CO MCULE-5424195678 [1,0,0,0,0,0|1,0,1]=3 672 B4R0.1 C[C@H](O)CCl MCULE-3018109825 [1,0,0,0,0,0|1,0,2]=4 673 B4R0.1 C[C@H](O)CCl MCULE-5836677540 [1,0,0,0,0,0|1,0,2]=4 674 B4R0.1 C[C@H](O)CN MCULE-3227371869 [1,0,0,0,0,0|1,0,2]=4 675 B4R0.1 C[C@H](O)CN MCULE-5480489257 [1,0,0,0,0,0|1,0,2]=4 676 B4R0.1 C[C@H](O)CO MCULE-6582852191 [1,0,0,0,0,0|0,0,2]=3 677 B4R0.1 C[C@H](O)CO MCULE-8074793296 [1,0,0,0,0,0|0,0,2]=3 678 B4R0.1 C[C@H](O)CS MCULE-9061842733 [1,0,0,0,0,0|0,1,2]=4 679 B4R0.1 N=C(N)CCl MCULE-1495198330 [1,0,0,0,0,0|3,0,0]=4 680 B4R0.1 N=C(N)CCl MCULE-2087468158 [1,0,0,0,0,0|3,0,0]=4 681 B4R0.1 N=C(N)CF MCULE-4489534021 [1,0,0,0,0,0|3,0,0]=4 682 B4R0.1 N=C(N)CF MCULE-8858704396 [1,0,0,0,0,0|3,0,0]=4 683 B4R0.1 N=C(N)CN MCULE-2761790792 [1,0,0,0,0,0|3,0,0]=4 684 B4R0.1 N=C(N)CN MCULE-5131841850 [1,0,0,0,0,0|3,0,0]=4 685 B4R0.1 N=C(N)CN MCULE-6618111844 [1,0,0,0,0,0|3,0,0]=4 686 B4R0.1 N=C(N)CO MCULE-5146395919 [1,0,0,0,0,0|2,0,0]=3 687 B4R0.1 N=C(N)CO MCULE-8814507460 [1,0,0,0,0,0|2,0,0]=3 688 B4R0.1 N=C(N)NO MCULE-2554837832 [1,0,0,0,0,0|3,0,0]=4 689 B4R0.1 N=C(N)NO MCULE-5458374815 [1,0,0,0,0,0|3,0,0]=4 690 B4R0.1 N=C(N)NO MCULE-5913043834 [1,0,0,0,0,0|3,0,0]=4 691 B4R0.1 NC(=NO)N MCULE-7650923271 [1,0,0,0,0,0|3,0,0]=4 692 B4R0.1 NC(=O)CBr MCULE-9306090536 [1,0,0,0,0,0|2,0,0]=3 693 B4R0.1 NC(=O)CCl MCULE-3241549842 [1,0,0,0,0,0|2,0,0]=3 694 B4R0.1 NC(=O)CF MCULE-3344212657 [1,0,0,0,0,0|2,0,0]=3 695 B4R0.1 NC(=O)CI MCULE-4217973413 [1,0,0,0,0,0|2,0,0]=3 696 B4R0.1 NC(=O)CO MCULE-2739878376 [1,0,0,0,0,0|1,0,0]=2 697 B4R0.1 NC(=O)CS MCULE-2639305532 [1,0,0,0,0,0|1,1,0]=3 698 B4R0.1 NC(=O)NO MCULE-9465284053 [1,0,0,0,0,0|2,0,0]=3 699 B4R0.1 NC(=S)CF MCULE-7873791134 [1,0,0,0,0,0|2,1,0]=4 700 B4R0.1 NC(=S)CO MCULE-9301705313 [1,0,0,0,0,0|1,1,0]=3 701 B4R0.1 NCC(=O)N MCULE-1048848056 [1,0,0,0,0,0|2,0,0]=3 702 B4R0.1 NCC(=O)N MCULE-2174395809 [1,0,0,0,0,0|2,0,0]=3 703 B4R0.1 NCC(=O)N MCULE-6113166250 [1,0,0,0,0,0|2,0,0]=3 704 B4R0.1 NCC(=O)O MCULE-2415764032 [1,0,0,0,0,0|2,0,0]=3 705 B4R0.1 NCC(=O)O MCULE-3643110755 [1,0,0,0,0,0|2,0,0]=3 706 B4R0.1 NCC(=O)O MCULE-4349255299 [1,0,0,0,0,0|2,0,0]=3 707 B4R0.1 NCC(=O)O MCULE-9146223615 [1,0,0,0,0,0|2,0,0]=3 708 B4R0.1 NCC(=O)O MCULE-9701991737 [1,0,0,0,0,0|2,0,0]=3 709 B4R0.1 NCC(=O)S MCULE-9837799864 [1,0,0,0,0,0|2,0,0]=3 710 B4R0.1 NCC(=O)[O-] MCULE-5975202378 [1,0,0,0,0,0|2,0,0]=3 711 B4R0.1 NCS(=O)[O-] MCULE-6627922989 [1,0,0,0,0,0|3,0,0]=4 712 B4R0.1 NCS(=O)[O-] MCULE-9434739250 [1,0,0,0,0,0|3,0,0]=4 713 B4R0.1 NNC(=O)N MCULE-3392559370 [1,0,0,0,0,0|3,0,0]=4 714 B4R0.1 NNC(=O)N MCULE-8490374775 [1,0,0,0,0,0|3,0,0]=4 715 B4R0.1 O=C(Br)CBr MCULE-6031858200 [1,0,0,0,0,0|2,0,0]=3 716 B4R0.1 O=C(Cl)CBr MCULE-7684029984 [1,0,0,0,0,0|2,0,0]=3 717 B4R0.1 O=C(Cl)CCl MCULE-7076914635 [1,0,0,0,0,0|2,0,0]=3 718 B4R0.1 O=C(Cl)CF MCULE-7182087882 [1,0,0,0,0,0|2,0,0]=3 719 B4R0.1 O=C(Cl)CI MCULE-5719121455 [1,0,0,0,0,0|2,0,0]=3 720 B4R0.1 O=C(Cl)SCl MCULE-5008011265 [1,0,0,0,0,0|3,0,0]=4 721 B4R0.1 O=C(O)CBr MCULE-1503716137 [1,0,0,0,0,0|2,0,0]=3 722 B4R0.1 O=C(O)CCl MCULE-9228754880 [1,0,0,0,0,0|2,0,0]=3 723 B4R0.1 O=C(O)CF MCULE-6584094437 [1,0,0,0,0,0|2,0,0]=3 724 B4R0.1 O=C(O)CI MCULE-3146792857 [1,0,0,0,0,0|2,0,0]=3 725 B4R0.1 O=C(O)CO MCULE-9792551388 [1,0,0,0,0,0|1,0,0]=2 726 B4R0.1 O=C(O)CS MCULE-8097997001 [1,0,0,0,0,0|1,1,0]=3 727 B4R0.1 O=C([O-])CF MCULE-8428965857 [1,0,0,0,0,0|2,0,0]=3 728 B4R0.1 O=C([O-])CO MCULE-2780567509 [1,0,0,0,0,0|1,0,0]=2 729 B4R0.1 O=C([O-])CS MCULE-3314809220 [1,0,0,0,0,0|1,1,0]=3 730 B4R0.1 O=C([O-])CS MCULE-5989133747 [1,0,0,0,0,0|1,1,0]=3 731 B4R0.1 O=CC(=O)O MCULE-5307898766 [1,0,0,0,0,0|1,0,2]=4 732 B4R0.1 O=N(=O)CBr MCULE-5030744397 [1,0,0,0,0,0|3,0,0]=4 733 B4R0.1 O=N(=O)CF MCULE-9920695539 [1,0,0,0,0,0|3,0,0]=4 734 B4R0.1 O=S(O)CO MCULE-4195832185 [1,0,0,0,0,0|2,0,0]=3 735 B4R0.1 O=S([O-])CF MCULE-5711587598 [1,0,0,0,0,0|3,0,0]=4 736 B4R0.1 O=S([O-])CF MCULE-9276464291 [1,0,0,0,0,0|3,0,0]=4 737 B4R0.1 O=S([O-])CO MCULE-5211722344 [1,0,0,0,0,0|2,0,0]=3 738 B4R0.1 OCC(Cl)Cl MCULE-3279441180 [1,0,0,0,0,0|2,0,1]=4 739 B4R0.1 OCC(F)Br MCULE-5466660542 [1,0,0,0,0,0|2,0,1]=4 740 B4R0.1 OCC(F)F MCULE-3252378943 [1,0,0,0,0,0|2,0,1]=4 741 B4R0.1 ON=C(Br)Br MCULE-4053513648 [1,0,0,0,0,0|3,0,0]=4 742 B4R0.1 P(=O)(O)CN MCULE-5441171864 [1,0,0,0,0,0|3,0,0]=4 743 B4R0.1 [C@H](C)(O)CN MCULE-8212000072 [1,0,0,0,0,0|1,0,2]=4 744 B4R0.1 [NH3+]C(C)CC MCULE-3066898055 [1,0,0,0,0,0|1,0,1]=3 745 B4R0.2 BrC=CCBr MCULE-1480697982 [1,0,0,0,0,0|2,0,1]=4 746 B4R0.2 BrCCCBr MCULE-6500110480 [1,0,0,0,0,0|2,0,1]=4 747 B4R0.2 BrCCCI MCULE-6470610840 [1,0,0,0,0,0|2,0,1]=4 748 B4R0.2 C#CC=CC MCULE-9741359131 [1,0,0,0,0,0|1,0,2]=4 749 B4R0.2 C#CCCBr MCULE-1495603480 [1,0,0,0,0,0|1,0,2]=4 750 B4R0.2 C#CCCC MCULE-1233806896 [1,0,0,0,0,0|1,0,2]=4 751 B4R0.2 C#CCCCl MCULE-5602517887 [1,0,0,0,0,0|1,0,2]=4 752 B4R0.2 C#CCCI MCULE-2832310719 [1,0,0,0,0,0|1,0,2]=4 753 B4R0.2 C#CCCN MCULE-1223656854 [1,0,0,0,0,0|1,0,2]=4 754 B4R0.2 C#CCCN MCULE-6408469965 [1,0,0,0,0,0|1,0,2]=4 755 B4R0.2 C#CCCO MCULE-1797559276 [1,0,0,0,0,0|0,0,2]=3 756 B4R0.2 C#CCCO MCULE-8743964065 [1,0,0,0,0,0|0,0,2]=3 757 B4R0.2 C#CCNC MCULE-9758975590 [1,0,0,0,0,0|2,0,1]=4 758 B4R0.2 C#CCNO MCULE-7210831528 [1,0,0,0,0,0|1,0,2]=4 759 B4R0.2 C#CCNO MCULE-8082854360 [1,0,0,0,0,0|1,0,2]=4 760 B4R0.2 C#CCOC MCULE-9172422462 [1,0,0,0,0,0|2,0,1]=4 761 B4R0.2 C#CCSC MCULE-6808040899 [1,0,0,0,0,0|2,0,1]=4 762 B4R0.2 C/C=C/C#N MCULE-2754343103 [1,0,0,0,0,0|1,0,2]=4 763 B4R0.2 C/C=C/C=O MCULE-9924705308 [1,0,0,0,0,0|0,0,3]=4 764 B4R0.2 C/C=C/CCl MCULE-9977493525 [1,0,0,0,0,0|1,0,1]=3 765 B4R0.2 C/C=C/CO MCULE-2383161163 [1,0,0,0,0,0|0,0,1]=2 766 B4R0.2 C/C=C/OC MCULE-3906920304 [1,0,0,0,0,0|2,0,1]=4 767 B4R0.2 C/C=C\CO MCULE-5924662327 [1,0,0,0,0,0|0,0,1]=2 768 B4R0.2 C=C=CCO MCULE-5424851896 [1,0,0,0,0,0|0,0,3]=4 769 B4R0.2 C=CC=CC MCULE-4452516287 [1,0,0,0,0,0|1,0,2]=4 770 B4R0.2 C=CCC#N MCULE-2566589348 [1,0,0,0,0,0|1,0,2]=4 771 B4R0.2 C=CCCBr MCULE-2890129103 [1,0,0,0,0,0|1,0,1]=3 772 B4R0.2 C=CCCC MCULE-8386546337 [1,0,0,0,0,0|1,0,1]=3 773 B4R0.2 C=CCCCl MCULE-5903789900 [1,0,0,0,0,0|1,0,1]=3 774 B4R0.2 C=CCCI MCULE-1055671394 [1,0,0,0,0,0|1,0,1]=3 775 B4R0.2 C=CCCN MCULE-2471716627 [1,0,0,0,0,0|1,0,1]=3 776 B4R0.2 C=CCCN MCULE-2881108697 [1,0,0,0,0,0|1,0,1]=3 777 B4R0.2 C=CCCO MCULE-4582400839 [1,0,0,0,0,0|0,0,1]=2 778 B4R0.2 C=CCNC MCULE-3335720336 [1,0,0,0,0,0|2,0,1]=4 779 B4R0.2 C=CCNN MCULE-2550690274 [1,0,0,0,0,0|2,0,1]=4 780 B4R0.2 C=CCNN MCULE-3554567414 [1,0,0,0,0,0|2,0,1]=4 781 B4R0.2 C=CCNN MCULE-8741523989 [1,0,0,0,0,0|2,0,1]=4 782 B4R0.2 C=CCOC MCULE-3321225771 [1,0,0,0,0,0|2,0,1]=4 783 B4R0.2 C=CCON MCULE-2094787759 [1,0,0,0,0,0|2,0,1]=4 784 B4R0.2 C=CCON MCULE-6222602533 [1,0,0,0,0,0|2,0,1]=4 785 B4R0.2 C=CCSC MCULE-4452023915 [1,0,0,0,0,0|2,0,1]=4 786 B4R0.2 C=CNC=O MCULE-8403928899 [1,0,0,0,0,0|2,0,1]=4 787 B4R0.2 C=COCC MCULE-2569047033 [1,0,0,0,0,0|2,0,1]=4 788 B4R0.2 C=CSCC MCULE-8927374165 [1,0,0,0,0,0|2,0,1]=4 789 B4R0.2 CC#CC=O MCULE-9270622693 [1,0,0,0,0,0|1,0,2]=4 790 B4R0.2 CC#CCBr MCULE-3596191560 [1,0,0,0,0,0|1,0,2]=4 791 B4R0.2 CC#CCC MCULE-8848779220 [1,0,0,0,0,0|1,0,2]=4 792 B4R0.2 CC#CCI MCULE-3596701582 [1,0,0,0,0,0|1,0,2]=4 793 B4R0.2 CC#CCN MCULE-7027146471 [1,0,0,0,0,0|1,0,2]=4 794 B4R0.2 CC#CCN MCULE-9570644542 [1,0,0,0,0,0|1,0,2]=4 795 B4R0.2 CC#CCO MCULE-5096552076 [1,0,0,0,0,0|0,0,2]=3 796 B4R0.2 CC=CC#N MCULE-5062019142 [1,0,0,0,0,0|1,0,2]=4 797 B4R0.2 CC=CC=O MCULE-2497362981 [1,0,0,0,0,0|0,0,3]=4 798 B4R0.2 CC=CCBr MCULE-7855581866 [1,0,0,0,0,0|1,0,1]=3 799 B4R0.2 CC=CCC MCULE-5931905453 [1,0,0,0,0,0|1,0,1]=3 800 B4R0.2 CC=CCCl MCULE-3941962217 [1,0,0,0,0,0|1,0,1]=3 801 B4R0.2 CC=CCO MCULE-7490725844 [1,0,0,0,0,0|0,0,1]=2 802 B4R0.2 CC=COC MCULE-6712403535 [1,0,0,0,0,0|2,0,1]=4 803 B4R0.2 CC=CSC MCULE-5921906156 [1,0,0,0,0,0|2,0,1]=4 804 B4R0.2 CCC=CBr MCULE-4471551501 [1,0,0,0,0,0|2,0,1]=4 805 B4R0.2 CCC=NO MCULE-9457280654 [1,0,0,0,0,0|1,0,2]=4 806 B4R0.2 CCCC#N MCULE-8571076087 [1,0,0,0,0,0|1,0,2]=4 807 B4R0.2 CCCC=O MCULE-8530391347 [1,0,0,0,0,0|1,0,0]=2 808 B4R0.2 CCCCBr MCULE-3390217131 [1,0,0,0,0,0|1,0,1]=3 809 B4R0.2 CCCCC MCULE-4643148765 [1,0,0,0,0,0|1,0,1]=3 810 B4R0.2 CCCCCl MCULE-5329900290 [1,0,0,0,0,0|1,0,1]=3 811 B4R0.2 CCCCF MCULE-7225760858 [1,0,0,0,0,0|1,0,1]=3 812 B4R0.2 CCCCI MCULE-1160974720 [1,0,0,0,0,0|1,0,1]=3 813 B4R0.2 CCCCN MCULE-1731874934 [1,0,0,0,0,0|1,0,1]=3 814 B4R0.2 CCCCN MCULE-4233278050 [1,0,0,0,0,0|1,0,1]=3 815 B4R0.2 CCCCN MCULE-5242069370 [1,0,0,0,0,0|1,0,1]=3 816 B4R0.2 CCCCN MCULE-7343835253 [1,0,0,0,0,0|1,0,1]=3 817 B4R0.2 CCCCO MCULE-1571156443 [1,0,0,0,0,0|0,0,1]=2 818 B4R0.2 CCCCS MCULE-9441213933 [1,0,0,0,0,0|0,1,1]=3 819 B4R0.2 CCCNC MCULE-2266616259 [1,0,0,0,0,0|2,0,0]=3 820 B4R0.2 CCCNC MCULE-7722796872 [1,0,0,0,0,0|2,0,0]=3 821 B4R0.2 CCCNN MCULE-4121438775 [1,0,0,0,0,0|2,0,1]=4 822 B4R0.2 CCCNN MCULE-5875592228 [1,0,0,0,0,0|2,0,1]=4 823 B4R0.2 CCCNN MCULE-9585694661 [1,0,0,0,0,0|2,0,1]=4 824 B4R0.2 CCCOC MCULE-5854067718 [1,0,0,0,0,0|2,0,0]=3 825 B4R0.2 CCCON MCULE-4800172637 [1,0,0,0,0,0|2,0,1]=4 826 B4R0.2 CCCON MCULE-7988781002 [1,0,0,0,0,0|2,0,1]=4 827 B4R0.2 CCCSC MCULE-8387041737 [1,0,0,0,0,0|2,0,0]=3 828 B4R0.2 CCN=C=O MCULE-6522145601 [1,0,0,0,0,0|2,0,1]=4 829 B4R0.2 CCNC=O MCULE-9309926274 [1,0,0,0,0,0|2,0,0]=3 830 B4R0.2 CCNCC MCULE-3395060353 [1,0,0,0,0,0|2,0,1]=4 831 B4R0.2 CCNCC MCULE-4374609736 [1,0,0,0,0,0|2,0,1]=4 832 B4R0.2 CCNCC MCULE-4555901025 [1,0,0,0,0,0|2,0,1]=4 833 B4R0.2 CCNCC MCULE-6895602113 [1,0,0,0,0,0|2,0,1]=4 834 B4R0.2 CCNOC MCULE-4797714235 [1,0,0,0,0,0|3,0,0]=4 835 B4R0.2 CCNOC MCULE-6486167423 [1,0,0,0,0,0|3,0,0]=4 836 B4R0.2 CCOC=N MCULE-5321655909 [1,0,0,0,0,0|3,0,0]=4 837 B4R0.2 CCOC=N MCULE-8158357614 [1,0,0,0,0,0|3,0,0]=4 838 B4R0.2 CCOC=O MCULE-6245072161 [1,0,0,0,0,0|2,0,0]=3 839 B4R0.2 CCOCBr MCULE-6644755987 [1,0,0,0,0,0|2,0,1]=4 840 B4R0.2 CCOCC MCULE-5665709021 [1,0,0,0,0,0|2,0,1]=4 841 B4R0.2 CCOCCl MCULE-5087992840 [1,0,0,0,0,0|2,0,1]=4 842 B4R0.2 CCONC MCULE-5446312516 [1,0,0,0,0,0|3,0,0]=4 843 B4R0.2 CCONC MCULE-7976027802 [1,0,0,0,0,0|3,0,0]=4 844 B4R0.2 CCSCC MCULE-6480710239 [1,0,0,0,0,0|2,0,1]=4 845 B4R0.2 CCSCCl MCULE-3890542152 [1,0,0,0,0,0|2,0,1]=4 846 B4R0.2 CCSSC MCULE-9430585714 [1,0,0,0,0,0|3,0,0]=4 847 B4R0.2 CC[NH2+]CC MCULE-9899430356 [1,0,0,0,0,0|2,0,1]=4 848 B4R0.2 CNCC#N MCULE-1233170363 [1,0,0,0,0,0|2,0,1]=4 849 B4R0.2 CNCC#N MCULE-4334159739 [1,0,0,0,0,0|2,0,1]=4 850 B4R0.2 CNCC#N MCULE-8267124503 [1,0,0,0,0,0|2,0,1]=4 851 B4R0.2 CNCCBr MCULE-3708780806 [1,0,0,0,0,0|2,0,0]=3 852 B4R0.2 CNCCBr MCULE-6840755559 [1,0,0,0,0,0|2,0,0]=3 853 B4R0.2 CNCCCl MCULE-1666345560 [1,0,0,0,0,0|2,0,0]=3 854 B4R0.2 CNCCCl MCULE-8215813413 [1,0,0,0,0,0|2,0,0]=3 855 B4R0.2 CNCCF MCULE-3719880423 [1,0,0,0,0,0|2,0,0]=3 856 B4R0.2 CNCCF MCULE-3751701745 [1,0,0,0,0,0|2,0,0]=3 857 B4R0.2 CNCCI MCULE-7026781832 [1,0,0,0,0,0|2,0,0]=3 858 B4R0.2 CNCCI MCULE-8892686580 [1,0,0,0,0,0|2,0,0]=3 859 B4R0.2 CNCCN MCULE-2881688448 [1,0,0,0,0,0|2,0,0]=3 860 B4R0.2 CNCCN MCULE-7199403269 [1,0,0,0,0,0|2,0,0]=3 861 B4R0.2 CNCCO MCULE-7051900771 [1,0,0,0,0,0|1,0,0]=2 862 B4R0.2 CNCCO MCULE-7934732981 [1,0,0,0,0,0|1,0,0]=2 863 B4R0.2 CNCCS MCULE-6430516369 [1,0,0,0,0,0|1,1,0]=3 864 B4R0.2 COCC#N MCULE-9178522865 [1,0,0,0,0,0|2,0,1]=4 865 B4R0.2 COCC=O MCULE-9427361019 [1,0,0,0,0,0|2,0,0]=3 866 B4R0.2 COCCBr MCULE-8316331262 [1,0,0,0,0,0|2,0,0]=3 867 B4R0.2 COCCCl MCULE-8886627413 [1,0,0,0,0,0|2,0,0]=3 868 B4R0.2 COCCI MCULE-9391124374 [1,0,0,0,0,0|2,0,0]=3 869 B4R0.2 COCCN MCULE-5051556646 [1,0,0,0,0,0|2,0,0]=3 870 B4R0.2 COCCN MCULE-7519068386 [1,0,0,0,0,0|2,0,0]=3 871 B4R0.2 COCCO MCULE-4751927883 [1,0,0,0,0,0|1,0,0]=2 872 B4R0.2 COCCS MCULE-7803276094 [1,0,0,0,0,0|1,1,0]=3 873 B4R0.2 COCOC MCULE-8559076702 [1,0,0,0,0,0|3,0,0]=4 874 B4R0.2 COCON MCULE-6032854331 [1,0,0,0,0,0|3,0,0]=4 875 B4R0.2 CSCC#N MCULE-3607261611 [1,0,0,0,0,0|2,0,1]=4 876 B4R0.2 CSCCBr MCULE-1684461541 [1,0,0,0,0,0|2,0,0]=3 877 B4R0.2 CSCCCl MCULE-8593103756 [1,0,0,0,0,0|2,0,0]=3 878 B4R0.2 CSCCN MCULE-5168245255 [1,0,0,0,0,0|2,0,0]=3 879 B4R0.2 CSCCN MCULE-6275285732 [1,0,0,0,0,0|2,0,0]=3 880 B4R0.2 CSCCO MCULE-9706874325 [1,0,0,0,0,0|1,0,0]=2 881 B4R0.2 CSCSC MCULE-5603964020 [1,0,0,0,0,0|3,0,0]=4 882 B4R0.2 Cl/C=C/CCl MCULE-4516188972 [1,0,0,0,0,0|2,0,1]=4 883 B4R0.2 ClC/C=C/Br MCULE-1061414929 [1,0,0,0,0,0|2,0,1]=4 884 B4R0.2 ClC=CCCl MCULE-4655672652 [1,0,0,0,0,0|2,0,1]=4 885 B4R0.2 ClCCCBr MCULE-7937580875 [1,0,0,0,0,0|2,0,1]=4 886 B4R0.2 ClCCCCl MCULE-6693270397 [1,0,0,0,0,0|2,0,1]=4 887 B4R0.2 ClCCCI MCULE-1521526833 [1,0,0,0,0,0|2,0,1]=4 888 B4R0.2 FCCCBr MCULE-5674735753 [1,0,0,0,0,0|2,0,1]=4 889 B4R0.2 FCCCF MCULE-1803511350 [1,0,0,0,0,0|2,0,1]=4 890 B4R0.2 FCCCI MCULE-9287814857 [1,0,0,0,0,0|2,0,1]=4 891 B4R0.2 ICCCI MCULE-9849754168 [1,0,0,0,0,0|2,0,1]=4 892 B4R0.2 N#CCCBr MCULE-1744180602 [1,0,0,0,0,0|2,0,1]=4 893 B4R0.2 N#CCCCl MCULE-3511379481 [1,0,0,0,0,0|2,0,1]=4 894 B4R0.2 N#CCCI MCULE-1591942951 [1,0,0,0,0,0|2,0,1]=4 895 B4R0.2 N#CCCN MCULE-8482296338 [1,0,0,0,0,0|2,0,1]=4 896 B4R0.2 N#CCCN MCULE-9518086954 [1,0,0,0,0,0|2,0,1]=4 897 B4R0.2 N#CCCO MCULE-5098987368 [1,0,0,0,0,0|1,0,1]=3 898 B4R0.2 N#CCCS MCULE-7199964466 [1,0,0,0,0,0|1,1,1]=4 899 B4R0.2 N#CCNO MCULE-6808474875 [1,0,0,0,0,0|2,0,1]=4 900 B4R0.2 N/C=C/C=O MCULE-2444951625 [1,0,0,0,0,0|1,0,2]=4 901 B4R0.2 NC=CC=O MCULE-4070918342 [1,0,0,0,0,0|1,0,2]=4 902 B4R0.2 NCCCBr MCULE-5485748003 [1,0,0,0,0,0|2,0,1]=4 903 B4R0.2 NCCCBr MCULE-7072709972 [1,0,0,0,0,0|2,0,1]=4 904 B4R0.2 NCCCCl MCULE-1324157004 [1,0,0,0,0,0|2,0,1]=4 905 B4R0.2 NCCCCl MCULE-3667248190 [1,0,0,0,0,0|2,0,1]=4 906 B4R0.2 NCCCF MCULE-5215746973 [1,0,0,0,0,0|2,0,1]=4 907 B4R0.2 NCCCF MCULE-8077133369 [1,0,0,0,0,0|2,0,1]=4 908 B4R0.2 NCCCI MCULE-3534892097 [1,0,0,0,0,0|2,0,1]=4 909 B4R0.2 NCCCI MCULE-8010453546 [1,0,0,0,0,0|2,0,1]=4 910 B4R0.2 NCCCN MCULE-4293255820 [1,0,0,0,0,0|2,0,1]=4 911 B4R0.2 NCCCN MCULE-5041378433 [1,0,0,0,0,0|2,0,1]=4 912 B4R0.2 NCCCN MCULE-6944452060 [1,0,0,0,0,0|2,0,1]=4 913 B4R0.2 NCCCN MCULE-7375662153 [1,0,0,0,0,0|2,0,1]=4 914 B4R0.2 NCCCN MCULE-8277465929 [1,0,0,0,0,0|2,0,1]=4 915 B4R0.2 NCCCN MCULE-9929373126 [1,0,0,0,0,0|2,0,1]=4 916 B4R0.2 NCCCO MCULE-2851278356 [1,0,0,0,0,0|1,0,1]=3 917 B4R0.2 NCCCO MCULE-9698089092 [1,0,0,0,0,0|1,0,1]=3 918 B4R0.2 NCCCS MCULE-3994478020 [1,0,0,0,0,0|1,1,1]=4 919 B4R0.2 NCCCS MCULE-7730973866 [1,0,0,0,0,0|1,1,1]=4 920 B4R0.2 NCCON MCULE-3613980902 [1,0,0,0,0,0|3,0,0]=4 921 B4R0.2 NCCON MCULE-7030217952 [1,0,0,0,0,0|3,0,0]=4 922 B4R0.2 NCCON MCULE-8959912781 [1,0,0,0,0,0|3,0,0]=4 923 B4R0.2 NNCCF MCULE-2712460031 [1,0,0,0,0,0|3,0,0]=4 924 B4R0.2 NNCCF MCULE-8505927457 [1,0,0,0,0,0|3,0,0]=4 925 B4R0.2 NNCCO MCULE-1290652744 [1,0,0,0,0,0|2,0,0]=3 926 B4R0.2 NOCCBr MCULE-2796346082 [1,0,0,0,0,0|3,0,0]=4 927 B4R0.2 NOCCBr MCULE-5636354898 [1,0,0,0,0,0|3,0,0]=4 928 B4R0.2 NOCCCl MCULE-5981688956 [1,0,0,0,0,0|3,0,0]=4 929 B4R0.2 NOCCF MCULE-1813481600 [1,0,0,0,0,0|3,0,0]=4 930 B4R0.2 NOCCF MCULE-2993254805 [1,0,0,0,0,0|3,0,0]=4 931 B4R0.2 NOCCO MCULE-2545004367 [1,0,0,0,0,0|2,0,0]=3 932 B4R0.2 O=C=NCCl MCULE-7751104052 [1,0,0,0,0,0|2,0,1]=4 933 B4R0.2 O=CCCBr MCULE-4107157458 [1,0,0,0,0,0|1,0,0]=2 934 B4R0.2 O=CCCCl MCULE-5863929313 [1,0,0,0,0,0|1,0,0]=2 935 B4R0.2 O=CCCI MCULE-9771140462 [1,0,0,0,0,0|1,0,0]=2 936 B4R0.2 O=CCCO MCULE-1685289763 [1,0,0,0,0,0|0,0,0]=1 937 B4R0.2 O=CNC=O MCULE-3098379420 [1,0,0,0,0,0|1,0,2]=4 938 B4R0.2 O=COC=O MCULE-6311384332 [1,0,0,0,0,0|1,0,2]=4 939 B4R0.2 O=C[N-]C=O MCULE-4923470284 [1,0,0,0,0,0|1,0,2]=4 940 B4R0.2 OC=CCCl MCULE-4750991393 [1,0,0,0,0,0|1,0,2]=4 941 B4R0.2 OCC#CBr MCULE-2495653455 [1,0,0,0,0,0|1,0,2]=4 942 B4R0.2 OCC#CI MCULE-1101149708 [1,0,0,0,0,0|1,0,2]=4 943 B4R0.2 OCC=CBr MCULE-4636104289 [1,0,0,0,0,0|1,0,1]=3 944 B4R0.2 OCC=CCl MCULE-2110127594 [1,0,0,0,0,0|1,0,1]=3 945 B4R0.2 OCCCBr MCULE-3450011527 [1,0,0,0,0,0|1,0,1]=3 946 B4R0.2 OCCCCl MCULE-2319230957 [1,0,0,0,0,0|1,0,1]=3 947 B4R0.2 OCCCF MCULE-2347934403 [1,0,0,0,0,0|1,0,1]=3 948 B4R0.2 OCCCI MCULE-5200713967 [1,0,0,0,0,0|1,0,1]=3 949 B4R0.2 OCCCO MCULE-5166824786 [1,0,0,0,0,0|0,0,2]=3 950 B4R0.2 OCCCS MCULE-7930164048 [1,0,0,0,0,0|0,1,1]=3 951 B4R0.2 PCCCP MCULE-6048146071 [1,0,0,0,0,0|2,0,1]=4 952 B4R0.2 SCCCBr MCULE-4627341228 [1,0,0,0,0,0|1,1,1]=4 953 B4R0.2 SCCCCl MCULE-6410389127 [1,0,0,0,0,0|1,1,1]=4 954 B4R0.2 SCCCS MCULE-8220630729 [1,0,0,0,0,0|0,2,1]=4 955 B4R0.2 [NH2+](CC)CC MCULE-1192179232 [1,0,0,0,0,0|2,0,1]=4 956 B6R0.1 C#C/C(=C\CO)/C MCULE-5643545939 [0,1,0,0,0,0|1,0,1]=3 957 B6R0.1 C#CC(=CCO)C MCULE-7063837718 [0,1,0,0,0,0|1,0,1]=3 958 B6R0.1 C#CC(=O)CCC MCULE-8990254228 [0,1,0,0,0,0|1,0,1]=3 959 B6R0.1 C#CC(=O)NCC MCULE-3703208943 [0,1,0,0,0,0|2,0,1]=4 960 B6R0.1 C#CC(=O)OCC MCULE-3783424133 [0,1,0,0,0,0|2,0,1]=4 961 B6R0.1 C#CCC(=O)OC MCULE-8097491486 [0,1,0,0,0,0|1,0,1]=3 962 B6R0.1 C(=C/C(=O)CC)\C MCULE-9250312874 [0,1,0,0,0,0|1,0,2]=4 963 B6R0.1 C/C(=N\O)/C=N/O MCULE-3049929204 [0,1,0,0,0,0|1,0,2]=4 964 B6R0.1 C/C=C/C(=O)OC MCULE-8935178488 [0,1,0,0,0,0|1,0,2]=4 965 B6R0.1 C=C(CC)CCO MCULE-5317656776 [0,1,0,0,0,0|1,0,0]=2 966 B6R0.1 C=C=CC(=O)OC MCULE-7885631451 [0,1,0,0,0,0|1,0,2]=4 967 B6R0.1 C=CC(=O)CCC MCULE-9373104880 [0,1,0,0,0,0|1,0,1]=3 968 B6R0.1 C=CC(=O)COC MCULE-1933195578 [0,1,0,0,0,0|2,0,1]=4 969 B6R0.1 C=CC(=O)NCC MCULE-3515057147 [0,1,0,0,0,0|2,0,1]=4 970 B6R0.1 C=CC(=O)NCO MCULE-3627112877 [0,1,0,0,0,0|1,0,1]=3 971 B6R0.1 C=CC(=O)OCC MCULE-9281713240 [0,1,0,0,0,0|2,0,1]=4 972 B6R0.1 C=CC(C)CCC MCULE-2692803387 [0,1,0,0,0,0|2,0,1]=4 973 B6R0.1 C=CC(C)CCO MCULE-2890369298 [0,1,0,0,0,0|1,0,1]=3 974 B6R0.1 C=CC(N)CCO MCULE-7781906138 [0,1,0,0,0,0|1,0,2]=4 975 B6R0.1 C=CCC(=O)CN MCULE-3960819679 [0,1,0,0,0,0|1,0,1]=3 976 B6R0.1 C=CCC(=O)CN MCULE-8089375331 [0,1,0,0,0,0|1,0,1]=3 977 B6R0.1 C=CCC(=O)NC MCULE-4823208577 [0,1,0,0,0,0|1,0,1]=3 978 B6R0.1 C=CCC(=O)OC MCULE-5546680906 [0,1,0,0,0,0|1,0,1]=3 979 B6R0.1 C=CCC(C)C=O MCULE-3981206051 [0,1,0,0,0,0|1,0,2]=4 980 B6R0.1 C=CC[C@H](C)C=O MCULE-6968117309 [0,1,0,0,0,0|1,0,2]=4 981 B6R0.1 C=COC(=O)CC MCULE-7662621547 [0,1,0,0,0,0|2,0,1]=4 982 B6R0.1 C=COC(=O)CCl MCULE-7675766105 [0,1,0,0,0,0|2,0,1]=4 983 B6R0.1 CC#CC(=O)OC MCULE-6108678475 [0,1,0,0,0,0|1,0,2]=4 984 B6R0.1 CC(=CCBr)CBr MCULE-6875050264 [0,1,0,0,0,0|2,0,1]=4 985 B6R0.1 CC(=CCBr)CCl MCULE-3390489656 [0,1,0,0,0,0|2,0,1]=4 986 B6R0.1 CC(=CCN)C#N MCULE-1319014311 [0,1,0,0,0,0|2,0,1]=4 987 B6R0.1 CC(=CCN)C#N MCULE-4924794215 [0,1,0,0,0,0|2,0,1]=4 988 B6R0.1 CC(=NO)C=NO MCULE-9711224051 [0,1,0,0,0,0|1,0,2]=4 989 B6R0.1 CC(CN)CCN MCULE-2719332037 [0,1,0,0,0,0|2,0,1]=4 990 B6R0.1 CC(CN)CCN MCULE-4200375624 [0,1,0,0,0,0|2,0,1]=4 991 B6R0.1 CC(CN)CCO MCULE-5515163518 [0,1,0,0,0,0|1,0,1]=3 992 B6R0.1 CC(CO)CCN MCULE-9900244005 [0,1,0,0,0,0|1,0,2]=4 993 B6R0.1 CC(CO)CCO MCULE-5240961149 [0,1,0,0,0,0|0,0,2]=3 994 B6R0.1 CC(CO)CCO MCULE-8678967805 [0,1,0,0,0,0|0,0,2]=3 995 B6R0.1 CC/C=C(\C)/C=O MCULE-6692882718 [0,1,0,0,0,0|1,0,1]=3 996 B6R0.1 CC=CC(=O)CC MCULE-5948495959 [0,1,0,0,0,0|1,0,2]=4 997 B6R0.1 CC=CC(=O)OC MCULE-1093700917 [0,1,0,0,0,0|1,0,2]=4 998 B6R0.1 CCC(=CCO)C MCULE-5264054153 [0,1,0,0,0,0|1,0,1]=3 999 B6R0.1 CCC(=O)CC#N MCULE-6150629588 [0,1,0,0,0,0|1,0,1]=3 1000 B6R0.1 CCC(=O)CNC MCULE-3030105640 [0,1,0,0,0,0|2,0,0]=3 1001 B6R0.1 CCC(=O)CNC MCULE-6945295017 [0,1,0,0,0,0|2,0,0]=3 1002 B6R0.1 CCC(=O)COC MCULE-1087802011 [0,1,0,0,0,0|2,0,0]=3 1003 B6R0.1 CCC(=O)CSC MCULE-3230433182 [0,1,0,0,0,0|2,0,0]=3 1004 B6R0.1 CCC(=O)NOC MCULE-4440074406 [0,1,0,0,0,0|3,0,0]=4 1005 B6R0.1 CCC(=O)OCCl MCULE-6975707373 [0,1,0,0,0,0|2,0,0]=3 1006 B6R0.1 CCC(C)CCBr MCULE-6033010731 [0,1,0,0,0,0|2,0,1]=4 1007 B6R0.1 CCC(C)CCCl MCULE-2069721626 [0,1,0,0,0,0|2,0,1]=4 1008 B6R0.1 CCC(C)CCN MCULE-4140800594 [0,1,0,0,0,0|2,0,1]=4 1009 B6R0.1 CCC(C)CCN MCULE-5509248218 [0,1,0,0,0,0|2,0,1]=4 1010 B6R0.1 CCC(C)CCO MCULE-6482427735 [0,1,0,0,0,0|1,0,1]=3 1011 B6R0.1 CCC(N)CCN MCULE-8956610037 [0,1,0,0,0,0|2,0,1]=4 1012 B6R0.1 CCC(N)CCO MCULE-1511155206 [0,1,0,0,0,0|1,0,1]=3 1013 B6R0.1 CCC(N)CCO MCULE-5525302643 [0,1,0,0,0,0|1,0,1]=3 1014 B6R0.1 CCC(O)CCN MCULE-5387303971 [0,1,0,0,0,0|1,0,2]=4 1015 B6R0.1 CCC(O)CCO MCULE-5156075792 [0,1,0,0,0,0|0,0,2]=3 1016 B6R0.1 CCC(S)CCO MCULE-4193788852 [0,1,0,0,0,0|0,1,1]=3 1017 B6R0.1 CCC/C(=N/O)/N MCULE-1101103373 [0,1,0,0,0,0|2,0,1]=4 1018 B6R0.1 CCC/C(=N/O)/N MCULE-2970638438 [0,1,0,0,0,0|2,0,1]=4 1019 B6R0.1 CCC=C(C)C=O MCULE-1636090264 [0,1,0,0,0,0|1,0,1]=3 1020 B6R0.1 CCCC(=NO)C MCULE-6437787263 [0,1,0,0,0,0|1,0,1]=3 1021 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [0,1,0,0,0,0|1,0,0]=2 1022 B6R0.1 CCCC(=O)CC MCULE-7121523805 [0,1,0,0,0,0|1,0,0]=2 1023 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [0,1,0,0,0,0|1,0,0]=2 1024 B6R0.1 CCCC(=O)CN MCULE-4663263123 [0,1,0,0,0,0|1,0,0]=2 1025 B6R0.1 CCCC(=O)CN MCULE-6326368932 [0,1,0,0,0,0|1,0,0]=2 1026 B6R0.1 CCCC(=O)CO MCULE-6518249412 [0,1,0,0,0,0|1,0,0]=2 1027 B6R0.1 CCCC(=O)NC MCULE-5770149071 [0,1,0,0,0,0|1,0,0]=2 1028 B6R0.1 CCCC(=O)NN MCULE-3660167295 [0,1,0,0,0,0|2,0,0]=3 1029 B6R0.1 CCCC(=O)NO MCULE-8710375368 [0,1,0,0,0,0|2,0,0]=3 1030 B6R0.1 CCCC(=O)OC MCULE-1092030267 [0,1,0,0,0,0|1,0,0]=2 1031 B6R0.1 CCCC(=O)SC MCULE-1490654381 [0,1,0,0,0,0|1,0,0]=2 1032 B6R0.1 CCCC(=S)OC MCULE-8125476093 [0,1,0,0,0,0|1,1,0]=3 1033 B6R0.1 CCCC(Br)CC MCULE-9116433502 [0,1,0,0,0,0|2,0,1]=4 1034 B6R0.1 CCCC(C)C#N MCULE-2492294131 [0,1,0,0,0,0|2,0,1]=4 1035 B6R0.1 CCCC(C)C=O MCULE-9756444218 [0,1,0,0,0,0|1,0,1]=3 1036 B6R0.1 CCCC(C)CBr MCULE-3437352091 [0,1,0,0,0,0|2,0,1]=4 1037 B6R0.1 CCCC(C)CC MCULE-7082933967 [0,1,0,0,0,0|2,0,1]=4 1038 B6R0.1 CCCC(C)CCl MCULE-2381010454 [0,1,0,0,0,0|2,0,1]=4 1039 B6R0.1 CCCC(C)CN MCULE-9552289739 [0,1,0,0,0,0|2,0,1]=4 1040 B6R0.1 CCCC(C)CO MCULE-9777250826 [0,1,0,0,0,0|1,0,2]=4 1041 B6R0.1 CCCC(C)NC MCULE-1560121168 [0,1,0,0,0,0|2,0,1]=4 1042 B6R0.1 CCCC(C)NC MCULE-2169396338 [0,1,0,0,0,0|2,0,1]=4 1043 B6R0.1 CCCC(Cl)CC MCULE-1581617529 [0,1,0,0,0,0|2,0,1]=4 1044 B6R0.1 CCCC(Cl)CCl MCULE-9464139069 [0,1,0,0,0,0|2,0,1]=4 1045 B6R0.1 CCCC(N)CC MCULE-5349906741 [0,1,0,0,0,0|2,0,1]=4 1046 B6R0.1 CCCC(N)CC MCULE-7172418373 [0,1,0,0,0,0|2,0,1]=4 1047 B6R0.1 CCCC(N)CN MCULE-8606218569 [0,1,0,0,0,0|2,0,1]=4 1048 B6R0.1 CCCC(N)CO MCULE-3404967504 [0,1,0,0,0,0|2,0,1]=4 1049 B6R0.1 CCCC(N)CO MCULE-3802448518 [0,1,0,0,0,0|2,0,1]=4 1050 B6R0.1 CCCC(N)CO MCULE-4259078445 [0,1,0,0,0,0|2,0,1]=4 1051 B6R0.1 CCCC(N)CO MCULE-6425025734 [0,1,0,0,0,0|2,0,1]=4 1052 B6R0.1 CCCC(O)CBr MCULE-5186252424 [0,1,0,0,0,0|1,0,2]=4 1053 B6R0.1 CCCC(O)CC MCULE-9504041935 [0,1,0,0,0,0|1,0,2]=4 1054 B6R0.1 CCCC(O)CCl MCULE-4737360217 [0,1,0,0,0,0|1,0,2]=4 1055 B6R0.1 CCCC(O)CN MCULE-9402934997 [0,1,0,0,0,0|1,0,2]=4 1056 B6R0.1 CCCC(O)CO MCULE-5124107719 [0,1,0,0,0,0|1,0,2]=4 1057 B6R0.1 CCCC(S)CC MCULE-1322481338 [0,1,0,0,0,0|1,1,1]=4 1058 B6R0.1 CCC[C@@H](N)CF MCULE-4702552251 [0,1,0,0,0,0|2,0,1]=4 1059 B6R0.1 CCC[C@@H](N)CF MCULE-8118043624 [0,1,0,0,0,0|2,0,1]=4 1060 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [0,1,0,0,0,0|2,0,1]=4 1061 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [0,1,0,0,0,0|2,0,1]=4 1062 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [0,1,0,0,0,0|2,0,1]=4 1063 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [0,1,0,0,0,0|1,0,2]=4 1064 B6R0.1 CCC[C@H](N)CF MCULE-7192744944 [0,1,0,0,0,0|2,0,1]=4 1065 B6R0.1 CCC[C@H](N)CF MCULE-7441387613 [0,1,0,0,0,0|2,0,1]=4 1066 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [0,1,0,0,0,0|2,0,1]=4 1067 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [0,1,0,0,0,0|2,0,1]=4 1068 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [0,1,0,0,0,0|2,0,1]=4 1069 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [0,1,0,0,0,0|2,0,1]=4 1070 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [0,1,0,0,0,0|1,0,2]=4 1071 B6R0.1 CCN(C)CCCl MCULE-4264927085 [0,1,0,0,0,0|3,0,0]=4 1072 B6R0.1 CCN(C)CCCl MCULE-8125659652 [0,1,0,0,0,0|3,0,0]=4 1073 B6R0.1 CCN(C)CCN MCULE-9503910262 [0,1,0,0,0,0|3,0,0]=4 1074 B6R0.1 CCN(C)CCO MCULE-5519271145 [0,1,0,0,0,0|2,0,0]=3 1075 B6R0.1 CCN(C)CCS MCULE-9974758531 [0,1,0,0,0,0|2,1,0]=4 1076 B6R0.1 CCN(N)CCO MCULE-7988723724 [0,1,0,0,0,0|2,0,0]=3 1077 B6R0.1 CCNC(=O)CBr MCULE-5393521747 [0,1,0,0,0,0|2,0,0]=3 1078 B6R0.1 CCNC(=O)CC MCULE-8820594723 [0,1,0,0,0,0|2,0,0]=3 1079 B6R0.1 CCNC(=O)CCl MCULE-7288703153 [0,1,0,0,0,0|2,0,0]=3 1080 B6R0.1 CCNC(=O)CN MCULE-1913543460 [0,1,0,0,0,0|2,0,0]=3 1081 B6R0.1 CCNC(=O)CN MCULE-5473845751 [0,1,0,0,0,0|2,0,0]=3 1082 B6R0.1 CCNC(=O)CO MCULE-1386307800 [0,1,0,0,0,0|2,0,0]=3 1083 B6R0.1 CCNC(=O)NC MCULE-7197803115 [0,1,0,0,0,0|2,0,0]=3 1084 B6R0.1 CCNC(=O)NN MCULE-9055200574 [0,1,0,0,0,0|3,0,0]=4 1085 B6R0.1 CCNC(=O)NO MCULE-3264850022 [0,1,0,0,0,0|3,0,0]=4 1086 B6R0.1 CCNC(=O)OC MCULE-7110705188 [0,1,0,0,0,0|2,0,0]=3 1087 B6R0.1 CCO/C(=N/O)/C MCULE-2336241507 [0,1,0,0,0,0|2,0,1]=4 1088 B6R0.1 CCO/C(=N\O)/C MCULE-7101376522 [0,1,0,0,0,0|2,0,1]=4 1089 B6R0.1 CCOC(=N)CC MCULE-4645506860 [0,1,0,0,0,0|3,0,0]=4 1090 B6R0.1 CCOC(=N)CC MCULE-9526837631 [0,1,0,0,0,0|3,0,0]=4 1091 B6R0.1 CCOC(=N)CCl MCULE-6291047852 [0,1,0,0,0,0|3,0,0]=4 1092 B6R0.1 CCOC(=N)CCl MCULE-9207251975 [0,1,0,0,0,0|3,0,0]=4 1093 B6R0.1 CCOC(=NO)C MCULE-6964305821 [0,1,0,0,0,0|2,0,1]=4 1094 B6R0.1 CCOC(=O)C#N MCULE-4506452376 [0,1,0,0,0,0|2,0,1]=4 1095 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [0,1,0,0,0,0|2,0,1]=4 1096 B6R0.1 CCOC(=O)CBr MCULE-1369687761 [0,1,0,0,0,0|2,0,0]=3 1097 B6R0.1 CCOC(=O)CC MCULE-1639864693 [0,1,0,0,0,0|2,0,0]=3 1098 B6R0.1 CCOC(=O)CCl MCULE-2200524105 [0,1,0,0,0,0|2,0,0]=3 1099 B6R0.1 CCOC(=O)CF MCULE-1926097423 [0,1,0,0,0,0|2,0,0]=3 1100 B6R0.1 CCOC(=O)CI MCULE-9898762324 [0,1,0,0,0,0|2,0,0]=3 1101 B6R0.1 CCOC(=O)CN MCULE-2185173056 [0,1,0,0,0,0|2,0,0]=3 1102 B6R0.1 CCOC(=O)CN MCULE-2628607025 [0,1,0,0,0,0|2,0,0]=3 1103 B6R0.1 CCOC(=O)CO MCULE-8121340151 [0,1,0,0,0,0|2,0,0]=3 1104 B6R0.1 CCOC(=O)CS MCULE-3354026239 [0,1,0,0,0,0|2,0,0]=3 1105 B6R0.1 CCOC(=O)NC MCULE-5506841198 [0,1,0,0,0,0|2,0,0]=3 1106 B6R0.1 CCOC(=O)NN MCULE-9872948119 [0,1,0,0,0,0|3,0,0]=4 1107 B6R0.1 CCOC(=O)NO MCULE-4701193610 [0,1,0,0,0,0|3,0,0]=4 1108 B6R0.1 CCOC(=O)OC MCULE-1185162684 [0,1,0,0,0,0|2,0,0]=3 1109 B6R0.1 CCOC(=S)SC MCULE-6959447720 [0,1,0,0,0,0|2,1,0]=4 1110 B6R0.1 CCOS(=O)CC MCULE-4858180441 [0,1,0,0,0,0|3,0,0]=4 1111 B6R0.1 CCS(=O)CCCl MCULE-1910591721 [0,1,0,0,0,0|2,0,0]=3 1112 B6R0.1 CCS(=O)CCN MCULE-7201812983 [0,1,0,0,0,0|2,0,0]=3 1113 B6R0.1 CCS(=O)CCN MCULE-7831905163 [0,1,0,0,0,0|2,0,0]=3 1114 B6R0.1 CCS(=O)CCO MCULE-8290368918 [0,1,0,0,0,0|1,0,0]=2 1115 B6R0.1 CCSC(=O)CC MCULE-6361738004 [0,1,0,0,0,0|2,0,0]=3 1116 B6R0.1 CC[C@H](C)CCO MCULE-1190203828 [0,1,0,0,0,0|1,0,1]=3 1117 B6R0.1 CC[C@H](C)CCO MCULE-8460710173 [0,1,0,0,0,0|1,0,1]=3 1118 B6R0.1 CN(C=O)CCO MCULE-3588371476 [0,1,0,0,0,0|1,0,0]=2 1119 B6R0.1 CN(CCO)N=O MCULE-3975606321 [0,1,0,0,0,0|1,0,0]=2 1120 B6R0.1 CNC(=O)CC#N MCULE-2970000161 [0,1,0,0,0,0|1,0,1]=3 1121 B6R0.1 CNC(=O)CCBr MCULE-9239224841 [0,1,0,0,0,0|1,0,0]=2 1122 B6R0.1 CNC(=O)CCCl MCULE-7130866366 [0,1,0,0,0,0|1,0,0]=2 1123 B6R0.1 CNC(=O)CCN MCULE-1374127264 [0,1,0,0,0,0|1,0,0]=2 1124 B6R0.1 CNC(=O)CCN MCULE-3948893656 [0,1,0,0,0,0|1,0,0]=2 1125 B6R0.1 CNC(=O)CCO MCULE-3222339741 [0,1,0,0,0,0|0,0,0]=1 1126 B6R0.1 CNC(=O)CCS MCULE-2385806944 [0,1,0,0,0,0|0,1,0]=2 1127 B6R0.1 CNC(=O)CON MCULE-6451598359 [0,1,0,0,0,0|2,0,0]=3 1128 B6R0.1 CNC(=O)CON MCULE-8743298594 [0,1,0,0,0,0|2,0,0]=3 1129 B6R0.1 CNC(=S)NCO MCULE-2829573844 [0,1,0,0,0,0|1,1,0]=3 1130 B6R0.1 CNC(C)CCO MCULE-4722422254 [0,1,0,0,0,0|1,0,1]=3 1131 B6R0.1 CNCC(=O)NC MCULE-4579550577 [0,1,0,0,0,0|2,0,0]=3 1132 B6R0.1 CNCC(=O)NC MCULE-7833395637 [0,1,0,0,0,0|2,0,0]=3 1133 B6R0.1 CNCC(=O)NN MCULE-8639164023 [0,1,0,0,0,0|3,0,0]=4 1134 B6R0.1 CNCC(=O)OC MCULE-1667683926 [0,1,0,0,0,0|2,0,0]=3 1135 B6R0.1 CNCC(=O)OC MCULE-5530863658 [0,1,0,0,0,0|2,0,0]=3 1136 B6R0.1 CNN(C)CCN MCULE-3863653213 [0,1,0,0,0,0|3,0,0]=4 1137 B6R0.1 CNNC(=O)OC MCULE-4763095719 [0,1,0,0,0,0|3,0,0]=4 1138 B6R0.1 COC(=N)CC#N MCULE-1828487034 [0,1,0,0,0,0|2,0,1]=4 1139 B6R0.1 COC(=N)CC#N MCULE-5000327296 [0,1,0,0,0,0|2,0,1]=4 1140 B6R0.1 COC(=N)CCCl MCULE-1997539408 [0,1,0,0,0,0|2,0,0]=3 1141 B6R0.1 COC(=N)CCCl MCULE-2235564076 [0,1,0,0,0,0|2,0,0]=3 1142 B6R0.1 COC(=N)CCO MCULE-1904978557 [0,1,0,0,0,0|1,0,0]=2 1143 B6R0.1 COC(=N)CCO MCULE-8146089973 [0,1,0,0,0,0|1,0,0]=2 1144 B6R0.1 COC(=O)/C=C/Br MCULE-8282646495 [0,1,0,0,0,0|1,0,2]=4 1145 B6R0.1 COC(=O)/C=C/I MCULE-2652779390 [0,1,0,0,0,0|1,0,2]=4 1146 B6R0.1 COC(=O)/C=C\Br MCULE-8147758029 [0,1,0,0,0,0|1,0,2]=4 1147 B6R0.1 COC(=O)/C=C\I MCULE-9091408550 [0,1,0,0,0,0|1,0,2]=4 1148 B6R0.1 COC(=O)C#CBr MCULE-2452280844 [0,1,0,0,0,0|1,0,2]=4 1149 B6R0.1 COC(=O)C#CI MCULE-2688506741 [0,1,0,0,0,0|1,0,2]=4 1150 B6R0.1 COC(=O)C=CBr MCULE-6878439912 [0,1,0,0,0,0|1,0,2]=4 1151 B6R0.1 COC(=O)C=CCl MCULE-6895925134 [0,1,0,0,0,0|1,0,2]=4 1152 B6R0.1 COC(=O)C=CI MCULE-1616048599 [0,1,0,0,0,0|1,0,2]=4 1153 B6R0.1 COC(=O)C=CN MCULE-4685220707 [0,1,0,0,0,0|1,0,2]=4 1154 B6R0.1 COC(=O)CC#N MCULE-2699345092 [0,1,0,0,0,0|1,0,1]=3 1155 B6R0.1 COC(=O)CC=O MCULE-6624474559 [0,1,0,0,0,0|0,0,2]=3 1156 B6R0.1 COC(=O)CCBr MCULE-3565567444 [0,1,0,0,0,0|1,0,0]=2 1157 B6R0.1 COC(=O)CCCl MCULE-5034007224 [0,1,0,0,0,0|1,0,0]=2 1158 B6R0.1 COC(=O)CCI MCULE-5984806612 [0,1,0,0,0,0|1,0,0]=2 1159 B6R0.1 COC(=O)CCN MCULE-2306060188 [0,1,0,0,0,0|1,0,0]=2 1160 B6R0.1 COC(=O)CCN MCULE-8245275833 [0,1,0,0,0,0|1,0,0]=2 1161 B6R0.1 COC(=O)CCO MCULE-8538834260 [0,1,0,0,0,0|0,0,0]=1 1162 B6R0.1 COC(=O)CCS MCULE-1695345183 [0,1,0,0,0,0|0,1,0]=2 1163 B6R0.1 COC(=O)CNN MCULE-3287579794 [0,1,0,0,0,0|2,0,0]=3 1164 B6R0.1 COC(=O)CNN MCULE-3838874166 [0,1,0,0,0,0|2,0,0]=3 1165 B6R0.1 COC(=O)CON MCULE-4799038238 [0,1,0,0,0,0|2,0,0]=3 1166 B6R0.1 COC(=O)CSC MCULE-6735536033 [0,1,0,0,0,0|2,0,0]=3 1167 B6R0.1 COC(=O)N=C=S MCULE-2981767233 [0,1,0,0,0,0|1,1,1]=4 1168 B6R0.1 COC(=O)NC=O MCULE-9852632340 [0,1,0,0,0,0|1,0,2]=4 1169 B6R0.1 COC(=O)OCCl MCULE-7856529986 [0,1,0,0,0,0|2,0,0]=3 1170 B6R0.1 COC(=O)OCF MCULE-4705008675 [0,1,0,0,0,0|2,0,0]=3 1171 B6R0.1 COC(=O)OCI MCULE-8692720175 [0,1,0,0,0,0|2,0,0]=3 1172 B6R0.1 COC(C)CCN MCULE-8081876282 [0,1,0,0,0,0|1,0,2]=4 1173 B6R0.1 COC(C)CCN MCULE-8892057529 [0,1,0,0,0,0|1,0,2]=4 1174 B6R0.1 COC(C)CCO MCULE-7396381165 [0,1,0,0,0,0|0,0,2]=3 1175 B6R0.1 COCC(=N)OC MCULE-2350779439 [0,1,0,0,0,0|3,0,0]=4 1176 B6R0.1 COCC(=N)OC MCULE-7810421458 [0,1,0,0,0,0|3,0,0]=4 1177 B6R0.1 COCC(=O)CCl MCULE-7542636020 [0,1,0,0,0,0|2,0,0]=3 1178 B6R0.1 COCC(=O)NN MCULE-4127487886 [0,1,0,0,0,0|3,0,0]=4 1179 B6R0.1 COCC(=O)OC MCULE-8337685268 [0,1,0,0,0,0|2,0,0]=3 1180 B6R0.1 COCC(C)C=O MCULE-7679332713 [0,1,0,0,0,0|2,0,1]=4 1181 B6R0.1 CON(C)CCN MCULE-9318319159 [0,1,0,0,0,0|2,0,1]=4 1182 B6R0.1 CONC(=O)OC MCULE-9304532248 [0,1,0,0,0,0|3,0,0]=4 1183 B6R0.1 CSC(C)CCN MCULE-5474458753 [0,1,0,0,0,0|1,1,1]=4 1184 B6R0.1 CSC(C)CCO MCULE-4317600086 [0,1,0,0,0,0|0,1,1]=3 1185 B6R0.1 CSCC(=O)NN MCULE-8151954663 [0,1,0,0,0,0|3,0,0]=4 1186 B6R0.1 C[C@@H](CO)CCN MCULE-4422620011 [0,1,0,0,0,0|1,0,2]=4 1187 B6R0.1 C[C@@H](CO)CCN MCULE-7560169391 [0,1,0,0,0,0|1,0,2]=4 1188 B6R0.1 C[C@@H](CO)CCO MCULE-6545491289 [0,1,0,0,0,0|0,0,2]=3 1189 B6R0.1 C[C@H](CO)CCO MCULE-2543010074 [0,1,0,0,0,0|0,0,2]=3 1190 B6R0.1 C[C@H](CO)CCO MCULE-6036462418 [0,1,0,0,0,0|0,0,2]=3 1191 B6R0.1 ClCC(Cl)CCBr MCULE-2469656567 [0,1,0,0,0,0|2,0,1]=4 1192 B6R0.1 FC(CBr)CCBr MCULE-2311323533 [0,1,0,0,0,0|2,0,1]=4 1193 B6R0.1 N#CCC(=O)NN MCULE-9203133961 [0,1,0,0,0,0|2,0,1]=4 1194 B6R0.1 N/C(=N\O)/CCO MCULE-1794050637 [0,1,0,0,0,0|1,0,1]=3 1195 B6R0.1 N=C(CCCl)NO MCULE-1713601074 [0,1,0,0,0,0|2,0,1]=4 1196 B6R0.1 NC(CO)CCF MCULE-3691993352 [0,1,0,0,0,0|2,0,1]=4 1197 B6R0.1 NC(CO)CCO MCULE-3703088648 [0,1,0,0,0,0|1,0,1]=3 1198 B6R0.1 NC(CO)CCO MCULE-7609576462 [0,1,0,0,0,0|1,0,1]=3 1199 B6R0.1 NCC(N)CCO MCULE-2965554481 [0,1,0,0,0,0|1,0,1]=3 1200 B6R0.1 NCC/C(=N/O)/N MCULE-6349866821 [0,1,0,0,0,0|2,0,1]=4 1201 B6R0.1 NCCC(=O)CN MCULE-3906468943 [0,1,0,0,0,0|1,0,0]=2 1202 B6R0.1 NCCC(=O)CN MCULE-9593243702 [0,1,0,0,0,0|1,0,0]=2 1203 B6R0.1 NCCC(F)CN MCULE-9478589176 [0,1,0,0,0,0|2,0,1]=4 1204 B6R0.1 NCCC(O)CN MCULE-9177974477 [0,1,0,0,0,0|1,0,2]=4 1205 B6R0.1 NCCC(O)CO MCULE-2556586168 [0,1,0,0,0,0|1,0,2]=4 1206 B6R0.1 NNC(=O)CCO MCULE-6184351353 [0,1,0,0,0,0|1,0,0]=2 1207 B6R0.1 NNC(=O)CCS MCULE-9322963076 [0,1,0,0,0,0|1,1,0]=3 1208 B6R0.1 N[C@@H](CO)CCO MCULE-4583236919 [0,1,0,0,0,0|1,0,1]=3 1209 B6R0.1 N[C@@H](CO)CCO MCULE-5489716742 [0,1,0,0,0,0|1,0,1]=3 1210 B6R0.1 N[C@H](CO)CCO MCULE-5338659573 [0,1,0,0,0,0|1,0,1]=3 1211 B6R0.1 N[C@H](CO)CCO MCULE-8998003003 [0,1,0,0,0,0|1,0,1]=3 1212 B6R0.1 N[C@H](CS)CCS MCULE-5846021725 [0,1,0,0,0,0|1,1,1]=4 1213 B6R0.1 N[C@H](CS)CCS MCULE-6871313350 [0,1,0,0,0,0|1,1,1]=4 1214 B6R0.1 N[C@H](CS)CCS MCULE-8095554848 [0,1,0,0,0,0|1,1,1]=4 1215 B6R0.1 N[C@H](CS)CCS MCULE-8177349504 [0,1,0,0,0,0|1,1,1]=4 1216 B6R0.1 O=C(C=CCl)CCl MCULE-6121304267 [0,1,0,0,0,0|1,0,2]=4 1217 B6R0.1 O=C(CCCl)NO MCULE-5569658108 [0,1,0,0,0,0|2,0,0]=3 1218 B6R0.1 O=C(CCl)CCCl MCULE-6460902474 [0,1,0,0,0,0|1,0,0]=2 1219 B6R0.1 O=C(CCl)NCO MCULE-9960585064 [0,1,0,0,0,0|1,0,0]=2 1220 B6R0.1 O=C=NC(=O)CCl MCULE-8927897165 [0,1,0,0,0,0|1,0,2]=4 1221 B6R0.1 OC(CBr)CCBr MCULE-5156583342 [0,1,0,0,0,0|1,0,2]=4 1222 B6R0.1 OC(CCl)CCCl MCULE-5495327725 [0,1,0,0,0,0|1,0,2]=4 1223 B6R0.1 OCCC(O)CCl MCULE-4752952606 [0,1,0,0,0,0|0,0,2]=3 1224 B6R0.1 OCCC(O)CO MCULE-6470178852 [0,1,0,0,0,0|0,0,2]=3 1225 B6R0.1 OCC[C@@H](Br)CO MCULE-4859199629 [0,1,0,0,0,0|1,0,1]=3 1226 B6R0.1 OCC[C@@H](O)CO MCULE-2312093276 [0,1,0,0,0,0|0,0,2]=3 1227 B6R0.1 OCC[C@@H](O)CO MCULE-4636748782 [0,1,0,0,0,0|0,0,2]=3 1228 B6R0.1 OCC[C@H](O)CBr MCULE-1990035925 [0,1,0,0,0,0|0,0,2]=3 1229 B6R0.1 OCC[C@H](O)CCl MCULE-4561806159 [0,1,0,0,0,0|0,0,2]=3 1230 B6R0.1 OCC[C@H](O)CCl MCULE-8582759529 [0,1,0,0,0,0|0,0,2]=3 1231 B6R0.1 OCC[C@H](O)CO MCULE-2265914374 [0,1,0,0,0,0|0,0,2]=3 1232 B6R0.1 OCC[C@H](O)CO MCULE-5459838421 [0,1,0,0,0,0|0,0,2]=3 1233 B6R0.1 O[C@@H](CBr)CCBr MCULE-2137750043 [0,1,0,0,0,0|1,0,2]=4 1234 B6R0.1 O[C@H](CBr)CCBr MCULE-2647046297 [0,1,0,0,0,0|1,0,2]=4 1235 B6R0.1 O[C@H](CBr)CCBr MCULE-5662911918 [0,1,0,0,0,0|1,0,2]=4 1236 B6R0.1 [NH3+]CCC(F)C[NH3+] MCULE-8320233584 [0,1,0,0,0,0|2,0,1]=4 1237 B6R0.2 C=C(C)CC(=O)C MCULE-3534735279 [0,1,0,0,0,0|1,0,1]=3 1238 B6R0.2 C=C(C)CC(=O)O MCULE-5404023928 [0,1,0,0,0,0|1,0,1]=3 1239 B6R0.2 C=C(C)CC(C)C MCULE-5553118538 [0,1,0,0,0,0|2,0,0]=3 1240 B6R0.2 C=C(C)C[C@@H](C)O MCULE-8518319636 [0,1,0,0,0,0|1,0,0]=2 1241 B6R0.2 C=C(C)C[C@H](C)O MCULE-7139115019 [0,1,0,0,0,0|1,0,0]=2 1242 B6R0.2 C=C(C)OC(=O)C MCULE-9345377025 [0,1,0,0,0,0|2,0,1]=4 1243 B6R0.2 C=C(I)CC(=O)O MCULE-3849925169 [0,1,0,0,0,0|1,0,2]=4 1244 B6R0.2 CC(=CB(O)O)C MCULE-5305023524 [0,1,0,0,0,0|2,0,1]=4 1245 B6R0.2 CC(=CC(=O)O)C MCULE-4772426340 [0,1,0,0,0,0|1,0,2]=4 1246 B6R0.2 CC(=CC(=O)O)Cl MCULE-7503760292 [0,1,0,0,0,0|1,0,2]=4 1247 B6R0.2 CC(=CC(=O)O)I MCULE-2652373771 [0,1,0,0,0,0|1,0,2]=4 1248 B6R0.2 CC(=CC(=O)O)N MCULE-5894724848 [0,1,0,0,0,0|1,0,2]=4 1249 B6R0.2 CC(=CC(C)C)C MCULE-5460531772 [0,1,0,0,0,0|2,0,1]=4 1250 B6R0.2 CC(=CC(C)O)C MCULE-5270694894 [0,1,0,0,0,0|1,0,1]=3 1251 B6R0.2 CC(=N)CC(=O)C MCULE-4678643052 [0,1,0,0,0,0|1,0,1]=3 1252 B6R0.2 CC(=NC(C)C)C MCULE-4174313497 [0,1,0,0,0,0|3,0,0]=4 1253 B6R0.2 CC(=O)/C=C(/C)\N MCULE-1235186190 [0,1,0,0,0,0|1,0,2]=4 1254 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-3445340105 [0,1,0,0,0,0|0,0,3]=4 1255 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-7833799417 [0,1,0,0,0,0|0,0,3]=4 1256 B6R0.2 CC(=O)/C=C(\C)/N MCULE-6412393370 [0,1,0,0,0,0|1,0,2]=4 1257 B6R0.2 CC(=O)C=C(C)C MCULE-4922478422 [0,1,0,0,0,0|1,0,2]=4 1258 B6R0.2 CC(=O)C=C(C)N MCULE-2247743178 [0,1,0,0,0,0|1,0,2]=4 1259 B6R0.2 CC(=O)C=C(C)O MCULE-7345258397 [0,1,0,0,0,0|0,0,2]=3 1260 B6R0.2 CC(=O)C=C(C)[O-] MCULE-7733093724 [0,1,0,0,0,0|0,0,3]=4 1261 B6R0.2 CC(=O)CC(=O)C MCULE-6481204381 [0,1,0,0,0,0|0,0,2]=3 1262 B6R0.2 CC(=O)CC(=O)N MCULE-1618058771 [0,1,0,0,0,0|0,0,2]=3 1263 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [0,1,0,0,0,0|0,0,1]=2 1264 B6R0.2 CC(=O)CC(=O)[O-] MCULE-6317885864 [0,1,0,0,0,0|0,0,2]=3 1265 B6R0.2 CC(=O)CC(=O)[O-] MCULE-8448177875 [0,1,0,0,0,0|0,0,2]=3 1266 B6R0.2 CC(=O)CC(C)C MCULE-2172909634 [0,1,0,0,0,0|1,0,0]=2 1267 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [0,1,0,0,0,0|1,0,0]=2 1268 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [0,1,0,0,0,0|1,0,0]=2 1269 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [0,1,0,0,0,0|0,0,0]=1 1270 B6R0.2 CC(=O)CN(=O)=O MCULE-3153232896 [0,1,0,0,0,0|1,0,1]=3 1271 B6R0.2 CC(=O)CN(C)C MCULE-8561521241 [0,1,0,0,0,0|2,0,0]=3 1272 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [0,1,0,0,0,0|1,0,0]=2 1273 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [0,1,0,0,0,0|1,0,0]=2 1274 B6R0.2 CC(=O)NC(=N)N MCULE-9300028018 [0,1,0,0,0,0|2,0,1]=4 1275 B6R0.2 CC(=O)NC(=O)C MCULE-3040534108 [0,1,0,0,0,0|1,0,2]=4 1276 B6R0.2 CC(=O)NC(=O)N MCULE-8999775359 [0,1,0,0,0,0|1,0,2]=4 1277 B6R0.2 CC(=O)NC(=S)N MCULE-8448117000 [0,1,0,0,0,0|1,1,1]=4 1278 B6R0.2 CC(=O)NC(C)C MCULE-2095134698 [0,1,0,0,0,0|2,0,0]=3 1279 B6R0.2 CC(=O)NN(C)C MCULE-3444969121 [0,1,0,0,0,0|3,0,0]=4 1280 B6R0.2 CC(=O)NN(C)C MCULE-5383938091 [0,1,0,0,0,0|3,0,0]=4 1281 B6R0.2 CC(=O)OC(=O)C MCULE-9184217748 [0,1,0,0,0,0|1,0,2]=4 1282 B6R0.2 CC(=O)OC(C)Br MCULE-6494616843 [0,1,0,0,0,0|2,0,0]=3 1283 B6R0.2 CC(=O)OC(C)C MCULE-6152257819 [0,1,0,0,0,0|2,0,0]=3 1284 B6R0.2 CC(=O)OC(C)Cl MCULE-3738479003 [0,1,0,0,0,0|2,0,0]=3 1285 B6R0.2 CC(=O)SC(=O)C MCULE-5749449964 [0,1,0,0,0,0|1,0,2]=4 1286 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-4855074933 [0,1,0,0,0,0|0,0,3]=4 1287 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-6905854247 [0,1,0,0,0,0|0,0,3]=4 1288 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [0,1,0,0,0,0|2,0,0]=3 1289 B6R0.2 CC(Br)CC(=S)N MCULE-3013222937 [0,1,0,0,0,0|2,1,0]=4 1290 B6R0.2 CC(Br)CC(C)Br MCULE-1139583334 [0,1,0,0,0,0|2,0,1]=4 1291 B6R0.2 CC(C)CB(O)O MCULE-9748327681 [0,1,0,0,0,0|2,0,1]=4 1292 B6R0.2 CC(C)CC(=N)N MCULE-1578322850 [0,1,0,0,0,0|3,0,0]=4 1293 B6R0.2 CC(C)CC(=N)N MCULE-1643115412 [0,1,0,0,0,0|3,0,0]=4 1294 B6R0.2 CC(C)CC(=N)N MCULE-9650824038 [0,1,0,0,0,0|3,0,0]=4 1295 B6R0.2 CC(C)CC(=O)Cl MCULE-8821231794 [0,1,0,0,0,0|2,0,0]=3 1296 B6R0.2 CC(C)CC(=O)N MCULE-7790849976 [0,1,0,0,0,0|2,0,0]=3 1297 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [0,1,0,0,0,0|2,0,0]=3 1298 B6R0.2 CC(C)CC(=S)N MCULE-7704222819 [0,1,0,0,0,0|2,1,0]=4 1299 B6R0.2 CC(C)CC(C)Br MCULE-1549882864 [0,1,0,0,0,0|2,0,1]=4 1300 B6R0.2 CC(C)CC(C)C MCULE-1646863110 [0,1,0,0,0,0|2,0,1]=4 1301 B6R0.2 CC(C)CC(C)I MCULE-6965017338 [0,1,0,0,0,0|2,0,1]=4 1302 B6R0.2 CC(C)CC(C)N MCULE-1144229692 [0,1,0,0,0,0|2,0,1]=4 1303 B6R0.2 CC(C)CC(C)N MCULE-5992377656 [0,1,0,0,0,0|2,0,1]=4 1304 B6R0.2 CC(C)CC(C)O MCULE-9223768698 [0,1,0,0,0,0|1,0,1]=3 1305 B6R0.2 CC(C)CN(=O)=O MCULE-1357840093 [0,1,0,0,0,0|3,0,0]=4 1306 B6R0.2 CC(C)CS(=O)[O-] MCULE-3716652382 [0,1,0,0,0,0|3,0,0]=4 1307 B6R0.2 CC(C)CS(=O)[O-] MCULE-7111094918 [0,1,0,0,0,0|3,0,0]=4 1308 B6R0.2 CC(C)C[C@@H](C)N MCULE-5902933285 [0,1,0,0,0,0|2,0,1]=4 1309 B6R0.2 CC(C)C[C@@H](C)N MCULE-7208228535 [0,1,0,0,0,0|2,0,1]=4 1310 B6R0.2 CC(C)C[C@@H](C)O MCULE-3150675602 [0,1,0,0,0,0|1,0,1]=3 1311 B6R0.2 CC(C)C[C@@H](C)O MCULE-4011042896 [0,1,0,0,0,0|1,0,1]=3 1312 B6R0.2 CC(C)NC(=O)N MCULE-2725741897 [0,1,0,0,0,0|3,0,0]=4 1313 B6R0.2 CC(C)OC(=O)Cl MCULE-3303340398 [0,1,0,0,0,0|3,0,0]=4 1314 B6R0.2 CC(C)OC(=O)N MCULE-9996500963 [0,1,0,0,0,0|3,0,0]=4 1315 B6R0.2 CC(C)SC(=O)Cl MCULE-9803882280 [0,1,0,0,0,0|3,0,0]=4 1316 B6R0.2 CC(Cl)CC(=O)Cl MCULE-3323045052 [0,1,0,0,0,0|2,0,0]=3 1317 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [0,1,0,0,0,0|2,0,0]=3 1318 B6R0.2 CC(Cl)CN(C)C MCULE-6738916847 [0,1,0,0,0,0|3,0,0]=4 1319 B6R0.2 CC(Cl)CN(C)C MCULE-7074789151 [0,1,0,0,0,0|3,0,0]=4 1320 B6R0.2 CC(Cl)OC(=O)Cl MCULE-8020850544 [0,1,0,0,0,0|3,0,0]=4 1321 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [0,1,0,0,0,0|2,0,0]=3 1322 B6R0.2 CC(N)CC(=O)N MCULE-8604112274 [0,1,0,0,0,0|2,0,0]=3 1323 B6R0.2 CC(N)CC(=O)N MCULE-8651032460 [0,1,0,0,0,0|2,0,0]=3 1324 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [0,1,0,0,0,0|2,0,0]=3 1325 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [0,1,0,0,0,0|2,0,0]=3 1326 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [0,1,0,0,0,0|2,0,0]=3 1327 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [0,1,0,0,0,0|2,0,0]=3 1328 B6R0.2 CC(N)CC(C)O MCULE-7772080010 [0,1,0,0,0,0|1,0,1]=3 1329 B6R0.2 CC(N)CC(F)F MCULE-9211292557 [0,1,0,0,0,0|2,0,1]=4 1330 B6R0.2 CC(N)CC(F)F MCULE-9693935594 [0,1,0,0,0,0|2,0,1]=4 1331 B6R0.2 CC(N)CN(C)C MCULE-4834268309 [0,1,0,0,0,0|3,0,0]=4 1332 B6R0.2 CC(N)CN(C)C MCULE-9601630435 [0,1,0,0,0,0|3,0,0]=4 1333 B6R0.2 CC(N)CS(=O)C MCULE-1278482312 [0,1,0,0,0,0|2,0,0]=3 1334 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [0,1,0,0,0,0|1,0,0]=2 1335 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [0,1,0,0,0,0|1,0,0]=2 1336 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [0,1,0,0,0,0|1,0,0]=2 1337 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [0,1,0,0,0,0|1,0,0]=2 1338 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [0,1,0,0,0,0|1,0,0]=2 1339 B6R0.2 CC(O)CC(C)O MCULE-1652556328 [0,1,0,0,0,0|0,0,2]=3 1340 B6R0.2 CC(O)CN(=O)=O MCULE-1592317283 [0,1,0,0,0,0|2,0,0]=3 1341 B6R0.2 CC(O)CN(C)C MCULE-6531222530 [0,1,0,0,0,0|2,0,0]=3 1342 B6R0.2 CC(O)CN(C)C MCULE-7127620454 [0,1,0,0,0,0|2,0,0]=3 1343 B6R0.2 CC(O)CN(C)N MCULE-6197492770 [0,1,0,0,0,0|2,0,0]=3 1344 B6R0.2 CC(O)CS(=O)C MCULE-2365161952 [0,1,0,0,0,0|1,0,0]=2 1345 B6R0.2 CN(C)CC(=O)Cl MCULE-2168217529 [0,1,0,0,0,0|3,0,0]=4 1346 B6R0.2 CN(C)CC(=O)Cl MCULE-6810056185 [0,1,0,0,0,0|3,0,0]=4 1347 B6R0.2 CN(C)CC(=O)N MCULE-3894706713 [0,1,0,0,0,0|3,0,0]=4 1348 B6R0.2 CN(C)CC(=O)O MCULE-2303978039 [0,1,0,0,0,0|2,0,1]=4 1349 B6R0.2 CN(C)CC(=O)O MCULE-3368936600 [0,1,0,0,0,0|2,0,1]=4 1350 B6R0.2 CN(C)CC(=O)[O-] MCULE-3077067854 [0,1,0,0,0,0|3,0,0]=4 1351 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [0,1,0,0,0,0|2,0,0]=3 1352 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [0,1,0,0,0,0|2,0,0]=3 1353 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [0,1,0,0,0,0|2,0,0]=3 1354 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [0,1,0,0,0,0|2,0,0]=3 1355 B6R0.2 C[C@@H](N)CN(C)C MCULE-2034828409 [0,1,0,0,0,0|3,0,0]=4 1356 B6R0.2 C[C@@H](N)CN(C)C MCULE-2147556460 [0,1,0,0,0,0|3,0,0]=4 1357 B6R0.2 C[C@@H](N)CN(C)C MCULE-6097836560 [0,1,0,0,0,0|3,0,0]=4 1358 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [0,1,0,0,0,0|1,0,0]=2 1359 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [0,1,0,0,0,0|1,0,0]=2 1360 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [0,1,0,0,0,0|1,0,0]=2 1361 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [0,1,0,0,0,0|1,0,0]=2 1362 B6R0.2 C[C@@H](O)CN(C)C MCULE-3114172439 [0,1,0,0,0,0|2,0,0]=3 1363 B6R0.2 C[C@@H](O)CN(C)C MCULE-9927679143 [0,1,0,0,0,0|2,0,0]=3 1364 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-3504626196 [0,1,0,0,0,0|0,0,2]=3 1365 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-4671148975 [0,1,0,0,0,0|0,0,2]=3 1366 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-8345849773 [0,1,0,0,0,0|0,0,2]=3 1367 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [0,1,0,0,0,0|2,0,0]=3 1368 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [0,1,0,0,0,0|2,0,0]=3 1369 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [0,1,0,0,0,0|2,0,0]=3 1370 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [0,1,0,0,0,0|2,0,0]=3 1371 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [0,1,0,0,0,0|2,0,0]=3 1372 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [0,1,0,0,0,0|2,0,0]=3 1373 B6R0.2 C[C@H](N)CN(C)C MCULE-2526118342 [0,1,0,0,0,0|3,0,0]=4 1374 B6R0.2 C[C@H](N)CN(C)C MCULE-3902055308 [0,1,0,0,0,0|3,0,0]=4 1375 B6R0.2 C[C@H](N)CN(C)C MCULE-4292583182 [0,1,0,0,0,0|3,0,0]=4 1376 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [0,1,0,0,0,0|1,0,0]=2 1377 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [0,1,0,0,0,0|1,0,0]=2 1378 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [0,1,0,0,0,0|1,0,0]=2 1379 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [0,1,0,0,0,0|1,0,0]=2 1380 B6R0.2 C[C@H](O)CN(C)C MCULE-4542650002 [0,1,0,0,0,0|2,0,0]=3 1381 B6R0.2 C[C@H](O)CN(C)C MCULE-4717676519 [0,1,0,0,0,0|2,0,0]=3 1382 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-1267135444 [0,1,0,0,0,0|0,0,2]=3 1383 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-5878966333 [0,1,0,0,0,0|0,0,2]=3 1384 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-1975585935 [0,1,0,0,0,0|3,0,0]=4 1385 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-7679949306 [0,1,0,0,0,0|3,0,0]=4 1386 B6R0.2 N=C(N)CC(=O)N MCULE-9200673939 [0,1,0,0,0,0|2,0,1]=4 1387 B6R0.2 N=C([NH3+])CC(=O)N MCULE-7769639649 [0,1,0,0,0,0|2,0,1]=4 1388 B6R0.2 NC(=O)CC(=O)N MCULE-7675159766 [0,1,0,0,0,0|1,0,2]=4 1389 B6R0.2 NC(=O)CC(=O)O MCULE-1168254626 [0,1,0,0,0,0|1,0,1]=3 1390 B6R0.2 NC(=O)CC(=S)N MCULE-9383188328 [0,1,0,0,0,0|1,1,1]=4 1391 B6R0.2 NC(=O)CN(=O)=O MCULE-2051107739 [0,1,0,0,0,0|2,0,1]=4 1392 B6R0.2 NC(=O)CN(=O)=O MCULE-6284821429 [0,1,0,0,0,0|2,0,1]=4 1393 B6R0.2 NC(F)CC(=O)O MCULE-1563194776 [0,1,0,0,0,0|2,0,0]=3 1394 B6R0.2 NC(F)CC(=O)O MCULE-1655564430 [0,1,0,0,0,0|2,0,0]=3 1395 B6R0.2 O=C(Cl)CC(=O)Cl MCULE-8779098368 [0,1,0,0,0,0|1,0,2]=4 1396 B6R0.2 O=C(O)CB(O)O MCULE-6408403753 [0,1,0,0,0,0|2,0,0]=3 1397 B6R0.2 O=C(O)CC(=O)O MCULE-5893043131 [0,1,0,0,0,0|1,0,1]=3 1398 B6R0.2 O=C(O)CC(F)F MCULE-9388620099 [0,1,0,0,0,0|2,0,0]=3 1399 B6R0.2 O=C(O)CN(=O)=O MCULE-4962751453 [0,1,0,0,0,0|2,0,1]=4 1400 B6R0.2 O=C([O-])CC(=O)[O-] MCULE-2327820884 [0,1,0,0,0,0|1,0,2]=4 1401 B6R0.2 O=C([O-])CC(=O)[O-] MCULE-6849635529 [0,1,0,0,0,0|1,0,2]=4 1402 B6R0.2 O=C([O-])CN(=O)=O MCULE-4674762686 [0,1,0,0,0,0|2,0,1]=4 1403 B6R0.3 C#CC(O)C(=O)O MCULE-4214673632 [0,1,0,0,0,0|2,0,1]=4 1404 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [0,1,0,0,0,0|3,0,0]=4 1405 B6R0.3 C(N)(CO)C(=O)N MCULE-5512645571 [0,1,0,0,0,0|1,0,0]=2 1406 B6R0.3 C(N)(CO)C(=O)N MCULE-5852943337 [0,1,0,0,0,0|1,0,0]=2 1407 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [0,1,0,0,0,0|2,0,0]=3 1408 B6R0.3 C=C(CBr)C(=O)O MCULE-7257367588 [0,1,0,0,0,0|2,0,1]=4 1409 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [0,1,0,0,0,0|2,0,1]=4 1410 B6R0.3 C=C(CO)C(=O)O MCULE-9731648602 [0,1,0,0,0,0|1,0,1]=3 1411 B6R0.3 C=C(I)C(C)CI MCULE-8558127481 [0,1,0,0,0,0|2,0,1]=4 1412 B6R0.3 C=C(I)[C@H](C)CI MCULE-1089285398 [0,1,0,0,0,0|2,0,1]=4 1413 B6R0.3 C=C(I)[C@H](C)CI MCULE-5444456468 [0,1,0,0,0,0|2,0,1]=4 1414 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [0,1,0,0,0,0|2,0,1]=4 1415 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [0,1,0,0,0,0|2,0,1]=4 1416 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [0,1,0,0,0,0|2,0,1]=4 1417 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [0,1,0,0,0,0|2,0,1]=4 1418 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [0,1,0,0,0,0|2,0,1]=4 1419 B6R0.3 C=CC(O)C(=O)O MCULE-3847595710 [0,1,0,0,0,0|2,0,1]=4 1420 B6R0.3 C=CN(C)C(=O)C MCULE-2418332000 [0,1,0,0,0,0|2,0,1]=4 1421 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [0,1,0,0,0,0|2,0,1]=4 1422 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [0,1,0,0,0,0|2,0,1]=4 1423 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [0,1,0,0,0,0|2,0,1]=4 1424 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [0,1,0,0,0,0|2,0,1]=4 1425 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [0,1,0,0,0,0|2,0,1]=4 1426 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [0,1,0,0,0,0|2,0,1]=4 1427 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [0,1,0,0,0,0|2,0,1]=4 1428 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [0,1,0,0,0,0|2,0,1]=4 1429 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [0,1,0,0,0,0|2,0,1]=4 1430 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [0,1,0,0,0,0|2,0,1]=4 1431 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [0,1,0,0,0,0|2,0,1]=4 1432 B6R0.3 CC(=C(Br)CBr)C MCULE-2575044530 [0,1,0,0,0,0|2,0,1]=4 1433 B6R0.3 CC(=C(Br)CN)C MCULE-2433306744 [0,1,0,0,0,0|2,0,1]=4 1434 B6R0.3 CC(=C(C)CO)C MCULE-2852322197 [0,1,0,0,0,0|1,0,1]=3 1435 B6R0.3 CC(=C(F)CN)C MCULE-8503104664 [0,1,0,0,0,0|2,0,1]=4 1436 B6R0.3 CC(=C(F)CN)C MCULE-8932417146 [0,1,0,0,0,0|2,0,1]=4 1437 B6R0.3 CC(=C(F)CO)C MCULE-3552996593 [0,1,0,0,0,0|1,0,1]=3 1438 B6R0.3 CC(=NO)C(=O)O MCULE-8264934008 [0,1,0,0,0,0|2,0,1]=4 1439 B6R0.3 CC(=O)/C(=N/O)/C MCULE-2017881701 [0,1,0,0,0,0|1,0,1]=3 1440 B6R0.3 CC(=O)/C(=N\O)/C MCULE-6814264333 [0,1,0,0,0,0|1,0,1]=3 1441 B6R0.3 CC(=O)C(=NO)C MCULE-3626428375 [0,1,0,0,0,0|1,0,1]=3 1442 B6R0.3 CC(=O)C(=NO)Cl MCULE-9930401042 [0,1,0,0,0,0|1,0,1]=3 1443 B6R0.3 CC(=O)C(=O)CBr MCULE-8560925164 [0,1,0,0,0,0|1,0,1]=3 1444 B6R0.3 CC(=O)C(=O)CCl MCULE-2778551811 [0,1,0,0,0,0|1,0,1]=3 1445 B6R0.3 CC(=O)C(Br)C=O MCULE-6904531970 [0,1,0,0,0,0|0,0,2]=3 1446 B6R0.3 CC(=O)C(C)C#N MCULE-3849364002 [0,1,0,0,0,0|1,0,1]=3 1447 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [0,1,0,0,0,0|0,0,2]=3 1448 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [0,1,0,0,0,0|0,0,0]=1 1449 B6R0.3 CC(=O)C(Cl)C#N MCULE-7984925847 [0,1,0,0,0,0|1,0,1]=3 1450 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [0,1,0,0,0,0|0,0,0]=1 1451 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [0,1,0,0,0,0|0,0,0]=1 1452 B6R0.3 CC(C#N)C(=O)N MCULE-2138676966 [0,1,0,0,0,0|2,0,1]=4 1453 B6R0.3 CC(C#N)C(=O)O MCULE-3302580561 [0,1,0,0,0,0|2,0,1]=4 1454 B6R0.3 CC(C)C(=O)CO MCULE-8746789873 [0,1,0,0,0,0|1,0,2]=4 1455 B6R0.3 CC(C)C(C)CBr MCULE-4323135623 [0,1,0,0,0,0|2,0,1]=4 1456 B6R0.3 CC(C)C(C)CN MCULE-1011041652 [0,1,0,0,0,0|2,0,1]=4 1457 B6R0.3 CC(C)C(C)CN MCULE-5682817467 [0,1,0,0,0,0|2,0,1]=4 1458 B6R0.3 CC(C)C(C)CO MCULE-7008552664 [0,1,0,0,0,0|1,0,1]=3 1459 B6R0.3 CC(C)C(N)CF MCULE-4101575579 [0,1,0,0,0,0|2,0,1]=4 1460 B6R0.3 CC(C)C(N)CF MCULE-4888178244 [0,1,0,0,0,0|2,0,1]=4 1461 B6R0.3 CC(C)C(N)CN MCULE-3414430422 [0,1,0,0,0,0|2,0,1]=4 1462 B6R0.3 CC(C)C(N)CN MCULE-5279153780 [0,1,0,0,0,0|2,0,1]=4 1463 B6R0.3 CC(C)C(N)CO MCULE-2361921763 [0,1,0,0,0,0|1,0,1]=3 1464 B6R0.3 CC(C)C(N)CO MCULE-2989454077 [0,1,0,0,0,0|1,0,1]=3 1465 B6R0.3 CC(C)C(N)CO MCULE-9793548365 [0,1,0,0,0,0|1,0,1]=3 1466 B6R0.3 CC(C)C(O)CBr MCULE-1921145212 [0,1,0,0,0,0|2,0,1]=4 1467 B6R0.3 CC(C)C(O)CCl MCULE-7270676495 [0,1,0,0,0,0|2,0,1]=4 1468 B6R0.3 CC(C)C(O)CN MCULE-3560246402 [0,1,0,0,0,0|2,0,1]=4 1469 B6R0.3 CC(C)C(O)CN MCULE-9420842607 [0,1,0,0,0,0|2,0,1]=4 1470 B6R0.3 CC(C)C(O)CO MCULE-6069815474 [0,1,0,0,0,0|1,0,1]=3 1471 B6R0.3 CC(C)C(S)CO MCULE-1903780493 [0,1,0,0,0,0|1,0,1]=3 1472 B6R0.3 CC(C)[C@@H](C)CO MCULE-4943691177 [0,1,0,0,0,0|1,0,1]=3 1473 B6R0.3 CC(C)[C@@H](C)CO MCULE-6583781047 [0,1,0,0,0,0|1,0,1]=3 1474 B6R0.3 CC(C)[C@@H](N)CF MCULE-7429178470 [0,1,0,0,0,0|2,0,1]=4 1475 B6R0.3 CC(C)[C@@H](N)CF MCULE-7951488806 [0,1,0,0,0,0|2,0,1]=4 1476 B6R0.3 CC(C)[C@@H](N)CO MCULE-1135743088 [0,1,0,0,0,0|1,0,1]=3 1477 B6R0.3 CC(C)[C@@H](N)CO MCULE-3994511291 [0,1,0,0,0,0|1,0,1]=3 1478 B6R0.3 CC(C)[C@H](C)CO MCULE-9527582465 [0,1,0,0,0,0|1,0,1]=3 1479 B6R0.3 CC(C)[C@H](N)CF MCULE-2978082368 [0,1,0,0,0,0|2,0,1]=4 1480 B6R0.3 CC(C)[C@H](N)CF MCULE-4609473233 [0,1,0,0,0,0|2,0,1]=4 1481 B6R0.3 CC(C)[C@H](N)CN MCULE-2884084983 [0,1,0,0,0,0|2,0,1]=4 1482 B6R0.3 CC(C)[C@H](N)CO MCULE-2625936994 [0,1,0,0,0,0|1,0,1]=3 1483 B6R0.3 CC(C)[C@H](N)CO MCULE-3229973889 [0,1,0,0,0,0|1,0,1]=3 1484 B6R0.3 CC(C)[C@H](N)CO MCULE-6090001117 [0,1,0,0,0,0|1,0,1]=3 1485 B6R0.3 CC(C)[C@H](N)CO MCULE-8284816696 [0,1,0,0,0,0|1,0,1]=3 1486 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [0,1,0,0,0,0|2,0,0]=3 1487 B6R0.3 CC(CCl)N(C)C MCULE-1058476958 [0,1,0,0,0,0|3,0,0]=4 1488 B6R0.3 CC(CCl)N(C)C MCULE-3515287037 [0,1,0,0,0,0|3,0,0]=4 1489 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [0,1,0,0,0,0|2,0,0]=3 1490 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [0,1,0,0,0,0|2,0,0]=3 1491 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [0,1,0,0,0,0|2,0,0]=3 1492 B6R0.3 CC(CN)N(C)C MCULE-1383449400 [0,1,0,0,0,0|3,0,0]=4 1493 B6R0.3 CC(CN)N(C)C MCULE-9891789912 [0,1,0,0,0,0|3,0,0]=4 1494 B6R0.3 CC(CN)S(=O)C MCULE-9048112625 [0,1,0,0,0,0|2,0,0]=3 1495 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [0,1,0,0,0,0|1,0,0]=2 1496 B6R0.3 CC(CO)C(=O)[O-] MCULE-6956620176 [0,1,0,0,0,0|1,0,0]=2 1497 B6R0.3 CC(CO)N(=O)=O MCULE-5856696728 [0,1,0,0,0,0|2,0,0]=3 1498 B6R0.3 CC(CO)N(C)C MCULE-7300076854 [0,1,0,0,0,0|2,0,0]=3 1499 B6R0.3 CC(CO)N(C)N MCULE-8306784573 [0,1,0,0,0,0|2,0,0]=3 1500 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [0,1,0,0,0,0|1,1,0]=3 1501 B6R0.3 CC(Cl)C(O)CCl MCULE-5399761987 [0,1,0,0,0,0|2,0,1]=4 1502 B6R0.3 CC(N)C(C)CO MCULE-8179225289 [0,1,0,0,0,0|1,0,1]=3 1503 B6R0.3 CC(N)C(O)CO MCULE-8191126136 [0,1,0,0,0,0|1,0,1]=3 1504 B6R0.3 CC(O)C(C)CN MCULE-5251700993 [0,1,0,0,0,0|1,0,2]=4 1505 B6R0.3 CC(O)C(C)CO MCULE-4061946423 [0,1,0,0,0,0|0,0,2]=3 1506 B6R0.3 CC(O)C(N)CN MCULE-2787573482 [0,1,0,0,0,0|1,0,2]=4 1507 B6R0.3 CC(O)C(N)CN MCULE-5330950433 [0,1,0,0,0,0|1,0,2]=4 1508 B6R0.3 CC(O)C(N)CO MCULE-7733336449 [0,1,0,0,0,0|0,0,2]=3 1509 B6R0.3 CC(O)C(O)CN MCULE-6591390331 [0,1,0,0,0,0|1,0,2]=4 1510 B6R0.3 CC(O)C(O)CO MCULE-1795053551 [0,1,0,0,0,0|0,0,2]=3 1511 B6R0.3 CC(ON)C(=O)O MCULE-1969235976 [0,1,0,0,0,0|3,0,0]=4 1512 B6R0.3 CC(ON)C(=O)O MCULE-4318537884 [0,1,0,0,0,0|3,0,0]=4 1513 B6R0.3 CC(ON)C(=O)O MCULE-4455753863 [0,1,0,0,0,0|3,0,0]=4 1514 B6R0.3 CC(ON)C(=O)O MCULE-8893009712 [0,1,0,0,0,0|3,0,0]=4 1515 B6R0.3 CC(S)C(C)CO MCULE-5435813701 [0,1,0,0,0,0|0,1,1]=3 1516 B6R0.3 CC=C(C)C(=O)C MCULE-8950290711 [0,1,0,0,0,0|1,0,2]=4 1517 B6R0.3 CCC(=C(C)C)C MCULE-7258057243 [0,1,0,0,0,0|2,0,1]=4 1518 B6R0.3 CCC(=O)C(=O)C MCULE-3065014067 [0,1,0,0,0,0|1,0,1]=3 1519 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [0,1,0,0,0,0|2,0,1]=4 1520 B6R0.3 CCC(=O)C(=O)[O-] MCULE-7571698792 [0,1,0,0,0,0|2,0,1]=4 1521 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [0,1,0,0,0,0|2,0,0]=3 1522 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [0,1,0,0,0,0|1,0,0]=2 1523 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [0,1,0,0,0,0|2,0,0]=3 1524 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [0,1,0,0,0,0|2,0,0]=3 1525 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [0,1,0,0,0,0|2,0,0]=3 1526 B6R0.3 CCC(C)C(=N)N MCULE-4070060089 [0,1,0,0,0,0|3,0,0]=4 1527 B6R0.3 CCC(C)C(=N)N MCULE-7020524406 [0,1,0,0,0,0|3,0,0]=4 1528 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [0,1,0,0,0,0|1,0,0]=2 1529 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [0,1,0,0,0,0|2,0,0]=3 1530 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [0,1,0,0,0,0|2,0,0]=3 1531 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [0,1,0,0,0,0|2,0,0]=3 1532 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [0,1,0,0,0,0|2,0,0]=3 1533 B6R0.3 CCC(C)C(=S)N MCULE-9682279721 [0,1,0,0,0,0|2,1,0]=4 1534 B6R0.3 CCC(C)C(C)Br MCULE-5368409335 [0,1,0,0,0,0|2,0,1]=4 1535 B6R0.3 CCC(C)C(C)C MCULE-9189749509 [0,1,0,0,0,0|2,0,1]=4 1536 B6R0.3 CCC(C)C(C)Cl MCULE-2663176330 [0,1,0,0,0,0|2,0,1]=4 1537 B6R0.3 CCC(C)C(C)N MCULE-1056466337 [0,1,0,0,0,0|2,0,1]=4 1538 B6R0.3 CCC(C)C(C)N MCULE-1503543126 [0,1,0,0,0,0|2,0,1]=4 1539 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [0,1,0,0,0,0|1,0,2]=4 1540 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [0,1,0,0,0,0|2,0,0]=3 1541 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [0,1,0,0,0,0|2,0,0]=3 1542 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [0,1,0,0,0,0|2,0,0]=3 1543 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [0,1,0,0,0,0|2,0,0]=3 1544 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [0,1,0,0,0,0|2,0,0]=3 1545 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [0,1,0,0,0,0|2,0,0]=3 1546 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [0,1,0,0,0,0|2,0,0]=3 1547 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [0,1,0,0,0,0|2,0,0]=3 1548 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [0,1,0,0,0,0|2,0,0]=3 1549 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [0,1,0,0,0,0|2,0,0]=3 1550 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [0,1,0,0,0,0|2,0,0]=3 1551 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [0,1,0,0,0,0|2,0,0]=3 1552 B6R0.3 CCC(N)C(C)C MCULE-3624338196 [0,1,0,0,0,0|2,0,1]=4 1553 B6R0.3 CCC(N)C(C)C MCULE-4491326477 [0,1,0,0,0,0|2,0,1]=4 1554 B6R0.3 CCC(N)C(C)O MCULE-2752432664 [0,1,0,0,0,0|1,0,2]=4 1555 B6R0.3 CCC(N)C(C)O MCULE-6087590428 [0,1,0,0,0,0|1,0,2]=4 1556 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [0,1,0,0,0,0|2,0,0]=3 1557 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [0,1,0,0,0,0|2,0,0]=3 1558 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [0,1,0,0,0,0|2,0,0]=3 1559 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [0,1,0,0,0,0|2,0,0]=3 1560 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [0,1,0,0,0,0|2,0,0]=3 1561 B6R0.3 CCC(O)C(C)C MCULE-1130775455 [0,1,0,0,0,0|2,0,1]=4 1562 B6R0.3 CCC(O)C(C)N MCULE-4027170059 [0,1,0,0,0,0|2,0,1]=4 1563 B6R0.3 CCC(O)C(C)O MCULE-1468922095 [0,1,0,0,0,0|1,0,2]=4 1564 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [0,1,0,0,0,0|1,0,0]=2 1565 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [0,1,0,0,0,0|2,0,0]=3 1566 B6R0.3 CCN(C)C(=O)C MCULE-6881823095 [0,1,0,0,0,0|2,0,0]=3 1567 B6R0.3 CCN(C)C(=O)Cl MCULE-3697487267 [0,1,0,0,0,0|3,0,0]=4 1568 B6R0.3 CCN(N)C(=O)N MCULE-8674876262 [0,1,0,0,0,0|3,0,0]=4 1569 B6R0.3 CCN(O)C(=O)C MCULE-8547381969 [0,1,0,0,0,0|2,0,0]=3 1570 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [0,1,0,0,0,0|2,0,0]=3 1571 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [0,1,0,0,0,0|2,0,0]=3 1572 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [0,1,0,0,0,0|2,0,0]=3 1573 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [0,1,0,0,0,0|2,0,0]=3 1574 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [0,1,0,0,0,0|2,0,0]=3 1575 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [0,1,0,0,0,0|2,0,0]=3 1576 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [0,1,0,0,0,0|2,0,0]=3 1577 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [0,1,0,0,0,0|2,0,0]=3 1578 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [0,1,0,0,0,0|2,0,0]=3 1579 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [0,1,0,0,0,0|2,0,0]=3 1580 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [0,1,0,0,0,0|2,0,0]=3 1581 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [0,1,0,0,0,0|2,0,0]=3 1582 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [0,1,0,0,0,0|2,0,0]=3 1583 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [0,1,0,0,0,0|2,0,0]=3 1584 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [0,1,0,0,0,0|2,0,0]=3 1585 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [0,1,0,0,0,0|2,0,0]=3 1586 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-8294520512 [0,1,0,0,0,0|1,0,2]=4 1587 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-9521001934 [0,1,0,0,0,0|1,0,2]=4 1588 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [0,1,0,0,0,0|2,0,0]=3 1589 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [0,1,0,0,0,0|2,0,0]=3 1590 B6R0.3 CC[C@@H](O)C(C)C MCULE-3684327261 [0,1,0,0,0,0|2,0,1]=4 1591 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [0,1,0,0,0,0|2,0,0]=3 1592 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [0,1,0,0,0,0|2,0,0]=3 1593 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [0,1,0,0,0,0|2,0,0]=3 1594 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [0,1,0,0,0,0|2,0,0]=3 1595 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [0,1,0,0,0,0|2,0,0]=3 1596 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [0,1,0,0,0,0|2,0,0]=3 1597 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [0,1,0,0,0,0|2,0,0]=3 1598 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [0,1,0,0,0,0|2,0,0]=3 1599 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [0,1,0,0,0,0|2,0,0]=3 1600 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [0,1,0,0,0,0|2,0,0]=3 1601 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [0,1,0,0,0,0|2,0,0]=3 1602 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [0,1,0,0,0,0|2,0,0]=3 1603 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [0,1,0,0,0,0|2,0,0]=3 1604 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [0,1,0,0,0,0|2,0,1]=4 1605 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [0,1,0,0,0,0|2,0,1]=4 1606 B6R0.3 CC[C@H](N)C(C)C MCULE-3200638239 [0,1,0,0,0,0|2,0,1]=4 1607 B6R0.3 CC[C@H](N)C(C)C MCULE-4973720203 [0,1,0,0,0,0|2,0,1]=4 1608 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-1930738992 [0,1,0,0,0,0|1,0,2]=4 1609 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-4226147180 [0,1,0,0,0,0|1,0,2]=4 1610 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-7445496718 [0,1,0,0,0,0|1,0,2]=4 1611 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-9770959398 [0,1,0,0,0,0|1,0,2]=4 1612 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-3878355824 [0,1,0,0,0,0|1,0,2]=4 1613 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-4791160457 [0,1,0,0,0,0|1,0,2]=4 1614 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [0,1,0,0,0,0|2,0,0]=3 1615 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [0,1,0,0,0,0|2,0,0]=3 1616 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [0,1,0,0,0,0|2,0,0]=3 1617 B6R0.3 CC[C@H](O)C(C)C MCULE-9659963395 [0,1,0,0,0,0|2,0,1]=4 1618 B6R0.3 CN(C)C(=O)CO MCULE-8470749078 [0,1,0,0,0,0|2,0,1]=4 1619 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [0,1,0,0,0,0|3,0,0]=4 1620 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [0,1,0,0,0,0|3,0,0]=4 1621 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [0,1,0,0,0,0|3,0,0]=4 1622 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [0,1,0,0,0,0|3,0,0]=4 1623 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [0,1,0,0,0,0|3,0,0]=4 1624 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [0,1,0,0,0,0|3,0,0]=4 1625 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [0,1,0,0,0,0|3,0,0]=4 1626 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [0,1,0,0,0,0|3,0,0]=4 1627 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [0,1,0,0,0,0|3,0,0]=4 1628 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [0,1,0,0,0,0|3,0,0]=4 1629 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [0,1,0,0,0,0|3,0,0]=4 1630 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [0,1,0,0,0,0|3,0,0]=4 1631 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [0,1,0,0,0,0|3,0,0]=4 1632 B6R0.3 COC(=O)C(=O)C MCULE-5423483210 [0,1,0,0,0,0|2,0,1]=4 1633 B6R0.3 COC(Br)C(=O)C MCULE-1220922171 [0,1,0,0,0,0|2,0,0]=3 1634 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [0,1,0,0,0,0|3,0,0]=4 1635 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [0,1,0,0,0,0|2,0,0]=3 1636 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [0,1,0,0,0,0|3,0,0]=4 1637 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [0,1,0,0,0,0|3,0,0]=4 1638 B6R0.3 CON(C)C(=O)C MCULE-8559238750 [0,1,0,0,0,0|3,0,0]=4 1639 B6R0.3 CO[C@@H](C)C(=O)Cl MCULE-9335923061 [0,1,0,0,0,0|3,0,0]=4 1640 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [0,1,0,0,0,0|3,0,0]=4 1641 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [0,1,0,0,0,0|3,0,0]=4 1642 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [0,1,0,0,0,0|3,0,0]=4 1643 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [0,1,0,0,0,0|3,0,0]=4 1644 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [0,1,0,0,0,0|2,0,0]=3 1645 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [0,1,0,0,0,0|3,0,0]=4 1646 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [0,1,0,0,0,0|2,0,0]=3 1647 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [0,1,0,0,0,0|2,0,0]=3 1648 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [0,1,0,0,0,0|2,0,0]=3 1649 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [0,1,0,0,0,0|2,0,0]=3 1650 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [0,1,0,0,0,0|1,0,0]=2 1651 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [0,1,0,0,0,0|1,0,0]=2 1652 B6R0.3 C[C@@H](CO)N(C)C MCULE-4388248602 [0,1,0,0,0,0|2,0,0]=3 1653 B6R0.3 C[C@@H](CS)N(C)C MCULE-7111398165 [0,1,0,0,0,0|2,1,0]=4 1654 B6R0.3 C[C@@H](F)[C@@H](F)CN MCULE-9285557840 [0,1,0,0,0,0|2,0,1]=4 1655 B6R0.3 C[C@@H](F)[C@H](F)CN MCULE-9353092073 [0,1,0,0,0,0|2,0,1]=4 1656 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-1499224916 [0,1,0,0,0,0|0,0,2]=3 1657 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-3539522955 [0,1,0,0,0,0|0,0,2]=3 1658 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-1381786707 [0,1,0,0,0,0|0,0,2]=3 1659 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-3627537672 [0,1,0,0,0,0|0,0,2]=3 1660 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-5429038645 [0,1,0,0,0,0|0,0,2]=3 1661 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-6146168744 [0,1,0,0,0,0|0,0,2]=3 1662 B6R0.3 C[C@@H](ON)C(=O)O MCULE-1538722507 [0,1,0,0,0,0|3,0,0]=4 1663 B6R0.3 C[C@@H](ON)C(=O)O MCULE-3835402446 [0,1,0,0,0,0|3,0,0]=4 1664 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [0,1,0,0,0,0|2,0,0]=3 1665 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [0,1,0,0,0,0|2,0,0]=3 1666 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [0,1,0,0,0,0|2,0,0]=3 1667 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [0,1,0,0,0,0|2,0,0]=3 1668 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [0,1,0,0,0,0|1,0,0]=2 1669 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [0,1,0,0,0,0|1,0,0]=2 1670 B6R0.3 C[C@H](CO)C(=O)[O-] MCULE-5733737039 [0,1,0,0,0,0|1,0,0]=2 1671 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-5329315346 [0,1,0,0,0,0|0,0,2]=3 1672 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7239426628 [0,1,0,0,0,0|0,0,2]=3 1673 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7437797788 [0,1,0,0,0,0|0,0,2]=3 1674 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-2378004602 [0,1,0,0,0,0|0,0,2]=3 1675 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-9436764758 [0,1,0,0,0,0|0,0,2]=3 1676 B6R0.3 C[C@H](ON)C(=O)O MCULE-3327889540 [0,1,0,0,0,0|3,0,0]=4 1677 B6R0.3 C[C@H](ON)C(=O)O MCULE-4523264650 [0,1,0,0,0,0|3,0,0]=4 1678 B6R0.3 N#CC(Br)C(=O)N MCULE-3091108124 [0,1,0,0,0,0|2,0,1]=4 1679 B6R0.3 N#CC(N)C(=O)N MCULE-3175667831 [0,1,0,0,0,0|2,0,1]=4 1680 B6R0.3 NC(=O)/C(=N/O)/N MCULE-6909019905 [0,1,0,0,0,0|2,0,1]=4 1681 B6R0.3 NC(=O)C(Br)CBr MCULE-3438242131 [0,1,0,0,0,0|2,0,0]=3 1682 B6R0.3 NC(=O)C(Cl)CCl MCULE-9549750186 [0,1,0,0,0,0|2,0,0]=3 1683 B6R0.3 NC(=O)C(N)CO MCULE-4842751232 [0,1,0,0,0,0|1,0,0]=2 1684 B6R0.3 NC(=O)C(N)CO MCULE-6854366147 [0,1,0,0,0,0|1,0,0]=2 1685 B6R0.3 NC(=O)C(N)CS MCULE-3144051628 [0,1,0,0,0,0|1,1,0]=3 1686 B6R0.3 NC(=O)C(N)CS MCULE-7739536595 [0,1,0,0,0,0|1,1,0]=3 1687 B6R0.3 NC(=O)[C@@H](N)CO MCULE-2185844038 [0,1,0,0,0,0|1,0,0]=2 1688 B6R0.3 NC(=O)[C@@H](N)CO MCULE-3623516041 [0,1,0,0,0,0|1,0,0]=2 1689 B6R0.3 NC(=O)[C@@H](N)CO MCULE-6218638108 [0,1,0,0,0,0|1,0,0]=2 1690 B6R0.3 NC(=O)[C@@H](N)CS MCULE-9790378691 [0,1,0,0,0,0|1,1,0]=3 1691 B6R0.3 NC(=O)[C@H](N)CO MCULE-2061645482 [0,1,0,0,0,0|1,0,0]=2 1692 B6R0.3 NC(=O)[C@H](N)CO MCULE-5920366137 [0,1,0,0,0,0|1,0,0]=2 1693 B6R0.3 NC(=O)[C@H](N)CO MCULE-7612340519 [0,1,0,0,0,0|1,0,0]=2 1694 B6R0.3 NC(=O)[C@H](N)CO MCULE-7734326153 [0,1,0,0,0,0|1,0,0]=2 1695 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [0,1,0,0,0,0|2,0,0]=3 1696 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [0,1,0,0,0,0|2,0,0]=3 1697 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [0,1,0,0,0,0|2,0,0]=3 1698 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [0,1,0,0,0,0|2,0,0]=3 1699 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [0,1,0,0,0,0|1,0,0]=2 1700 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [0,1,0,0,0,0|1,0,0]=2 1701 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [0,1,0,0,0,0|1,1,0]=3 1702 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [0,1,0,0,0,0|1,1,0]=3 1703 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [0,1,0,0,0,0|1,1,0]=3 1704 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [0,1,0,0,0,0|1,1,0]=3 1705 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [0,1,0,0,0,0|2,0,0]=3 1706 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [0,1,0,0,0,0|2,0,0]=3 1707 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [0,1,0,0,0,0|2,0,0]=3 1708 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [0,1,0,0,0,0|2,0,0]=3 1709 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [0,1,0,0,0,0|2,0,0]=3 1710 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [0,1,0,0,0,0|2,0,0]=3 1711 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [0,1,0,0,0,0|2,0,0]=3 1712 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [0,1,0,0,0,0|2,0,0]=3 1713 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [0,1,0,0,0,0|2,0,0]=3 1714 B6R0.3 NCC(O)C(=O)N MCULE-1543465850 [0,1,0,0,0,0|2,0,0]=3 1715 B6R0.3 NCC(O)C(=O)N MCULE-9574499203 [0,1,0,0,0,0|2,0,0]=3 1716 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [0,1,0,0,0,0|2,0,0]=3 1717 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [0,1,0,0,0,0|2,0,0]=3 1718 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [0,1,0,0,0,0|2,0,0]=3 1719 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [0,1,0,0,0,0|2,0,0]=3 1720 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [0,1,0,0,0,0|2,0,0]=3 1721 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [0,1,0,0,0,0|2,0,0]=3 1722 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [0,1,0,0,0,0|2,0,0]=3 1723 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [0,1,0,0,0,0|2,0,0]=3 1724 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [0,1,0,0,0,0|2,0,0]=3 1725 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [0,1,0,0,0,0|2,0,0]=3 1726 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [0,1,0,0,0,0|2,0,0]=3 1727 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [0,1,0,0,0,0|2,0,0]=3 1728 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [0,1,0,0,0,0|2,0,0]=3 1729 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [0,1,0,0,0,0|2,0,0]=3 1730 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [0,1,0,0,0,0|2,0,0]=3 1731 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [0,1,0,0,0,0|2,0,0]=3 1732 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [0,1,0,0,0,0|2,0,0]=3 1733 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [0,1,0,0,0,0|2,0,0]=3 1734 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [0,1,0,0,0,0|2,0,0]=3 1735 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [0,1,0,0,0,0|2,0,0]=3 1736 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [0,1,0,0,0,0|2,0,0]=3 1737 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [0,1,0,0,0,0|2,0,0]=3 1738 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [0,1,0,0,0,0|2,0,0]=3 1739 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [0,1,0,0,0,0|2,0,0]=3 1740 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [0,1,0,0,0,0|2,0,0]=3 1741 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [0,1,0,0,0,0|2,0,0]=3 1742 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [0,1,0,0,0,0|2,0,0]=3 1743 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [0,1,0,0,0,0|1,0,0]=2 1744 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [0,1,0,0,0,0|1,0,0]=2 1745 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [0,1,0,0,0,0|1,0,0]=2 1746 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [0,1,0,0,0,0|1,0,0]=2 1747 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [0,1,0,0,0,0|1,1,0]=3 1748 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [0,1,0,0,0,0|1,1,0]=3 1749 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [0,1,0,0,0,0|1,1,0]=3 1750 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [0,1,0,0,0,0|1,1,0]=3 1751 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [0,1,0,0,0,0|2,0,0]=3 1752 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [0,1,0,0,0,0|2,0,0]=3 1753 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [0,1,0,0,0,0|2,0,0]=3 1754 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [0,1,0,0,0,0|2,0,0]=3 1755 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [0,1,0,0,0,0|2,0,0]=3 1756 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [0,1,0,0,0,0|2,0,0]=3 1757 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [0,1,0,0,0,0|1,0,0]=2 1758 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [0,1,0,0,0,0|1,0,0]=2 1759 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [0,1,0,0,0,0|1,1,0]=3 1760 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [0,1,0,0,0,0|1,1,0]=3 1761 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [0,1,0,0,0,0|1,1,0]=3 1762 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [0,1,0,0,0,0|1,1,0]=3 1763 B6R0.3 O=C(Cl)C(=O)CBr MCULE-1637788630 [0,1,0,0,0,0|2,0,1]=4 1764 B6R0.3 O=C(Cl)C(Br)CBr MCULE-8490174834 [0,1,0,0,0,0|2,0,0]=3 1765 B6R0.3 O=C(Cl)C(Cl)CCl MCULE-5571003994 [0,1,0,0,0,0|2,0,0]=3 1766 B6R0.3 O=C(O)C(=O)CBr MCULE-4768170572 [0,1,0,0,0,0|2,0,1]=4 1767 B6R0.3 O=C(O)C(=O)CCl MCULE-7853426045 [0,1,0,0,0,0|2,0,1]=4 1768 B6R0.3 O=C(O)C(=O)CF MCULE-5884987827 [0,1,0,0,0,0|2,0,1]=4 1769 B6R0.3 O=C(O)C(=O)CO MCULE-2263002631 [0,1,0,0,0,0|1,0,1]=3 1770 B6R0.3 O=C(O)C(=O)CS MCULE-7466669113 [0,1,0,0,0,0|1,1,1]=4 1771 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [0,1,0,0,0,0|2,0,0]=3 1772 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [0,1,0,0,0,0|2,0,0]=3 1773 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [0,1,0,0,0,0|1,0,0]=2 1774 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [0,1,0,0,0,0|2,0,0]=3 1775 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [0,1,0,0,0,0|1,0,0]=2 1776 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [0,1,0,0,0,0|2,0,0]=3 1777 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [0,1,0,0,0,0|2,0,0]=3 1778 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [0,1,0,0,0,0|2,0,0]=3 1779 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [0,1,0,0,0,0|1,0,0]=2 1780 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [0,1,0,0,0,0|1,0,0]=2 1781 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [0,1,0,0,0,0|1,0,0]=2 1782 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [0,1,0,0,0,0|2,0,0]=3 1783 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [0,1,0,0,0,0|1,0,0]=2 1784 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [0,1,0,0,0,0|1,0,0]=2 1785 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [0,1,0,0,0,0|1,0,0]=2 1786 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [0,1,0,0,0,0|1,0,0]=2 1787 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [0,1,0,0,0,0|2,0,0]=3 1788 B6R0.3 O=C([O-])C(=O)CF MCULE-9109967389 [0,1,0,0,0,0|2,0,1]=4 1789 B6R0.3 O=C([O-])C(=O)CS MCULE-4375165973 [0,1,0,0,0,0|1,1,1]=4 1790 B6R0.3 O=C([O-])[C@@H](O)CO MCULE-4498291090 [0,1,0,0,0,0|1,0,0]=2 1791 B6R0.3 O=N(=O)C(Br)CO MCULE-2147001744 [0,1,0,0,0,0|2,0,0]=3 1792 B6R0.3 OCC(=C(F)F)F MCULE-9266336086 [0,1,0,0,0,0|2,0,1]=4 1793 B6R0.3 OC[C@@H](O)C(F)F MCULE-5042610356 [0,1,0,0,0,0|2,0,1]=4 1794 B6R0.3 OC[C@@H](O)C(F)F MCULE-8643910063 [0,1,0,0,0,0|2,0,1]=4 1795 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [0,1,0,0,0,0|2,0,1]=4 1796 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [0,1,0,0,0,0|2,0,0]=3 1797 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [0,1,0,0,0,0|3,0,0]=4 1798 B6R0.3 [C@H](N)(CO)C(=O)N MCULE-2792784400 [0,1,0,0,0,0|1,0,0]=2 1799 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [0,1,0,0,0,0|2,0,0]=3 1800 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [0,1,0,0,0,0|1,1,0]=3 1801 B6R0.4 C#CCCC(=O)C MCULE-8723638688 [0,1,0,0,0,0|1,0,0]=2 1802 B6R0.4 C#CCCC(=O)Cl MCULE-5720262741 [0,1,0,0,0,0|2,0,0]=3 1803 B6R0.4 C#CCCC(=O)N MCULE-4490482235 [0,1,0,0,0,0|2,0,0]=3 1804 B6R0.4 C#CCCC(=O)O MCULE-6669146060 [0,1,0,0,0,0|2,0,0]=3 1805 B6R0.4 C#CCCC(=O)[O-] MCULE-2972869840 [0,1,0,0,0,0|2,0,0]=3 1806 B6R0.4 C#CCCC(C)C MCULE-9613694830 [0,1,0,0,0,0|2,0,1]=4 1807 B6R0.4 C#CCCC(C)O MCULE-1476308263 [0,1,0,0,0,0|1,0,2]=4 1808 B6R0.4 C#CCCN(=O)=O MCULE-9436796906 [0,1,0,0,0,0|3,0,0]=4 1809 B6R0.4 C#CCCN(C)C MCULE-9558095172 [0,1,0,0,0,0|3,0,0]=4 1810 B6R0.4 C#CCNC(=O)C MCULE-1159984782 [0,1,0,0,0,0|1,0,1]=3 1811 B6R0.4 C#CCNC(=O)N MCULE-4499144419 [0,1,0,0,0,0|2,0,1]=4 1812 B6R0.4 C#CCOC(=O)C MCULE-5002994323 [0,1,0,0,0,0|1,0,1]=3 1813 B6R0.4 C#CCOC(=O)Cl MCULE-5453166266 [0,1,0,0,0,0|2,0,1]=4 1814 B6R0.4 C#CCOC(=O)N MCULE-9698208346 [0,1,0,0,0,0|2,0,1]=4 1815 B6R0.4 C/C=C/CC(=O)Cl MCULE-5377125313 [0,1,0,0,0,0|2,0,1]=4 1816 B6R0.4 C/C=C/CC(=O)N MCULE-1942934157 [0,1,0,0,0,0|2,0,1]=4 1817 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [0,1,0,0,0,0|2,0,1]=4 1818 B6R0.4 C=C(C)CCC#N MCULE-9953519474 [0,1,0,0,0,0|2,0,0]=3 1819 B6R0.4 C=C(C)CCCBr MCULE-5063918467 [0,1,0,0,0,0|2,0,0]=3 1820 B6R0.4 C=C(C)CCCC MCULE-1010177756 [0,1,0,0,0,0|2,0,0]=3 1821 B6R0.4 C=C(C)CCCO MCULE-4629274490 [0,1,0,0,0,0|1,0,0]=2 1822 B6R0.4 C=C(C)CN=C=S MCULE-8890105593 [0,1,0,0,0,0|1,1,1]=4 1823 B6R0.4 C=C(C)CNCC MCULE-2237759977 [0,1,0,0,0,0|2,0,0]=3 1824 B6R0.4 C=C(Cl)CCCCl MCULE-5713882356 [0,1,0,0,0,0|2,0,1]=4 1825 B6R0.4 C=C(F)CCCO MCULE-1688645687 [0,1,0,0,0,0|1,0,1]=3 1826 B6R0.4 C=C=CCC(=O)O MCULE-2611659307 [0,1,0,0,0,0|2,0,1]=4 1827 B6R0.4 C=CCCC(=C)C MCULE-2323382963 [0,1,0,0,0,0|2,0,0]=3 1828 B6R0.4 C=CCCC(=N)N MCULE-6900789687 [0,1,0,0,0,0|3,0,0]=4 1829 B6R0.4 C=CCCC(=N)N MCULE-8560021860 [0,1,0,0,0,0|3,0,0]=4 1830 B6R0.4 C=CCCC(=O)C MCULE-9598399930 [0,1,0,0,0,0|1,0,0]=2 1831 B6R0.4 C=CCCC(=O)Cl MCULE-7378353157 [0,1,0,0,0,0|2,0,0]=3 1832 B6R0.4 C=CCCC(=O)N MCULE-7202462484 [0,1,0,0,0,0|2,0,0]=3 1833 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [0,1,0,0,0,0|2,0,0]=3 1834 B6R0.4 C=CCCC(C)Br MCULE-5841356762 [0,1,0,0,0,0|2,0,1]=4 1835 B6R0.4 C=CCCC(C)C MCULE-7128249655 [0,1,0,0,0,0|2,0,1]=4 1836 B6R0.4 C=CCCC(C)O MCULE-3388106789 [0,1,0,0,0,0|1,0,2]=4 1837 B6R0.4 C=CCCN(=O)=O MCULE-9645435231 [0,1,0,0,0,0|3,0,0]=4 1838 B6R0.4 C=CCC[C@@H](C)O MCULE-1272820385 [0,1,0,0,0,0|1,0,2]=4 1839 B6R0.4 C=CCC[C@@H](C)O MCULE-8509867177 [0,1,0,0,0,0|1,0,2]=4 1840 B6R0.4 C=CCC[C@H](C)O MCULE-4371391667 [0,1,0,0,0,0|1,0,2]=4 1841 B6R0.4 C=CCNC(=O)C MCULE-7903624915 [0,1,0,0,0,0|1,0,1]=3 1842 B6R0.4 C=CCNC(=O)N MCULE-1210131291 [0,1,0,0,0,0|2,0,1]=4 1843 B6R0.4 C=CCOC(=O)C MCULE-9991130828 [0,1,0,0,0,0|1,0,1]=3 1844 B6R0.4 C=CCOC(=O)Cl MCULE-3513251417 [0,1,0,0,0,0|2,0,1]=4 1845 B6R0.4 C=CCOC(=O)N MCULE-4119124558 [0,1,0,0,0,0|2,0,1]=4 1846 B6R0.4 C=CNCC(=O)O MCULE-5142273921 [0,1,0,0,0,0|2,0,1]=4 1847 B6R0.4 CC#CCC(=O)O MCULE-8576178825 [0,1,0,0,0,0|2,0,1]=4 1848 B6R0.4 CC(=CCC#N)C MCULE-1406666578 [0,1,0,0,0,0|2,0,1]=4 1849 B6R0.4 CC(=CCCBr)C MCULE-9403575147 [0,1,0,0,0,0|2,0,0]=3 1850 B6R0.4 CC(=CCCN)C MCULE-9185531904 [0,1,0,0,0,0|2,0,0]=3 1851 B6R0.4 CC(=CCCO)C MCULE-2493404466 [0,1,0,0,0,0|1,0,0]=2 1852 B6R0.4 CC(=CCCO)C MCULE-8497528596 [0,1,0,0,0,0|1,0,0]=2 1853 B6R0.4 CC(=O)CCC#N MCULE-6810756363 [0,1,0,0,0,0|1,0,0]=2 1854 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [0,1,0,0,0,0|0,0,1]=2 1855 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [0,1,0,0,0,0|1,0,0]=2 1856 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [0,1,0,0,0,0|1,0,0]=2 1857 B6R0.4 CC(=O)CCCO MCULE-1335342150 [0,1,0,0,0,0|0,0,0]=1 1858 B6R0.4 CC(=O)CSC#N MCULE-5774397655 [0,1,0,0,0,0|1,0,1]=3 1859 B6R0.4 CC(=O)NCC#N MCULE-2345227602 [0,1,0,0,0,0|1,0,1]=3 1860 B6R0.4 CC(=O)NCCCl MCULE-7865062188 [0,1,0,0,0,0|1,0,0]=2 1861 B6R0.4 CC(=O)NCCN MCULE-2230084818 [0,1,0,0,0,0|1,0,0]=2 1862 B6R0.4 CC(=O)NCCO MCULE-5968518415 [0,1,0,0,0,0|0,0,0]=1 1863 B6R0.4 CC(=O)NCCS MCULE-3345813615 [0,1,0,0,0,0|0,1,0]=2 1864 B6R0.4 CC(=O)OCC#N MCULE-4866082576 [0,1,0,0,0,0|1,0,1]=3 1865 B6R0.4 CC(=O)OCCBr MCULE-3760449773 [0,1,0,0,0,0|1,0,0]=2 1866 B6R0.4 CC(=O)OCCCl MCULE-4570139017 [0,1,0,0,0,0|1,0,0]=2 1867 B6R0.4 CC(=O)OCCN MCULE-4530529900 [0,1,0,0,0,0|1,0,0]=2 1868 B6R0.4 CC(=O)OCCN MCULE-6854340494 [0,1,0,0,0,0|1,0,0]=2 1869 B6R0.4 CC(=O)OCCO MCULE-1251660436 [0,1,0,0,0,0|0,0,0]=1 1870 B6R0.4 CC(=O)SCC#N MCULE-5864559051 [0,1,0,0,0,0|1,0,1]=3 1871 B6R0.4 CC(=O)SCCBr MCULE-1786480878 [0,1,0,0,0,0|1,0,0]=2 1872 B6R0.4 CC(=O)SCCN MCULE-3819903256 [0,1,0,0,0,0|1,0,0]=2 1873 B6R0.4 CC(=O)SCCN MCULE-4872130470 [0,1,0,0,0,0|1,0,0]=2 1874 B6R0.4 CC(=O)SCCN MCULE-7084821345 [0,1,0,0,0,0|1,0,0]=2 1875 B6R0.4 CC(Br)CCC#N MCULE-7424967519 [0,1,0,0,0,0|2,0,1]=4 1876 B6R0.4 CC(Br)CCCBr MCULE-8808667049 [0,1,0,0,0,0|2,0,1]=4 1877 B6R0.4 CC(C)CCC#N MCULE-5503038837 [0,1,0,0,0,0|2,0,1]=4 1878 B6R0.4 CC(C)CCC=O MCULE-9664145623 [0,1,0,0,0,0|1,0,2]=4 1879 B6R0.4 CC(C)CCCBr MCULE-2045625937 [0,1,0,0,0,0|2,0,1]=4 1880 B6R0.4 CC(C)CCCCl MCULE-4841628592 [0,1,0,0,0,0|2,0,1]=4 1881 B6R0.4 CC(C)CCCI MCULE-4035616717 [0,1,0,0,0,0|2,0,1]=4 1882 B6R0.4 CC(C)CCCN MCULE-2232715676 [0,1,0,0,0,0|2,0,1]=4 1883 B6R0.4 CC(C)CCCN MCULE-7121372197 [0,1,0,0,0,0|2,0,1]=4 1884 B6R0.4 CC(C)CCCO MCULE-5797993948 [0,1,0,0,0,0|1,0,1]=3 1885 B6R0.4 CC(C)CCCS MCULE-8417191578 [0,1,0,0,0,0|1,1,1]=4 1886 B6R0.4 CC(C)CCNN MCULE-1163630283 [0,1,0,0,0,0|2,0,1]=4 1887 B6R0.4 CC(C)CCNN MCULE-2023326468 [0,1,0,0,0,0|2,0,1]=4 1888 B6R0.4 CC(C)CCNN MCULE-4572239737 [0,1,0,0,0,0|2,0,1]=4 1889 B6R0.4 CC(C)CCON MCULE-2653553816 [0,1,0,0,0,0|1,0,1]=3 1890 B6R0.4 CC(C)CCON MCULE-6468395078 [0,1,0,0,0,0|1,0,1]=3 1891 B6R0.4 CC(C)COCCl MCULE-2194640169 [0,1,0,0,0,0|2,0,1]=4 1892 B6R0.4 CC(C)CSCCl MCULE-5218455619 [0,1,0,0,0,0|2,0,1]=4 1893 B6R0.4 CC(C)NCCCl MCULE-1521398137 [0,1,0,0,0,0|2,0,1]=4 1894 B6R0.4 CC(C)NCCCl MCULE-2586914937 [0,1,0,0,0,0|2,0,1]=4 1895 B6R0.4 CC(C)NCCN MCULE-1003086359 [0,1,0,0,0,0|2,0,1]=4 1896 B6R0.4 CC(C)NCCN MCULE-5066931507 [0,1,0,0,0,0|2,0,1]=4 1897 B6R0.4 CC(C)NCCO MCULE-1749029105 [0,1,0,0,0,0|1,0,1]=3 1898 B6R0.4 CC(C)OCCBr MCULE-8869065375 [0,1,0,0,0,0|2,0,1]=4 1899 B6R0.4 CC(C)OCCCl MCULE-3848763715 [0,1,0,0,0,0|2,0,1]=4 1900 B6R0.4 CC(C)OCCI MCULE-8259612531 [0,1,0,0,0,0|2,0,1]=4 1901 B6R0.4 CC(C)OCCN MCULE-6140628944 [0,1,0,0,0,0|2,0,1]=4 1902 B6R0.4 CC(C)OCCN MCULE-7438591135 [0,1,0,0,0,0|2,0,1]=4 1903 B6R0.4 CC(C)OCCN MCULE-7614115649 [0,1,0,0,0,0|2,0,1]=4 1904 B6R0.4 CC(C)OCCO MCULE-8766149613 [0,1,0,0,0,0|1,0,1]=3 1905 B6R0.4 CC(C)SCCCl MCULE-4991548042 [0,1,0,0,0,0|2,0,1]=4 1906 B6R0.4 CC(C)SCCN MCULE-2838203545 [0,1,0,0,0,0|2,0,1]=4 1907 B6R0.4 CC(C)SCCN MCULE-6551225219 [0,1,0,0,0,0|2,0,1]=4 1908 B6R0.4 CC(C)SCCO MCULE-1467015400 [0,1,0,0,0,0|1,0,1]=3 1909 B6R0.4 CC(Cl)CCC#N MCULE-2064174419 [0,1,0,0,0,0|2,0,1]=4 1910 B6R0.4 CC(Cl)CCCCl MCULE-9382073752 [0,1,0,0,0,0|2,0,1]=4 1911 B6R0.4 CC(Cl)CCCO MCULE-2554250532 [0,1,0,0,0,0|1,0,1]=3 1912 B6R0.4 CC(N)CCCN MCULE-4857113826 [0,1,0,0,0,0|2,0,1]=4 1913 B6R0.4 CC(N)CCCN MCULE-4899798325 [0,1,0,0,0,0|2,0,1]=4 1914 B6R0.4 CC(N)CCCO MCULE-6629535696 [0,1,0,0,0,0|1,0,1]=3 1915 B6R0.4 CC(O)CCC#N MCULE-6350143710 [0,1,0,0,0,0|1,0,2]=4 1916 B6R0.4 CC(O)CCCBr MCULE-5477662754 [0,1,0,0,0,0|1,0,2]=4 1917 B6R0.4 CC(O)CCCCl MCULE-6993728810 [0,1,0,0,0,0|1,0,2]=4 1918 B6R0.4 CC(O)CCCN MCULE-3754805134 [0,1,0,0,0,0|1,0,2]=4 1919 B6R0.4 CC(O)CCCO MCULE-6580326052 [0,1,0,0,0,0|0,0,2]=3 1920 B6R0.4 CC/C=C/C(=O)Cl MCULE-8929214872 [0,1,0,0,0,0|2,0,1]=4 1921 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [0,1,0,0,0,0|2,0,1]=4 1922 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [0,1,0,0,0,0|2,0,1]=4 1923 B6R0.4 CCC#CC(=O)C MCULE-7788224704 [0,1,0,0,0,0|1,0,1]=3 1924 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [0,1,0,0,0,0|2,0,1]=4 1925 B6R0.4 CCC=CC(=O)C MCULE-2986269826 [0,1,0,0,0,0|1,0,1]=3 1926 B6R0.4 CCC=CC(=O)Cl MCULE-5159865849 [0,1,0,0,0,0|2,0,1]=4 1927 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [0,1,0,0,0,0|2,0,1]=4 1928 B6R0.4 CCCC=C(C)C MCULE-2110588796 [0,1,0,0,0,0|2,0,0]=3 1929 B6R0.4 CCCCC(=N)N MCULE-3271993509 [0,1,0,0,0,0|3,0,0]=4 1930 B6R0.4 CCCCC(=N)N MCULE-3935017760 [0,1,0,0,0,0|3,0,0]=4 1931 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [0,1,0,0,0,0|2,0,0]=3 1932 B6R0.4 CCCCC(=O)C MCULE-3554390184 [0,1,0,0,0,0|1,0,0]=2 1933 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [0,1,0,0,0,0|2,0,0]=3 1934 B6R0.4 CCCCC(=O)N MCULE-6419483436 [0,1,0,0,0,0|2,0,0]=3 1935 B6R0.4 CCCCC(=O)O MCULE-2333640078 [0,1,0,0,0,0|2,0,0]=3 1936 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [0,1,0,0,0,0|2,0,0]=3 1937 B6R0.4 CCCCC(=S)N MCULE-8236760762 [0,1,0,0,0,0|2,1,0]=4 1938 B6R0.4 CCCCC(C)Br MCULE-3252474574 [0,1,0,0,0,0|2,0,1]=4 1939 B6R0.4 CCCCC(C)C MCULE-7568461039 [0,1,0,0,0,0|2,0,1]=4 1940 B6R0.4 CCCCC(C)Cl MCULE-4825682003 [0,1,0,0,0,0|2,0,1]=4 1941 B6R0.4 CCCCC(C)N MCULE-5349371506 [0,1,0,0,0,0|2,0,1]=4 1942 B6R0.4 CCCCC(C)N MCULE-6696490028 [0,1,0,0,0,0|2,0,1]=4 1943 B6R0.4 CCCCC(C)O MCULE-6558228722 [0,1,0,0,0,0|1,0,2]=4 1944 B6R0.4 CCCCC(C)S MCULE-4791681848 [0,1,0,0,0,0|1,1,1]=4 1945 B6R0.4 CCCCN(=O)=O MCULE-7679767771 [0,1,0,0,0,0|3,0,0]=4 1946 B6R0.4 CCCCN(C)C MCULE-7202077639 [0,1,0,0,0,0|3,0,0]=4 1947 B6R0.4 CCCCN(C)N MCULE-7927159797 [0,1,0,0,0,0|3,0,0]=4 1948 B6R0.4 CCCCS(=O)[O-] MCULE-4347348762 [0,1,0,0,0,0|3,0,0]=4 1949 B6R0.4 CCCCS(=O)[O-] MCULE-8153578421 [0,1,0,0,0,0|3,0,0]=4 1950 B6R0.4 CCCC[C@@H](C)N MCULE-2673058676 [0,1,0,0,0,0|2,0,1]=4 1951 B6R0.4 CCCC[C@@H](C)N MCULE-7666196055 [0,1,0,0,0,0|2,0,1]=4 1952 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [0,1,0,0,0,0|1,0,2]=4 1953 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [0,1,0,0,0,0|1,0,2]=4 1954 B6R0.4 CCCC[C@H](C)N MCULE-6212068145 [0,1,0,0,0,0|2,0,1]=4 1955 B6R0.4 CCCC[C@H](C)N MCULE-7818513999 [0,1,0,0,0,0|2,0,1]=4 1956 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [0,1,0,0,0,0|1,0,2]=4 1957 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [0,1,0,0,0,0|1,0,2]=4 1958 B6R0.4 CCCNC(=N)N MCULE-6381843991 [0,1,0,0,0,0|3,0,0]=4 1959 B6R0.4 CCCNC(=N)N MCULE-8286774592 [0,1,0,0,0,0|3,0,0]=4 1960 B6R0.4 CCCNC(=O)C MCULE-5899703886 [0,1,0,0,0,0|1,0,0]=2 1961 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [0,1,0,0,0,0|2,0,0]=3 1962 B6R0.4 CCCNC(=O)N MCULE-8528844765 [0,1,0,0,0,0|2,0,0]=3 1963 B6R0.4 CCCNC(=S)N MCULE-3142756488 [0,1,0,0,0,0|2,1,0]=4 1964 B6R0.4 CCCNC(C)C MCULE-7475023734 [0,1,0,0,0,0|2,0,1]=4 1965 B6R0.4 CCCOC(=O)C MCULE-7327042566 [0,1,0,0,0,0|1,0,0]=2 1966 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [0,1,0,0,0,0|2,0,0]=3 1967 B6R0.4 CCCOC(=O)N MCULE-2760622567 [0,1,0,0,0,0|2,0,0]=3 1968 B6R0.4 CCCOC(=S)[S-] MCULE-9126934993 [0,1,0,0,0,0|2,1,0]=4 1969 B6R0.4 CCCOC(=S)[S-] MCULE-9566804941 [0,1,0,0,0,0|2,1,0]=4 1970 B6R0.4 CCCON(=O)=O MCULE-3372904250 [0,1,0,0,0,0|3,0,0]=4 1971 B6R0.4 CCCSC(=N)N MCULE-4777505658 [0,1,0,0,0,0|3,0,0]=4 1972 B6R0.4 CCCSC(=N)N MCULE-8873393921 [0,1,0,0,0,0|3,0,0]=4 1973 B6R0.4 CCCSC(=O)C MCULE-4329646671 [0,1,0,0,0,0|1,0,0]=2 1974 B6R0.4 CCCSC(=O)Cl MCULE-5971141999 [0,1,0,0,0,0|2,0,0]=3 1975 B6R0.4 CCCSC(=[NH2+])N MCULE-6759252204 [0,1,0,0,0,0|3,0,0]=4 1976 B6R0.4 CCCSC(C)C MCULE-2233656285 [0,1,0,0,0,0|2,0,1]=4 1977 B6R0.4 CCNCC(=O)C MCULE-5799315547 [0,1,0,0,0,0|1,0,0]=2 1978 B6R0.4 CCNCC(=O)C MCULE-9258294157 [0,1,0,0,0,0|1,0,0]=2 1979 B6R0.4 CCNCC(=O)N MCULE-1787248899 [0,1,0,0,0,0|2,0,0]=3 1980 B6R0.4 CCNCC(=O)N MCULE-3821700273 [0,1,0,0,0,0|2,0,0]=3 1981 B6R0.4 CCNCC(=O)O MCULE-5989480216 [0,1,0,0,0,0|2,0,0]=3 1982 B6R0.4 CCNCC(=O)O MCULE-8087863397 [0,1,0,0,0,0|2,0,0]=3 1983 B6R0.4 CCNCC(C)C MCULE-1625905125 [0,1,0,0,0,0|2,0,1]=4 1984 B6R0.4 CCNCC(C)C MCULE-3527739859 [0,1,0,0,0,0|2,0,1]=4 1985 B6R0.4 CCNCC(C)O MCULE-5078068369 [0,1,0,0,0,0|1,0,2]=4 1986 B6R0.4 CCNC[C@@H](C)O MCULE-4291219061 [0,1,0,0,0,0|1,0,2]=4 1987 B6R0.4 CCNC[C@@H](C)O MCULE-8603386701 [0,1,0,0,0,0|1,0,2]=4 1988 B6R0.4 CCNC[C@H](C)O MCULE-7173470231 [0,1,0,0,0,0|1,0,2]=4 1989 B6R0.4 CCNC[C@H](C)O MCULE-9651301254 [0,1,0,0,0,0|1,0,2]=4 1990 B6R0.4 CCOCC(=N)N MCULE-3232806707 [0,1,0,0,0,0|3,0,0]=4 1991 B6R0.4 CCOCC(=N)N MCULE-4996987536 [0,1,0,0,0,0|3,0,0]=4 1992 B6R0.4 CCOCC(=O)C MCULE-2825677443 [0,1,0,0,0,0|1,0,0]=2 1993 B6R0.4 CCOCC(=O)Cl MCULE-2172268229 [0,1,0,0,0,0|2,0,0]=3 1994 B6R0.4 CCOCC(=O)O MCULE-1726530898 [0,1,0,0,0,0|2,0,0]=3 1995 B6R0.4 CCOCC(=S)N MCULE-7064672670 [0,1,0,0,0,0|2,1,0]=4 1996 B6R0.4 CCOCC(C)C MCULE-7986128672 [0,1,0,0,0,0|2,0,1]=4 1997 B6R0.4 CCOCC(C)N MCULE-8540668261 [0,1,0,0,0,0|2,0,1]=4 1998 B6R0.4 CCOCC(C)N MCULE-8720228996 [0,1,0,0,0,0|2,0,1]=4 1999 B6R0.4 CCOCC(C)O MCULE-6224339526 [0,1,0,0,0,0|1,0,2]=4 2000 B6R0.4 CCOC[C@@H](C)N MCULE-7053460047 [0,1,0,0,0,0|2,0,1]=4 2001 B6R0.4 CCOC[C@@H](C)N MCULE-9865800502 [0,1,0,0,0,0|2,0,1]=4 2002 B6R0.4 CCOC[C@@H](C)O MCULE-9075407512 [0,1,0,0,0,0|1,0,2]=4 2003 B6R0.4 CCOC[C@H](C)N MCULE-2897416804 [0,1,0,0,0,0|2,0,1]=4 2004 B6R0.4 CCOC[C@H](C)N MCULE-6799267946 [0,1,0,0,0,0|2,0,1]=4 2005 B6R0.4 CCSCC(=O)C MCULE-9872082780 [0,1,0,0,0,0|1,0,0]=2 2006 B6R0.4 CCSCC(=O)O MCULE-7471335718 [0,1,0,0,0,0|2,0,0]=3 2007 B6R0.4 CCSCC(C)N MCULE-3399255190 [0,1,0,0,0,0|2,0,1]=4 2008 B6R0.4 CN(C)CCC#N MCULE-8979604677 [0,1,0,0,0,0|3,0,0]=4 2009 B6R0.4 CN(C)CCC=O MCULE-6830649526 [0,1,0,0,0,0|2,0,1]=4 2010 B6R0.4 CN(C)CCCBr MCULE-2862944726 [0,1,0,0,0,0|3,0,0]=4 2011 B6R0.4 CN(C)CCCBr MCULE-4596026048 [0,1,0,0,0,0|3,0,0]=4 2012 B6R0.4 CN(C)CCCBr MCULE-7515880350 [0,1,0,0,0,0|3,0,0]=4 2013 B6R0.4 CN(C)CCCCl MCULE-1347366200 [0,1,0,0,0,0|3,0,0]=4 2014 B6R0.4 CN(C)CCCCl MCULE-3767329555 [0,1,0,0,0,0|3,0,0]=4 2015 B6R0.4 CN(C)CCCI MCULE-2134226049 [0,1,0,0,0,0|3,0,0]=4 2016 B6R0.4 CN(C)CCCI MCULE-2999516061 [0,1,0,0,0,0|3,0,0]=4 2017 B6R0.4 CN(C)CCCN MCULE-3882436382 [0,1,0,0,0,0|3,0,0]=4 2018 B6R0.4 CN(C)CCCN MCULE-4415270662 [0,1,0,0,0,0|3,0,0]=4 2019 B6R0.4 CN(C)CCCN MCULE-4624916051 [0,1,0,0,0,0|3,0,0]=4 2020 B6R0.4 CN(C)CCCN MCULE-4749435878 [0,1,0,0,0,0|3,0,0]=4 2021 B6R0.4 CN(C)CCCN MCULE-9301668058 [0,1,0,0,0,0|3,0,0]=4 2022 B6R0.4 CN(C)CCCO MCULE-7408728427 [0,1,0,0,0,0|2,0,0]=3 2023 B6R0.4 CN(C)CCCS MCULE-7945161812 [0,1,0,0,0,0|2,1,0]=4 2024 B6R0.4 CN(C)CCNN MCULE-5321668174 [0,1,0,0,0,0|3,0,0]=4 2025 B6R0.4 CN(C)CCNN MCULE-6578987911 [0,1,0,0,0,0|3,0,0]=4 2026 B6R0.4 CN(C)CCON MCULE-1981169712 [0,1,0,0,0,0|2,0,0]=3 2027 B6R0.4 CN(C)CCON MCULE-6706970282 [0,1,0,0,0,0|2,0,0]=3 2028 B6R0.4 CN(C)NCCCl MCULE-2462354397 [0,1,0,0,0,0|3,0,0]=4 2029 B6R0.4 CN(C)NCCCl MCULE-7933853049 [0,1,0,0,0,0|3,0,0]=4 2030 B6R0.4 CNCCC(=O)N MCULE-1118876220 [0,1,0,0,0,0|2,0,0]=3 2031 B6R0.4 CNCCC(=O)N MCULE-6679713144 [0,1,0,0,0,0|2,0,0]=3 2032 B6R0.4 CNCCC(=O)O MCULE-3627988097 [0,1,0,0,0,0|2,0,0]=3 2033 B6R0.4 CNCCC(=O)O MCULE-9858204248 [0,1,0,0,0,0|2,0,0]=3 2034 B6R0.4 CNCCC(C)C MCULE-3679914556 [0,1,0,0,0,0|2,0,1]=4 2035 B6R0.4 CNCCC(C)C MCULE-9679972004 [0,1,0,0,0,0|2,0,1]=4 2036 B6R0.4 CNCCC(C)N MCULE-5955505029 [0,1,0,0,0,0|2,0,1]=4 2037 B6R0.4 CNCCC(C)N MCULE-8933967952 [0,1,0,0,0,0|2,0,1]=4 2038 B6R0.4 CNCCC(C)O MCULE-1615526002 [0,1,0,0,0,0|1,0,2]=4 2039 B6R0.4 CNCCN(C)C MCULE-3324857553 [0,1,0,0,0,0|3,0,0]=4 2040 B6R0.4 CNCCN(C)C MCULE-8014008412 [0,1,0,0,0,0|3,0,0]=4 2041 B6R0.4 CNCCN(C)C MCULE-9954339750 [0,1,0,0,0,0|3,0,0]=4 2042 B6R0.4 CNCC[C@@H](C)N MCULE-6024494304 [0,1,0,0,0,0|2,0,1]=4 2043 B6R0.4 CNCC[C@H](C)N MCULE-5449372796 [0,1,0,0,0,0|2,0,1]=4 2044 B6R0.4 CNCC[C@H](C)N MCULE-8157402351 [0,1,0,0,0,0|2,0,1]=4 2045 B6R0.4 CO/C=C/C(=O)C MCULE-1215649803 [0,1,0,0,0,0|0,0,2]=3 2046 B6R0.4 CO/C=C/C(=O)O MCULE-3681049176 [0,1,0,0,0,0|1,0,2]=4 2047 B6R0.4 COC=CC(=O)C MCULE-4868833764 [0,1,0,0,0,0|0,0,2]=3 2048 B6R0.4 COC=CC(=O)Cl MCULE-4966577139 [0,1,0,0,0,0|1,0,2]=4 2049 B6R0.4 COC=CC(=O)O MCULE-4252899122 [0,1,0,0,0,0|1,0,2]=4 2050 B6R0.4 COCCC(=N)N MCULE-8118559492 [0,1,0,0,0,0|2,0,0]=3 2051 B6R0.4 COCCC(=N)N MCULE-9000138086 [0,1,0,0,0,0|2,0,0]=3 2052 B6R0.4 COCCC(=O)C MCULE-5939812376 [0,1,0,0,0,0|0,0,0]=1 2053 B6R0.4 COCCC(=O)Cl MCULE-9454266286 [0,1,0,0,0,0|1,0,0]=2 2054 B6R0.4 COCCC(=O)N MCULE-7556483675 [0,1,0,0,0,0|1,0,0]=2 2055 B6R0.4 COCCC(=O)O MCULE-3436347115 [0,1,0,0,0,0|1,0,0]=2 2056 B6R0.4 COCCC(C)Br MCULE-6529807745 [0,1,0,0,0,0|1,0,1]=3 2057 B6R0.4 COCCC(C)C MCULE-8727768886 [0,1,0,0,0,0|1,0,1]=3 2058 B6R0.4 COCCC(C)N MCULE-6183216923 [0,1,0,0,0,0|1,0,1]=3 2059 B6R0.4 COCCC(C)O MCULE-6536001437 [0,1,0,0,0,0|0,0,2]=3 2060 B6R0.4 COCCN(C)C MCULE-5323166567 [0,1,0,0,0,0|2,0,0]=3 2061 B6R0.4 COCCN(C)N MCULE-9480733049 [0,1,0,0,0,0|2,0,0]=3 2062 B6R0.4 COCC[C@H](C)N MCULE-6163336851 [0,1,0,0,0,0|1,0,1]=3 2063 B6R0.4 COCC[C@H](C)N MCULE-6363449253 [0,1,0,0,0,0|1,0,1]=3 2064 B6R0.4 COCNC(=O)N MCULE-8367032240 [0,1,0,0,0,0|2,0,0]=3 2065 B6R0.4 COCOC(=O)C MCULE-8876091916 [0,1,0,0,0,0|1,0,0]=2 2066 B6R0.4 CON=CC(=O)O MCULE-6800819509 [0,1,0,0,0,0|2,0,1]=4 2067 B6R0.4 CS(=O)CCCN MCULE-1124989526 [0,1,0,0,0,0|2,0,0]=3 2068 B6R0.4 CS(=O)CCCN MCULE-8758903495 [0,1,0,0,0,0|2,0,0]=3 2069 B6R0.4 CSCCC(=N)N MCULE-3926353306 [0,1,0,0,0,0|2,1,0]=4 2070 B6R0.4 CSCCC(=N)N MCULE-4451485733 [0,1,0,0,0,0|2,1,0]=4 2071 B6R0.4 CSCCC(=O)C MCULE-6178663156 [0,1,0,0,0,0|0,1,0]=2 2072 B6R0.4 CSCCC(=O)Cl MCULE-9732512141 [0,1,0,0,0,0|1,1,0]=3 2073 B6R0.4 CSCCC(=O)N MCULE-7105035733 [0,1,0,0,0,0|1,1,0]=3 2074 B6R0.4 CSCCC(=O)O MCULE-9550032941 [0,1,0,0,0,0|1,1,0]=3 2075 B6R0.4 CSCCC(C)N MCULE-3925048385 [0,1,0,0,0,0|1,1,1]=4 2076 B6R0.4 CSCCC(C)O MCULE-5934844952 [0,1,0,0,0,0|0,1,2]=4 2077 B6R0.4 CSCCN(C)C MCULE-2148124964 [0,1,0,0,0,0|2,1,0]=4 2078 B6R0.4 CSCCN(C)C MCULE-5176242697 [0,1,0,0,0,0|2,1,0]=4 2079 B6R0.4 CSCOC(=O)C MCULE-1498769347 [0,1,0,0,0,0|1,1,0]=3 2080 B6R0.4 CSSCC(=O)O MCULE-5829510166 [0,1,0,0,0,0|2,1,0]=4 2081 B6R0.4 C[C@@H](N)CCCO MCULE-8313291415 [0,1,0,0,0,0|1,0,1]=3 2082 B6R0.4 C[C@@H](O)CCCO MCULE-1658231016 [0,1,0,0,0,0|0,0,2]=3 2083 B6R0.4 FC(=CCCBr)F MCULE-2616028843 [0,1,0,0,0,0|3,0,0]=4 2084 B6R0.4 FC(=CCCCl)F MCULE-2193644602 [0,1,0,0,0,0|3,0,0]=4 2085 B6R0.4 N#CCCC(=O)O MCULE-3165189228 [0,1,0,0,0,0|2,0,0]=3 2086 B6R0.4 N#CCNC(=O)N MCULE-9927791118 [0,1,0,0,0,0|2,0,1]=4 2087 B6R0.4 N#C[Se]CC(=O)O MCULE-1382907788 [0,1,0,0,0,0|2,0,1]=4 2088 B6R0.4 N#C[Se]CC(=O)[O-] MCULE-6957286300 [0,1,0,0,0,0|2,0,1]=4 2089 B6R0.4 N#N=NCC(=O)N MCULE-8839477322 [0,1,0,0,0,0|3,0,0]=4 2090 B6R0.4 N#N=NCC(=O)O MCULE-3031425162 [0,1,0,0,0,0|3,0,0]=4 2091 B6R0.4 N=C(N)NCCO MCULE-5114367892 [0,1,0,0,0,0|2,0,0]=3 2092 B6R0.4 N=C(N)NCCO MCULE-6389092248 [0,1,0,0,0,0|2,0,0]=3 2093 B6R0.4 N=C(N)NCCS MCULE-1108122235 [0,1,0,0,0,0|2,1,0]=4 2094 B6R0.4 N=C(N)NCCS MCULE-1842583721 [0,1,0,0,0,0|2,1,0]=4 2095 B6R0.4 N=C(N)NCCS MCULE-4497722042 [0,1,0,0,0,0|2,1,0]=4 2096 B6R0.4 N=C(N)NCCS MCULE-6123443321 [0,1,0,0,0,0|2,1,0]=4 2097 B6R0.4 N=C(N)SCCN MCULE-1482556327 [0,1,0,0,0,0|3,0,0]=4 2098 B6R0.4 N=C(N)SCCO MCULE-5563309692 [0,1,0,0,0,0|2,0,0]=3 2099 B6R0.4 N=C(N)SCCO MCULE-5671847690 [0,1,0,0,0,0|2,0,0]=3 2100 B6R0.4 NC(=NCCO)N MCULE-5043697998 [0,1,0,0,0,0|2,0,0]=3 2101 B6R0.4 NC(=NCCS)N MCULE-4111802244 [0,1,0,0,0,0|2,1,0]=4 2102 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [0,1,0,0,0,0|2,0,0]=3 2103 B6R0.4 NC(=O)CCCO MCULE-3779341561 [0,1,0,0,0,0|1,0,0]=2 2104 B6R0.4 NC(=O)CN=C=S MCULE-1111706944 [0,1,0,0,0,0|1,1,1]=4 2105 B6R0.4 NC(=O)NCCCl MCULE-6117142945 [0,1,0,0,0,0|2,0,0]=3 2106 B6R0.4 NC(=O)NCCF MCULE-9526714989 [0,1,0,0,0,0|2,0,0]=3 2107 B6R0.4 NC(=O)NCCO MCULE-2353513655 [0,1,0,0,0,0|1,0,0]=2 2108 B6R0.4 NC(=O)OCCCl MCULE-4259077420 [0,1,0,0,0,0|2,0,0]=3 2109 B6R0.4 NC(=O)OCCO MCULE-7565460845 [0,1,0,0,0,0|1,0,0]=2 2110 B6R0.4 NC(=S)CCCO MCULE-8951145487 [0,1,0,0,0,0|1,1,0]=3 2111 B6R0.4 NC(=S)NCCO MCULE-9343742573 [0,1,0,0,0,0|1,1,0]=3 2112 B6R0.4 NC/C=C/C(=O)O MCULE-1249244912 [0,1,0,0,0,0|2,0,1]=4 2113 B6R0.4 NCC#CC(=O)O MCULE-8511125702 [0,1,0,0,0,0|2,0,1]=4 2114 B6R0.4 NCC=CC(=O)O MCULE-3049811576 [0,1,0,0,0,0|2,0,1]=4 2115 B6R0.4 NCC=CC(=O)O MCULE-5171717036 [0,1,0,0,0,0|2,0,1]=4 2116 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [0,1,0,0,0,0|2,0,0]=3 2117 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [0,1,0,0,0,0|2,0,0]=3 2118 B6R0.4 NCCCC(=O)N MCULE-8039142092 [0,1,0,0,0,0|2,0,0]=3 2119 B6R0.4 NCCCC(=O)N MCULE-8262250872 [0,1,0,0,0,0|2,0,0]=3 2120 B6R0.4 NCCCC(=O)O MCULE-3615304273 [0,1,0,0,0,0|2,0,0]=3 2121 B6R0.4 NCCCC(=O)O MCULE-7613134021 [0,1,0,0,0,0|2,0,0]=3 2122 B6R0.4 NCCNC(=O)N MCULE-1197396950 [0,1,0,0,0,0|2,0,0]=3 2123 B6R0.4 NCCNC(=O)N MCULE-2171700183 [0,1,0,0,0,0|2,0,0]=3 2124 B6R0.4 NCCNC(=O)N MCULE-3799764813 [0,1,0,0,0,0|2,0,0]=3 2125 B6R0.4 NCCNC(=S)N MCULE-7473616024 [0,1,0,0,0,0|2,1,0]=4 2126 B6R0.4 NCCNC(=S)N MCULE-7947010145 [0,1,0,0,0,0|2,1,0]=4 2127 B6R0.4 NCCOC(=O)N MCULE-4144808257 [0,1,0,0,0,0|2,0,0]=3 2128 B6R0.4 NCCOC(=O)N MCULE-5815053840 [0,1,0,0,0,0|2,0,0]=3 2129 B6R0.4 NCCON(=O)=O MCULE-1660868950 [0,1,0,0,0,0|3,0,0]=4 2130 B6R0.4 NCCON(=O)=O MCULE-5781896981 [0,1,0,0,0,0|3,0,0]=4 2131 B6R0.4 NOCCC(=O)O MCULE-1529492904 [0,1,0,0,0,0|1,0,0]=2 2132 B6R0.4 NOCCC(=O)O MCULE-6297331357 [0,1,0,0,0,0|1,0,0]=2 2133 B6R0.4 O=C(Cl)CCCBr MCULE-1389049838 [0,1,0,0,0,0|2,0,0]=3 2134 B6R0.4 O=C(Cl)CCCCl MCULE-5885932072 [0,1,0,0,0,0|2,0,0]=3 2135 B6R0.4 O=C(Cl)OCCBr MCULE-6758010852 [0,1,0,0,0,0|2,0,0]=3 2136 B6R0.4 O=C(Cl)OCCCl MCULE-1505786385 [0,1,0,0,0,0|2,0,0]=3 2137 B6R0.4 O=C(Cl)OCCF MCULE-5233366139 [0,1,0,0,0,0|2,0,0]=3 2138 B6R0.4 O=C(O)/C=C/CBr MCULE-2012997584 [0,1,0,0,0,0|2,0,1]=4 2139 B6R0.4 O=C(O)/C=C/CCl MCULE-5651159998 [0,1,0,0,0,0|2,0,1]=4 2140 B6R0.4 O=C(O)/C=C/CO MCULE-1612823053 [0,1,0,0,0,0|1,0,1]=3 2141 B6R0.4 O=C(O)C#CCCl MCULE-6341675394 [0,1,0,0,0,0|2,0,1]=4 2142 B6R0.4 O=C(O)C#CCF MCULE-8744045229 [0,1,0,0,0,0|2,0,1]=4 2143 B6R0.4 O=C(O)C#CCO MCULE-1849362182 [0,1,0,0,0,0|1,0,1]=3 2144 B6R0.4 O=C(O)C=CCBr MCULE-3029375430 [0,1,0,0,0,0|2,0,1]=4 2145 B6R0.4 O=C(O)C=CCCl MCULE-1050913038 [0,1,0,0,0,0|2,0,1]=4 2146 B6R0.4 O=C(O)C=CCO MCULE-3375515425 [0,1,0,0,0,0|1,0,1]=3 2147 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [0,1,0,0,0,0|2,0,0]=3 2148 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [0,1,0,0,0,0|2,0,0]=3 2149 B6R0.4 O=C(O)CCCF MCULE-2415675768 [0,1,0,0,0,0|2,0,0]=3 2150 B6R0.4 O=C(O)CCCI MCULE-7794841553 [0,1,0,0,0,0|2,0,0]=3 2151 B6R0.4 O=C(O)CCCS MCULE-3352840152 [0,1,0,0,0,0|1,1,0]=3 2152 B6R0.4 O=C(O)CNCO MCULE-4092998319 [0,1,0,0,0,0|1,0,0]=2 2153 B6R0.4 O=C([O-])CCCCl MCULE-4131322715 [0,1,0,0,0,0|2,0,0]=3 2154 B6R0.4 O=C([O-])CNCO MCULE-2804068565 [0,1,0,0,0,0|1,0,0]=2 2155 B6R0.4 O=C([O-])C[N+]#C[K] MCULE-7657836645 [0,1,0,0,0,0|2,0,1]=4 2156 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [0,1,0,0,0,0|1,0,1]=3 2157 B6R0.4 O=CCCN(=O)=O MCULE-3692892497 [0,1,0,0,0,0|2,0,1]=4 2158 B6R0.4 O=CNCC(=O)O MCULE-3251128290 [0,1,0,0,0,0|1,0,2]=4 2159 B6R0.4 O=N(=O)CCCBr MCULE-7541604704 [0,1,0,0,0,0|3,0,0]=4 2160 B6R0.4 O=N(=O)CCCCl MCULE-3635255631 [0,1,0,0,0,0|3,0,0]=4 2161 B6R0.4 O=N(=O)CCCO MCULE-5021681032 [0,1,0,0,0,0|2,0,0]=3 2162 B6R0.4 OCCCC(F)F MCULE-2972867290 [0,1,0,0,0,0|2,0,1]=4 2163 B6R0.4 OCCOC(F)F MCULE-6004830165 [0,1,0,0,0,0|2,0,1]=4 2164 B6R0.4 P(=O)([O-])OCCC MCULE-3877591764 [0,1,0,0,0,0|3,0,0]=4 2165 B6R0.4 [NH2+]=C(N)SCC[NH3+] MCULE-2799536411 [0,1,0,0,0,0|3,0,0]=4 2166 B6R0.5 C#CCS(=O)(=O)C MCULE-8710940034 [0,1,0,0,0,0|2,0,1]=4 2167 B6R0.5 C=CCS(=O)(=O)C MCULE-8490929862 [0,1,0,0,0,0|2,0,1]=4 2168 B6R0.5 CC(C)(Br)CCBr MCULE-9461856185 [0,1,0,0,0,0|2,0,1]=4 2169 B6R0.5 CC(C)(C)CCBr MCULE-6591692767 [0,1,0,0,0,0|2,0,1]=4 2170 B6R0.5 CC(C)(C)CCCl MCULE-6806888253 [0,1,0,0,0,0|2,0,1]=4 2171 B6R0.5 CC(C)(C)CCI MCULE-5455265220 [0,1,0,0,0,0|2,0,1]=4 2172 B6R0.5 CC(C)(C)CCN MCULE-6905943138 [0,1,0,0,0,0|2,0,1]=4 2173 B6R0.5 CC(C)(C)CCN MCULE-9954564734 [0,1,0,0,0,0|2,0,1]=4 2174 B6R0.5 CC(C)(C)CCO MCULE-3121776589 [0,1,0,0,0,0|1,0,1]=3 2175 B6R0.5 CC(C)(Cl)CCCl MCULE-1702128758 [0,1,0,0,0,0|2,0,1]=4 2176 B6R0.5 CC(C)(F)CCN MCULE-8439738647 [0,1,0,0,0,0|2,0,1]=4 2177 B6R0.5 CC(C)(F)CCN MCULE-9182730805 [0,1,0,0,0,0|2,0,1]=4 2178 B6R0.5 CC(C)(F)CCO MCULE-7157649991 [0,1,0,0,0,0|1,0,1]=3 2179 B6R0.5 CC(C)(I)CCO MCULE-2114317591 [0,1,0,0,0,0|1,0,1]=3 2180 B6R0.5 CC(C)(N)CCN MCULE-3524950958 [0,1,0,0,0,0|2,0,1]=4 2181 B6R0.5 CC(C)(N)CCN MCULE-9689616736 [0,1,0,0,0,0|2,0,1]=4 2182 B6R0.5 CC(C)(N)CCO MCULE-2300724181 [0,1,0,0,0,0|1,0,1]=3 2183 B6R0.5 CC(C)(N)CCO MCULE-7470688556 [0,1,0,0,0,0|1,0,1]=3 2184 B6R0.5 CC(C)(O)CCBr MCULE-5311251278 [0,1,0,0,0,0|1,0,2]=4 2185 B6R0.5 CC(C)(O)CCCl MCULE-2803507835 [0,1,0,0,0,0|1,0,2]=4 2186 B6R0.5 CC(C)(O)CCI MCULE-1822716730 [0,1,0,0,0,0|1,0,2]=4 2187 B6R0.5 CC(C)(O)CCN MCULE-1233177150 [0,1,0,0,0,0|1,0,2]=4 2188 B6R0.5 CC(C)(O)CCO MCULE-4723950851 [0,1,0,0,0,0|0,0,2]=3 2189 B6R0.5 CC(C)(O)CCS MCULE-5161173776 [0,1,0,0,0,0|0,1,2]=4 2190 B6R0.5 CC(C)(S)CCO MCULE-6218278668 [0,1,0,0,0,0|0,1,1]=3 2191 B6R0.5 CC(F)(F)CCBr MCULE-1559219051 [0,1,0,0,0,0|2,0,1]=4 2192 B6R0.5 CC(F)(F)CCN MCULE-2380721562 [0,1,0,0,0,0|2,0,1]=4 2193 B6R0.5 CC(F)(F)CCN MCULE-9299707465 [0,1,0,0,0,0|2,0,1]=4 2194 B6R0.5 CC(F)(F)CCO MCULE-6983720400 [0,1,0,0,0,0|1,0,1]=3 2195 B6R0.5 CCCC(C)(C)C MCULE-2309229328 [0,1,0,0,0,0|2,0,1]=4 2196 B6R0.5 CCCC(C)(C)Cl MCULE-1426018824 [0,1,0,0,0,0|2,0,1]=4 2197 B6R0.5 CCCC(C)(C)N MCULE-2670535144 [0,1,0,0,0,0|2,0,1]=4 2198 B6R0.5 CCCC(C)(C)N MCULE-4533125677 [0,1,0,0,0,0|2,0,1]=4 2199 B6R0.5 CCCC(C)(C)O MCULE-2647276101 [0,1,0,0,0,0|1,0,2]=4 2200 B6R0.5 CCCP(=O)(O)O MCULE-3928382731 [0,1,0,0,0,0|3,0,0]=4 2201 B6R0.5 CCCS(=O)(=O)Cl MCULE-4980552385 [0,1,0,0,0,0|3,0,0]=4 2202 B6R0.5 CCCS(=O)(=O)F MCULE-7811564151 [0,1,0,0,0,0|3,0,0]=4 2203 B6R0.5 CCCS(=O)(=O)N MCULE-1554874611 [0,1,0,0,0,0|3,0,0]=4 2204 B6R0.5 CCCS(=O)(=O)O MCULE-5213264344 [0,1,0,0,0,0|3,0,0]=4 2205 B6R0.5 CCCS(=O)(=O)[O-] MCULE-5970988364 [0,1,0,0,0,0|3,0,0]=4 2206 B6R0.5 CCC[N+](C)(C)C MCULE-4840113179 [0,1,0,0,0,0|3,0,0]=4 2207 B6R0.5 CCC[N+](C)(C)C MCULE-6374165176 [0,1,0,0,0,0|3,0,0]=4 2208 B6R0.5 CCC[N+](C)(C)C MCULE-6861938722 [0,1,0,0,0,0|3,0,0]=4 2209 B6R0.5 CCC[Si](C)(C)Cl MCULE-2174562638 [0,1,0,0,0,0|2,1,0]=4 2210 B6R0.5 CCC[Si](C)(Cl)Cl MCULE-9758606777 [0,1,0,0,0,0|2,1,0]=4 2211 B6R0.5 CCNS(=O)(=O)C MCULE-7880259383 [0,1,0,0,0,0|3,0,0]=4 2212 B6R0.5 CCOP(=O)(C)S MCULE-4864782374 [0,1,0,0,0,0|3,0,0]=4 2213 B6R0.5 CCOS(=O)(=O)C MCULE-7269389229 [0,1,0,0,0,0|3,0,0]=4 2214 B6R0.5 CS(=N)(=O)CCO MCULE-8018746796 [0,1,0,0,0,0|1,0,0]=2 2215 B6R0.5 CS(=O)(=O)CC#N MCULE-8861900036 [0,1,0,0,0,0|2,0,1]=4 2216 B6R0.5 CS(=O)(=O)CCBr MCULE-8646670232 [0,1,0,0,0,0|2,0,0]=3 2217 B6R0.5 CS(=O)(=O)CCCl MCULE-2793702743 [0,1,0,0,0,0|2,0,0]=3 2218 B6R0.5 CS(=O)(=O)CCN MCULE-1321841891 [0,1,0,0,0,0|2,0,0]=3 2219 B6R0.5 CS(=O)(=O)CCN MCULE-2288346161 [0,1,0,0,0,0|2,0,0]=3 2220 B6R0.5 CS(=O)(=O)CCN MCULE-7691141389 [0,1,0,0,0,0|2,0,0]=3 2221 B6R0.5 CS(=O)(=O)CCO MCULE-1589351176 [0,1,0,0,0,0|1,0,0]=2 2222 B6R0.5 CS(=O)(=O)CCS MCULE-9115674422 [0,1,0,0,0,0|1,1,0]=3 2223 B6R0.5 CS(=O)(=S)OCBr MCULE-7749578002 [0,1,0,0,0,0|3,0,0]=4 2224 B6R0.5 C[N+](C)(C)CCBr MCULE-2368072196 [0,1,0,0,0,0|3,0,0]=4 2225 B6R0.5 C[N+](C)(C)CCBr MCULE-5324488073 [0,1,0,0,0,0|3,0,0]=4 2226 B6R0.5 C[N+](C)(C)CCCl MCULE-4654671217 [0,1,0,0,0,0|3,0,0]=4 2227 B6R0.5 C[N+](C)(C)CCCl MCULE-5943183618 [0,1,0,0,0,0|3,0,0]=4 2228 B6R0.5 C[N+](C)(C)CCF MCULE-6144278057 [0,1,0,0,0,0|3,0,0]=4 2229 B6R0.5 C[N+](C)(C)CCF MCULE-8462212061 [0,1,0,0,0,0|3,0,0]=4 2230 B6R0.5 C[N+](C)(C)CCI MCULE-4250272474 [0,1,0,0,0,0|3,0,0]=4 2231 B6R0.5 C[N+](C)(C)CCI MCULE-6980062227 [0,1,0,0,0,0|3,0,0]=4 2232 B6R0.5 C[N+](C)(C)CCN MCULE-3293219115 [0,1,0,0,0,0|3,0,0]=4 2233 B6R0.5 C[N+](C)(C)CCN MCULE-8852245898 [0,1,0,0,0,0|3,0,0]=4 2234 B6R0.5 C[N+](C)(C)CCN MCULE-9184903626 [0,1,0,0,0,0|3,0,0]=4 2235 B6R0.5 C[N+](C)(C)CCO MCULE-3010919014 [0,1,0,0,0,0|2,0,0]=3 2236 B6R0.5 C[N+](C)(C)CCO MCULE-3528185452 [0,1,0,0,0,0|2,0,0]=3 2237 B6R0.5 C[N+](C)(C)CCO MCULE-4172409716 [0,1,0,0,0,0|2,0,0]=3 2238 B6R0.5 C[N+](C)(C)CCO MCULE-7472714268 [0,1,0,0,0,0|2,0,0]=3 2239 B6R0.5 C[N+](C)(C)CCO MCULE-7712564949 [0,1,0,0,0,0|2,0,0]=3 2240 B6R0.5 C[N+](C)(C)CCO MCULE-7734259295 [0,1,0,0,0,0|2,0,0]=3 2241 B6R0.5 C[N+](C)(C)CCO MCULE-8298385594 [0,1,0,0,0,0|2,0,0]=3 2242 B6R0.5 C[N+](C)(C)CCS MCULE-9130259009 [0,1,0,0,0,0|2,1,0]=4 2243 B6R0.5 C[N+](C)(C)CCS MCULE-9495273519 [0,1,0,0,0,0|2,1,0]=4 2244 B6R0.5 C[N+](C)(N)CCCl MCULE-8152821505 [0,1,0,0,0,0|3,0,0]=4 2245 B6R0.5 C[N+](C)(N)CCCl MCULE-9237621518 [0,1,0,0,0,0|3,0,0]=4 2246 B6R0.5 C[Si](C)(C)CCBr MCULE-6991513303 [0,1,0,0,0,0|2,1,0]=4 2247 B6R0.5 C[Si](C)(C)CCCl MCULE-6700650458 [0,1,0,0,0,0|2,1,0]=4 2248 B6R0.5 C[Si](C)(C)CCN MCULE-2403043655 [0,1,0,0,0,0|2,1,0]=4 2249 B6R0.5 C[Si](C)(C)CCN MCULE-8743826240 [0,1,0,0,0,0|2,1,0]=4 2250 B6R0.5 C[Si](C)(C)CCO MCULE-3912098564 [0,1,0,0,0,0|1,1,0]=3 2251 B6R0.5 C[Si](C)(C)CCS MCULE-5201039482 [0,1,0,0,0,0|1,2,0]=4 2252 B6R0.5 C[Si](Cl)(Cl)CCCl MCULE-2114111230 [0,1,0,0,0,0|2,1,0]=4 2253 B6R0.5 NCCP(=O)(O)O MCULE-6030069631 [0,1,0,0,0,0|3,0,0]=4 2254 B6R0.5 NCCP(=O)(O)O MCULE-7710471805 [0,1,0,0,0,0|3,0,0]=4 2255 B6R0.5 NCCS(=O)(=O)F MCULE-5644302660 [0,1,0,0,0,0|3,0,0]=4 2256 B6R0.5 NCCS(=O)(=O)F MCULE-7750343881 [0,1,0,0,0,0|3,0,0]=4 2257 B6R0.5 NCCS(=O)(=O)N MCULE-1115068779 [0,1,0,0,0,0|3,0,0]=4 2258 B6R0.5 NCCS(=O)(=O)N MCULE-2765806178 [0,1,0,0,0,0|3,0,0]=4 2259 B6R0.5 NCCS(=O)(=O)O MCULE-6041857208 [0,1,0,0,0,0|3,0,0]=4 2260 B6R0.5 NCCS(=O)(=O)[O-] MCULE-8550332525 [0,1,0,0,0,0|3,0,0]=4 2261 B6R0.5 NS(=O)(=O)CCO MCULE-2612328809 [0,1,0,0,0,0|2,0,0]=3 2262 B6R0.5 O=P(O)(O)CCBr MCULE-3355549967 [0,1,0,0,0,0|3,0,0]=4 2263 B6R0.5 O=P(O)(O)CCCl MCULE-4131416773 [0,1,0,0,0,0|3,0,0]=4 2264 B6R0.5 O=P(O)(O)CCO MCULE-9752100956 [0,1,0,0,0,0|2,0,0]=3 2265 B6R0.5 O=S(=O)(Cl)CCBr MCULE-6013397779 [0,1,0,0,0,0|3,0,0]=4 2266 B6R0.5 O=S(=O)(Cl)CCCl MCULE-3218421200 [0,1,0,0,0,0|3,0,0]=4 2267 B6R0.5 O=S(=O)(Cl)CCF MCULE-1453516853 [0,1,0,0,0,0|3,0,0]=4 2268 B6R0.5 O=S(=O)(Cl)CCO MCULE-8335645741 [0,1,0,0,0,0|2,0,0]=3 2269 B6R0.5 O=S(=O)(F)CCCl MCULE-2316584071 [0,1,0,0,0,0|3,0,0]=4 2270 B6R0.5 O=S(=O)(F)CCO MCULE-5940944774 [0,1,0,0,0,0|2,0,0]=3 2271 B6R0.5 O=S(=O)(O)CCBr MCULE-3291252302 [0,1,0,0,0,0|3,0,0]=4 2272 B6R0.5 O=S(=O)(O)CCCl MCULE-9043359543 [0,1,0,0,0,0|3,0,0]=4 2273 B6R0.5 O=S(=O)(O)CCO MCULE-8075949368 [0,1,0,0,0,0|2,0,0]=3 2274 B6R0.5 O=S(=O)(O)CCS MCULE-1073050356 [0,1,0,0,0,0|2,1,0]=4 2275 B6R0.5 O=S(=O)([O-])CCBr MCULE-1501139927 [0,1,0,0,0,0|3,0,0]=4 2276 B6R0.5 O=S(=O)([O-])CCCl MCULE-1021847094 [0,1,0,0,0,0|3,0,0]=4 2277 B6R0.5 O=S(=O)([O-])CCO MCULE-2371191982 [0,1,0,0,0,0|2,0,0]=3 2278 B6R0.5 O=S(=O)([O-])CCO MCULE-5592842641 [0,1,0,0,0,0|2,0,0]=3 2279 B6R0.5 O=S(=O)([O-])CCO MCULE-7262663037 [0,1,0,0,0,0|2,0,0]=3 2280 B6R0.5 O=S(=O)([O-])CCS MCULE-7089816613 [0,1,0,0,0,0|2,1,0]=4 2281 B6R0.5 OCCC(F)(F)F MCULE-1784497575 [0,1,0,0,0,0|2,0,1]=4 2282 B6R1.2 BrC1=CCCC1 MCULE-1008379150 [0,0,0,1,0,0|2,0,1]=4 2283 B6R1.2 BrC1=COCC1 MCULE-8057569313 [0,0,0,1,0,0|1,0,1]=3 2284 B6R1.2 BrC1CCCC1 MCULE-9383923023 [0,0,0,1,0,0|2,0,1]=4 2285 B6R1.2 BrC1CCNC1 MCULE-4841543716 [0,0,0,1,0,0|2,0,1]=4 2286 B6R1.2 BrC1CCNC1 MCULE-4954951045 [0,0,0,1,0,0|2,0,1]=4 2287 B6R1.2 BrC1CCNC1 MCULE-7176123276 [0,0,0,1,0,0|2,0,1]=4 2288 B6R1.2 BrC1CCOC1 MCULE-7037144528 [0,0,0,1,0,0|1,0,1]=3 2289 B6R1.2 BrC1CCSC1 MCULE-6663716947 [0,0,0,1,0,0|1,1,1]=4 2290 B6R1.2 Br[C@@H]1CCNC1 MCULE-1681494552 [0,0,0,1,0,0|2,0,1]=4 2291 B6R1.2 Br[C@@H]1CCNC1 MCULE-1764777534 [0,0,0,1,0,0|2,0,1]=4 2292 B6R1.2 Br[C@@H]1CCNC1 MCULE-2455801012 [0,0,0,1,0,0|2,0,1]=4 2293 B6R1.2 Br[C@@H]1CCNC1 MCULE-8945784733 [0,0,0,1,0,0|2,0,1]=4 2294 B6R1.2 Br[C@H]1CCNC1 MCULE-5014033994 [0,0,0,1,0,0|2,0,1]=4 2295 B6R1.2 Br[C@H]1CCNC1 MCULE-5217617272 [0,0,0,1,0,0|2,0,1]=4 2296 B6R1.2 Br[C@H]1CCNC1 MCULE-8899453530 [0,0,0,1,0,0|2,0,1]=4 2297 B6R1.2 Br[C@H]1CCNC1 MCULE-9461718131 [0,0,0,1,0,0|2,0,1]=4 2298 B6R1.2 Br[C@H]1CCOC1 MCULE-7554969036 [0,0,0,1,0,0|1,0,1]=3 2299 B6R1.2 C1(CCNC1)C MCULE-2542646403 [0,0,0,1,0,0|2,0,1]=4 2300 B6R1.2 C1(CCNC1)C MCULE-4538835016 [0,0,0,1,0,0|2,0,1]=4 2301 B6R1.2 C1(CCNC1)F MCULE-2259566125 [0,0,0,1,0,0|2,0,1]=4 2302 B6R1.2 C1(CCNC1)F MCULE-3325393466 [0,0,0,1,0,0|2,0,1]=4 2303 B6R1.2 C1(CCNC1)O MCULE-2676539647 [0,0,0,1,0,0|1,0,2]=4 2304 B6R1.2 C1(CCNC1)O MCULE-4228466615 [0,0,0,1,0,0|1,0,2]=4 2305 B6R1.2 C1(CCOC1)I MCULE-4877322062 [0,0,0,1,0,0|1,0,1]=3 2306 B6R1.2 C1(CCOC1)N MCULE-2221007915 [0,0,0,1,0,0|1,0,1]=3 2307 B6R1.2 C1(CCOC1)N MCULE-3972931474 [0,0,0,1,0,0|1,0,1]=3 2308 B6R1.2 C1(CCOC1)O MCULE-3631749536 [0,0,0,1,0,0|0,0,2]=3 2309 B6R1.2 C=C1CCCC1 MCULE-4115373196 [0,0,0,1,0,0|2,0,0]=3 2310 B6R1.2 C=C1CCNC1 MCULE-7982953073 [0,0,0,1,0,0|2,0,0]=3 2311 B6R1.2 C=C1CCNC1 MCULE-8428731599 [0,0,0,1,0,0|2,0,0]=3 2312 B6R1.2 C=C1CCSC1 MCULE-7042571473 [0,0,0,1,0,0|1,1,0]=3 2313 B6R1.2 CC1=CC=CC1 MCULE-3765599626 [0,0,0,1,0,0|2,0,1]=4 2314 B6R1.2 CC1=CCCC1 MCULE-8508688474 [0,0,0,1,0,0|2,0,0]=3 2315 B6R1.2 CC1=CCCO1 MCULE-7276659214 [0,0,0,1,0,0|1,0,2]=4 2316 B6R1.2 CC1=CCNC1 MCULE-5892113847 [0,0,0,1,0,0|2,0,1]=4 2317 B6R1.2 CC1=CCNC1 MCULE-9225220351 [0,0,0,1,0,0|2,0,1]=4 2318 B6R1.2 CC1=COC=C1 MCULE-1597223627 [0,0,0,1,0,0|1,0,2]=4 2319 B6R1.2 CC1=COC=N1 MCULE-3497089982 [0,0,0,1,0,0|2,0,1]=4 2320 B6R1.2 CC1=CON=C1 MCULE-4312100714 [0,0,0,1,0,0|2,0,1]=4 2321 B6R1.2 CC1=NCCC1 MCULE-5009170423 [0,0,0,1,0,0|2,0,0]=3 2322 B6R1.2 CC1=NCCN1 MCULE-4787238872 [0,0,0,1,0,0|3,0,0]=4 2323 B6R1.2 CC1=NCCO1 MCULE-8564633040 [0,0,0,1,0,0|2,0,1]=4 2324 B6R1.2 CC1=NCCS1 MCULE-1701303405 [0,0,0,1,0,0|2,1,0]=4 2325 B6R1.2 CC1=NNCC1 MCULE-1758510182 [0,0,0,1,0,0|2,0,0]=3 2326 B6R1.2 CC1=NOC=C1 MCULE-1572732397 [0,0,0,1,0,0|1,0,2]=4 2327 B6R1.2 CC1=NOC=N1 MCULE-5841548711 [0,0,0,1,0,0|2,0,1]=4 2328 B6R1.2 CC1=NON=C1 MCULE-7563934145 [0,0,0,1,0,0|2,0,1]=4 2329 B6R1.2 CC1C=CCC1 MCULE-1638534048 [0,0,0,1,0,0|2,0,1]=4 2330 B6R1.2 CC1CCCC1 MCULE-4702116068 [0,0,0,1,0,0|2,0,1]=4 2331 B6R1.2 CC1CCCN1 MCULE-4853624560 [0,0,0,1,0,0|2,0,1]=4 2332 B6R1.2 CC1CCCN1 MCULE-5939948024 [0,0,0,1,0,0|2,0,1]=4 2333 B6R1.2 CC1CCCN1 MCULE-6020011445 [0,0,0,1,0,0|2,0,1]=4 2334 B6R1.2 CC1CCCN1 MCULE-7855346849 [0,0,0,1,0,0|2,0,1]=4 2335 B6R1.2 CC1CCCO1 MCULE-2526138687 [0,0,0,1,0,0|1,0,2]=4 2336 B6R1.2 CC1CCCS1 MCULE-8372499972 [0,0,0,1,0,0|1,1,1]=4 2337 B6R1.2 CC1CCNC1 MCULE-6494098173 [0,0,0,1,0,0|2,0,1]=4 2338 B6R1.2 CC1CCNC1 MCULE-8260364514 [0,0,0,1,0,0|2,0,1]=4 2339 B6R1.2 CC1CCOC1 MCULE-6424683416 [0,0,0,1,0,0|1,0,1]=3 2340 B6R1.2 CC1CCSC1 MCULE-7445511318 [0,0,0,1,0,0|1,1,1]=4 2341 B6R1.2 CC1CNOC1 MCULE-1071803164 [0,0,0,1,0,0|2,0,1]=4 2342 B6R1.2 CC1CNOC1 MCULE-9455391174 [0,0,0,1,0,0|2,0,1]=4 2343 B6R1.2 CC1COCO1 MCULE-9332316279 [0,0,0,1,0,0|2,0,1]=4 2344 B6R1.2 CN1CCCC1 MCULE-5387702231 [0,0,0,1,0,0|3,0,0]=4 2345 B6R1.2 CN1CCNC1 MCULE-8059197564 [0,0,0,1,0,0|3,0,0]=4 2346 B6R1.2 CN1CCNC1 MCULE-9818601515 [0,0,0,1,0,0|3,0,0]=4 2347 B6R1.2 CN1CCOC1 MCULE-5504672404 [0,0,0,1,0,0|2,0,0]=3 2348 B6R1.2 C[C@@H]1CCCN1 MCULE-1038329474 [0,0,0,1,0,0|2,0,1]=4 2349 B6R1.2 C[C@@H]1CCCN1 MCULE-1829999308 [0,0,0,1,0,0|2,0,1]=4 2350 B6R1.2 C[C@@H]1CCCN1 MCULE-8644278041 [0,0,0,1,0,0|2,0,1]=4 2351 B6R1.2 C[C@@H]1CCCN1 MCULE-9243990647 [0,0,0,1,0,0|2,0,1]=4 2352 B6R1.2 C[C@@H]1CCNC1 MCULE-5345577321 [0,0,0,1,0,0|2,0,1]=4 2353 B6R1.2 C[C@@H]1CCNC1 MCULE-5749945455 [0,0,0,1,0,0|2,0,1]=4 2354 B6R1.2 C[C@@H]1CCNC1 MCULE-8967606188 [0,0,0,1,0,0|2,0,1]=4 2355 B6R1.2 C[C@@H]1CCNC1 MCULE-8996756392 [0,0,0,1,0,0|2,0,1]=4 2356 B6R1.2 C[C@H]1CCCN1 MCULE-2078024663 [0,0,0,1,0,0|2,0,1]=4 2357 B6R1.2 C[C@H]1CCCN1 MCULE-3113877345 [0,0,0,1,0,0|2,0,1]=4 2358 B6R1.2 C[C@H]1CCCN1 MCULE-3426869473 [0,0,0,1,0,0|2,0,1]=4 2359 B6R1.2 C[C@H]1CCCN1 MCULE-5093266679 [0,0,0,1,0,0|2,0,1]=4 2360 B6R1.2 C[C@H]1CCNC1 MCULE-1866792897 [0,0,0,1,0,0|2,0,1]=4 2361 B6R1.2 C[C@H]1CCNC1 MCULE-3817248567 [0,0,0,1,0,0|2,0,1]=4 2362 B6R1.2 C[C@H]1CCNC1 MCULE-7938243226 [0,0,0,1,0,0|2,0,1]=4 2363 B6R1.2 C[C@H]1CCNC1 MCULE-8895875203 [0,0,0,1,0,0|2,0,1]=4 2364 B6R1.2 C[S+]1CCCC1 MCULE-6294888335 [0,0,0,1,0,0|3,0,0]=4 2365 B6R1.2 C[S+]1CCCC1 MCULE-8432227262 [0,0,0,1,0,0|3,0,0]=4 2366 B6R1.2 ClC1=CCCC1 MCULE-7680993065 [0,0,0,1,0,0|2,0,1]=4 2367 B6R1.2 ClC1CCCC1 MCULE-3285928655 [0,0,0,1,0,0|2,0,1]=4 2368 B6R1.2 ClC1CCNC1 MCULE-5659561118 [0,0,0,1,0,0|2,0,1]=4 2369 B6R1.2 ClC1CCNC1 MCULE-6180477494 [0,0,0,1,0,0|2,0,1]=4 2370 B6R1.2 ClC1CCNC1 MCULE-6964859207 [0,0,0,1,0,0|2,0,1]=4 2371 B6R1.2 ClC1CCNC1 MCULE-8389509440 [0,0,0,1,0,0|2,0,1]=4 2372 B6R1.2 ClC1CCOC1 MCULE-6903762147 [0,0,0,1,0,0|1,0,1]=3 2373 B6R1.2 Cl[C@@H]1CCNC1 MCULE-3218152098 [0,0,0,1,0,0|2,0,1]=4 2374 B6R1.2 Cl[C@@H]1CCNC1 MCULE-6728755007 [0,0,0,1,0,0|2,0,1]=4 2375 B6R1.2 Cl[C@@H]1CCNC1 MCULE-7223308304 [0,0,0,1,0,0|2,0,1]=4 2376 B6R1.2 Cl[C@@H]1CCNC1 MCULE-9699335522 [0,0,0,1,0,0|2,0,1]=4 2377 B6R1.2 Cl[C@H]1CCNC1 MCULE-1696981588 [0,0,0,1,0,0|2,0,1]=4 2378 B6R1.2 Cl[C@H]1CCNC1 MCULE-4535592624 [0,0,0,1,0,0|2,0,1]=4 2379 B6R1.2 Cl[C@H]1CCNC1 MCULE-4850151938 [0,0,0,1,0,0|2,0,1]=4 2380 B6R1.2 Cl[C@H]1CCNC1 MCULE-8947782807 [0,0,0,1,0,0|2,0,1]=4 2381 B6R1.2 FC1CCCC1 MCULE-1416016970 [0,0,0,1,0,0|2,0,1]=4 2382 B6R1.2 FC1CCNC1 MCULE-3601135445 [0,0,0,1,0,0|2,0,1]=4 2383 B6R1.2 FC1CCNC1 MCULE-8578750940 [0,0,0,1,0,0|2,0,1]=4 2384 B6R1.2 FC1CNOC1 MCULE-4837734523 [0,0,0,1,0,0|2,0,1]=4 2385 B6R1.2 FC1CNOC1 MCULE-6176254900 [0,0,0,1,0,0|2,0,1]=4 2386 B6R1.2 F[C@@H]1CCNC1 MCULE-4408739710 [0,0,0,1,0,0|2,0,1]=4 2387 B6R1.2 F[C@@H]1CCNC1 MCULE-5678498844 [0,0,0,1,0,0|2,0,1]=4 2388 B6R1.2 F[C@@H]1CCNC1 MCULE-5679054116 [0,0,0,1,0,0|2,0,1]=4 2389 B6R1.2 F[C@@H]1CCNC1 MCULE-7029204180 [0,0,0,1,0,0|2,0,1]=4 2390 B6R1.2 F[C@H]1CCNC1 MCULE-2854402872 [0,0,0,1,0,0|2,0,1]=4 2391 B6R1.2 F[C@H]1CCNC1 MCULE-4493640982 [0,0,0,1,0,0|2,0,1]=4 2392 B6R1.2 F[C@H]1CCNC1 MCULE-7441383471 [0,0,0,1,0,0|2,0,1]=4 2393 B6R1.2 F[C@H]1CCNC1 MCULE-7946601643 [0,0,0,1,0,0|2,0,1]=4 2394 B6R1.2 IC1=CCCC1 MCULE-5953451970 [0,0,0,1,0,0|2,0,1]=4 2395 B6R1.2 IC1=COCC1 MCULE-3076361502 [0,0,0,1,0,0|1,0,1]=3 2396 B6R1.2 IC1CCCC1 MCULE-2705379744 [0,0,0,1,0,0|2,0,1]=4 2397 B6R1.2 IC1CCNC1 MCULE-3058541551 [0,0,0,1,0,0|2,0,1]=4 2398 B6R1.2 IC1CCNC1 MCULE-5326267139 [0,0,0,1,0,0|2,0,1]=4 2399 B6R1.2 IC1CCOC1 MCULE-1379775972 [0,0,0,1,0,0|1,0,1]=3 2400 B6R1.2 I[C@@H]1CCNC1 MCULE-3800433724 [0,0,0,1,0,0|2,0,1]=4 2401 B6R1.2 I[C@@H]1CCNC1 MCULE-3857825133 [0,0,0,1,0,0|2,0,1]=4 2402 B6R1.2 I[C@@H]1CCNC1 MCULE-7781267462 [0,0,0,1,0,0|2,0,1]=4 2403 B6R1.2 I[C@@H]1CCNC1 MCULE-7979843810 [0,0,0,1,0,0|2,0,1]=4 2404 B6R1.2 I[C@@H]1CCOC1 MCULE-2036157502 [0,0,0,1,0,0|1,0,1]=3 2405 B6R1.2 I[C@@H]1CCOC1 MCULE-4800752659 [0,0,0,1,0,0|1,0,1]=3 2406 B6R1.2 I[C@H]1CCNC1 MCULE-1218289403 [0,0,0,1,0,0|2,0,1]=4 2407 B6R1.2 I[C@H]1CCNC1 MCULE-7469922084 [0,0,0,1,0,0|2,0,1]=4 2408 B6R1.2 I[C@H]1CCOC1 MCULE-4242860607 [0,0,0,1,0,0|1,0,1]=3 2409 B6R1.2 I[C@H]1CCOC1 MCULE-7095404975 [0,0,0,1,0,0|1,0,1]=3 2410 B6R1.2 N=C1CCCS1 MCULE-4228855265 [0,0,0,1,0,0|2,1,0]=4 2411 B6R1.2 N=C1CCCS1 MCULE-7496124035 [0,0,0,1,0,0|2,1,0]=4 2412 B6R1.2 NC1=NCCC1 MCULE-6089369366 [0,0,0,1,0,0|3,0,0]=4 2413 B6R1.2 NC1=NCCC1 MCULE-8979618464 [0,0,0,1,0,0|3,0,0]=4 2414 B6R1.2 NC1=NNCC1 MCULE-4665265929 [0,0,0,1,0,0|3,0,0]=4 2415 B6R1.2 NC1=NOCC1 MCULE-4971355735 [0,0,0,1,0,0|2,0,0]=3 2416 B6R1.2 NC1CCCC1 MCULE-2292038009 [0,0,0,1,0,0|2,0,1]=4 2417 B6R1.2 NC1CCNC1 MCULE-2237528072 [0,0,0,1,0,0|2,0,1]=4 2418 B6R1.2 NC1CCNC1 MCULE-5167920547 [0,0,0,1,0,0|2,0,1]=4 2419 B6R1.2 NC1CCNC1 MCULE-5837785719 [0,0,0,1,0,0|2,0,1]=4 2420 B6R1.2 NC1CCOC1 MCULE-1276945018 [0,0,0,1,0,0|1,0,1]=3 2421 B6R1.2 NC1CCOC1 MCULE-8146259495 [0,0,0,1,0,0|1,0,1]=3 2422 B6R1.2 NC1CCSC1 MCULE-8972229387 [0,0,0,1,0,0|1,1,1]=4 2423 B6R1.2 NC1CCSC1 MCULE-9186640582 [0,0,0,1,0,0|1,1,1]=4 2424 B6R1.2 NN1CCCC1 MCULE-1562593919 [0,0,0,1,0,0|3,0,0]=4 2425 B6R1.2 NN1CCCC1 MCULE-2311855036 [0,0,0,1,0,0|3,0,0]=4 2426 B6R1.2 NN1CCCC1 MCULE-5484008222 [0,0,0,1,0,0|3,0,0]=4 2427 B6R1.2 N[C@@H]1CCNC1 MCULE-6043697974 [0,0,0,1,0,0|2,0,1]=4 2428 B6R1.2 N[C@@H]1CCNC1 MCULE-8912264932 [0,0,0,1,0,0|2,0,1]=4 2429 B6R1.2 N[C@@H]1CCNC1 MCULE-9183647019 [0,0,0,1,0,0|2,0,1]=4 2430 B6R1.2 N[C@@H]1CCNC1 MCULE-9608760183 [0,0,0,1,0,0|2,0,1]=4 2431 B6R1.2 N[C@@H]1CCOC1 MCULE-1100136080 [0,0,0,1,0,0|1,0,1]=3 2432 B6R1.2 N[C@@H]1CCOC1 MCULE-4493278911 [0,0,0,1,0,0|1,0,1]=3 2433 B6R1.2 N[C@@H]1CCOC1 MCULE-5574536510 [0,0,0,1,0,0|1,0,1]=3 2434 B6R1.2 N[C@@H]1CCOC1 MCULE-7204677203 [0,0,0,1,0,0|1,0,1]=3 2435 B6R1.2 N[C@H]1CCNC1 MCULE-3573455998 [0,0,0,1,0,0|2,0,1]=4 2436 B6R1.2 N[C@H]1CCNC1 MCULE-3988158945 [0,0,0,1,0,0|2,0,1]=4 2437 B6R1.2 N[C@H]1CCNC1 MCULE-4526890579 [0,0,0,1,0,0|2,0,1]=4 2438 B6R1.2 N[C@H]1CCNC1 MCULE-8548728927 [0,0,0,1,0,0|2,0,1]=4 2439 B6R1.2 N[C@H]1CCOC1 MCULE-2273771439 [0,0,0,1,0,0|1,0,1]=3 2440 B6R1.2 N[C@H]1CCOC1 MCULE-3567904137 [0,0,0,1,0,0|1,0,1]=3 2441 B6R1.2 N[C@H]1CCOC1 MCULE-5268616156 [0,0,0,1,0,0|1,0,1]=3 2442 B6R1.2 N[C@H]1CCOC1 MCULE-7351975857 [0,0,0,1,0,0|1,0,1]=3 2443 B6R1.2 O=C1C=CCC1 MCULE-1844779047 [0,0,0,1,0,0|1,0,1]=3 2444 B6R1.2 O=C1C=CCN1 MCULE-4338701003 [0,0,0,1,0,0|2,0,1]=4 2445 B6R1.2 O=C1C=CCO1 MCULE-4296503663 [0,0,0,1,0,0|2,0,1]=4 2446 B6R1.2 O=C1C=CCS1 MCULE-5623095583 [0,0,0,1,0,0|2,0,1]=4 2447 B6R1.2 O=C1C=CSC1 MCULE-6580304664 [0,0,0,1,0,0|0,1,2]=4 2448 B6R1.2 O=C1CC=CC1 MCULE-7606670114 [0,0,0,1,0,0|1,0,1]=3 2449 B6R1.2 O=C1CC=NN1 MCULE-1672455504 [0,0,0,1,0,0|2,0,1]=4 2450 B6R1.2 O=C1CCCC1 MCULE-9455227735 [0,0,0,1,0,0|1,0,0]=2 2451 B6R1.2 O=C1CCCN1 MCULE-3061780794 [0,0,0,1,0,0|2,0,0]=3 2452 B6R1.2 O=C1CCCO1 MCULE-6795890265 [0,0,0,1,0,0|2,0,0]=3 2453 B6R1.2 O=C1CCCS1 MCULE-5361654550 [0,0,0,1,0,0|2,0,0]=3 2454 B6R1.2 O=C1CCNC1 MCULE-2947789259 [0,0,0,1,0,0|1,0,0]=2 2455 B6R1.2 O=C1CCNC1 MCULE-7192595052 [0,0,0,1,0,0|1,0,0]=2 2456 B6R1.2 O=C1CCNN1 MCULE-7030953666 [0,0,0,1,0,0|2,0,0]=3 2457 B6R1.2 O=C1CCOC1 MCULE-2031733910 [0,0,0,1,0,0|0,0,0]=1 2458 B6R1.2 O=C1CCON1 MCULE-6799359324 [0,0,0,1,0,0|1,0,0]=2 2459 B6R1.2 O=C1CCSC1 MCULE-2059655624 [0,0,0,1,0,0|0,1,0]=2 2460 B6R1.2 O=C1CC[NH2+]N1 MCULE-5327505055 [0,0,0,1,0,0|2,0,0]=3 2461 B6R1.2 O=C1CNCN1 MCULE-2645891847 [0,0,0,1,0,0|2,0,0]=3 2462 B6R1.2 O=C1CNCN1 MCULE-9269137129 [0,0,0,1,0,0|2,0,0]=3 2463 B6R1.2 O=C1CSCN1 MCULE-3946660854 [0,0,0,1,0,0|1,1,0]=3 2464 B6R1.2 O=C1NCCN1 MCULE-9806791551 [0,0,0,1,0,0|3,0,0]=4 2465 B6R1.2 O=C1NCCO1 MCULE-3934923008 [0,0,0,1,0,0|3,0,0]=4 2466 B6R1.2 O=C1NCCS1 MCULE-6732478086 [0,0,0,1,0,0|3,0,0]=4 2467 B6R1.2 O=C1OCCO1 MCULE-9493253045 [0,0,0,1,0,0|3,0,0]=4 2468 B6R1.2 O=S1CCCC1 MCULE-2442126780 [0,0,0,1,0,0|2,0,0]=3 2469 B6R1.2 OC1CCCC1 MCULE-1758440264 [0,0,0,1,0,0|1,0,2]=4 2470 B6R1.2 OC1CCNC1 MCULE-4307402606 [0,0,0,1,0,0|1,0,2]=4 2471 B6R1.2 OC1CCNC1 MCULE-6745480350 [0,0,0,1,0,0|1,0,2]=4 2472 B6R1.2 OC1CCOC1 MCULE-4469581028 [0,0,0,1,0,0|0,0,2]=3 2473 B6R1.2 OC1CCSC1 MCULE-9796808599 [0,0,0,1,0,0|0,1,2]=4 2474 B6R1.2 OC1CNOC1 MCULE-3414700581 [0,0,0,1,0,0|1,0,2]=4 2475 B6R1.2 OC1CNOC1 MCULE-8163403090 [0,0,0,1,0,0|1,0,2]=4 2476 B6R1.2 OC1CNOC1 MCULE-8644852072 [0,0,0,1,0,0|1,0,2]=4 2477 B6R1.2 OC1C[NH2+]OC1 MCULE-7865131527 [0,0,0,1,0,0|1,0,2]=4 2478 B6R1.2 O[C@@H]1CCNC1 MCULE-8116497337 [0,0,0,1,0,0|1,0,2]=4 2479 B6R1.2 O[C@@H]1CCNC1 MCULE-8578068948 [0,0,0,1,0,0|1,0,2]=4 2480 B6R1.2 O[C@@H]1CCNC1 MCULE-9094582248 [0,0,0,1,0,0|1,0,2]=4 2481 B6R1.2 O[C@@H]1CCNC1 MCULE-9933593352 [0,0,0,1,0,0|1,0,2]=4 2482 B6R1.2 O[C@@H]1CCOC1 MCULE-7739141732 [0,0,0,1,0,0|0,0,2]=3 2483 B6R1.2 O[C@@H]1CCOC1 MCULE-8344812226 [0,0,0,1,0,0|0,0,2]=3 2484 B6R1.2 O[C@@H]1CCOC1 MCULE-9098074990 [0,0,0,1,0,0|0,0,2]=3 2485 B6R1.2 O[C@@H]1CCSC1 MCULE-3532754705 [0,0,0,1,0,0|0,1,2]=4 2486 B6R1.2 O[C@@H]1CCSC1 MCULE-5800407146 [0,0,0,1,0,0|0,1,2]=4 2487 B6R1.2 O[C@@H]1CNOC1 MCULE-1481945185 [0,0,0,1,0,0|1,0,2]=4 2488 B6R1.2 O[C@@H]1CNOC1 MCULE-4156521353 [0,0,0,1,0,0|1,0,2]=4 2489 B6R1.2 O[C@@H]1CNOC1 MCULE-5692816168 [0,0,0,1,0,0|1,0,2]=4 2490 B6R1.2 O[C@@H]1CNOC1 MCULE-6838604903 [0,0,0,1,0,0|1,0,2]=4 2491 B6R1.2 O[C@H]1CCNC1 MCULE-1100098088 [0,0,0,1,0,0|1,0,2]=4 2492 B6R1.2 O[C@H]1CCNC1 MCULE-3493644065 [0,0,0,1,0,0|1,0,2]=4 2493 B6R1.2 O[C@H]1CCNC1 MCULE-3778918259 [0,0,0,1,0,0|1,0,2]=4 2494 B6R1.2 O[C@H]1CCNC1 MCULE-4680162054 [0,0,0,1,0,0|1,0,2]=4 2495 B6R1.2 O[C@H]1CCOC1 MCULE-8518846297 [0,0,0,1,0,0|0,0,2]=3 2496 B6R1.2 O[C@H]1CCOC1 MCULE-9544747995 [0,0,0,1,0,0|0,0,2]=3 2497 B6R1.2 O[C@H]1CNOC1 MCULE-1746817114 [0,0,0,1,0,0|1,0,2]=4 2498 B6R1.2 O[C@H]1CNOC1 MCULE-4469396812 [0,0,0,1,0,0|1,0,2]=4 2499 B6R1.2 O[C@H]1CNOC1 MCULE-7167785164 [0,0,0,1,0,0|1,0,2]=4 2500 B6R1.2 O[C@H]1CNOC1 MCULE-8409877332 [0,0,0,1,0,0|1,0,2]=4 2501 B6R1.2 S=C1CCCN1 MCULE-1089290822 [0,0,0,1,0,0|2,1,0]=4 2502 B6R1.2 SC1CCCC1 MCULE-5932400506 [0,0,0,1,0,0|1,1,1]=4 2503 B6R1.2 SC1CCOC1 MCULE-9247906418 [0,0,0,1,0,0|0,1,1]=3 2504 B6R1.2 SC1CCSC1 MCULE-5955380477 [0,0,0,1,0,0|0,2,1]=4 2505 B6R1.2 [NH3+]C1CC[NH2+]C1 MCULE-3374468196 [0,0,0,1,0,0|2,0,1]=4 2506 B6R1.3 BrCCC1CC1 MCULE-3454213225 [0,0,0,1,0,0|2,0,1]=4 2507 B6R1.3 BrCCC1CO1 MCULE-9889314000 [0,0,0,1,0,0|1,0,2]=4 2508 B6R1.3 BrCC[C@@H]1CO1 MCULE-7015242723 [0,0,0,1,0,0|1,0,2]=4 2509 B6R1.3 BrCC[C@H]1CO1 MCULE-3286755305 [0,0,0,1,0,0|1,0,2]=4 2510 B6R1.3 BrCC[C@H]1CO1 MCULE-3512143037 [0,0,0,1,0,0|1,0,2]=4 2511 B6R1.3 CCCC1CO1 MCULE-5080039224 [0,0,0,1,0,0|1,0,2]=4 2512 B6R1.3 CCC[C@@H]1CO1 MCULE-1815222100 [0,0,0,1,0,0|1,0,2]=4 2513 B6R1.3 CCC[C@H]1CO1 MCULE-9952368131 [0,0,0,1,0,0|1,0,2]=4 2514 B6R1.3 ClCCC1CC1 MCULE-5665496795 [0,0,0,1,0,0|2,0,1]=4 2515 B6R1.3 ClCCC1CO1 MCULE-2772510260 [0,0,0,1,0,0|1,0,2]=4 2516 B6R1.3 ICCC1CC1 MCULE-5518738700 [0,0,0,1,0,0|2,0,1]=4 2517 B6R1.3 NCCC1CC1 MCULE-8459735325 [0,0,0,1,0,0|2,0,1]=4 2518 B6R1.3 NCCC1CC1 MCULE-9646218986 [0,0,0,1,0,0|2,0,1]=4 2519 B6R1.3 NCCN1CC1 MCULE-3554584147 [0,0,0,1,0,0|3,0,0]=4 2520 B6R1.3 OCCC1CC1 MCULE-1360348684 [0,0,0,1,0,0|1,0,1]=3 2521 B6R1.3 OCCC1CO1 MCULE-6523000607 [0,0,0,1,0,0|0,0,2]=3 2522 B6R1.3 OCCN1CC1 MCULE-3845187783 [0,0,0,1,0,0|2,0,0]=3 2523 B6R1.3 OCC[C@@H]1CO1 MCULE-4797533590 [0,0,0,1,0,0|0,0,2]=3 2524 B6R1.3 OCC[C@@H]1CO1 MCULE-6833850805 [0,0,0,1,0,0|0,0,2]=3 2525 B6R1.3 OCC[C@H]1CO1 MCULE-3560802495 [0,0,0,1,0,0|0,0,2]=3 2526 B6R1.3 OCC[C@H]1CO1 MCULE-8738926598 [0,0,0,1,0,0|0,0,2]=3 2527 B6R1.5 C=C1CC(=O)O1 MCULE-7149487095 [0,0,0,1,0,0|2,0,1]=4 2528 B6R1.5 C=C1CC(C1)N MCULE-4635717695 [0,0,0,1,0,0|2,0,0]=3 2529 B6R1.5 C=C1CC(C1)N MCULE-6992894696 [0,0,0,1,0,0|2,0,0]=3 2530 B6R1.5 CC1CC(=O)C1 MCULE-2159393653 [0,0,0,1,0,0|1,0,0]=2 2531 B6R1.5 CC1CC(=O)N1 MCULE-6139592633 [0,0,0,1,0,0|2,0,0]=3 2532 B6R1.5 CC1CC(=O)O1 MCULE-9285847382 [0,0,0,1,0,0|2,0,0]=3 2533 B6R1.5 CC1CC(C1)N MCULE-5323299846 [0,0,0,1,0,0|2,0,1]=4 2534 B6R1.5 CC1CC(C1)N MCULE-9940885824 [0,0,0,1,0,0|2,0,1]=4 2535 B6R1.5 CC1CC(C1)O MCULE-8612661286 [0,0,0,1,0,0|1,0,1]=3 2536 B6R1.5 CC1CC(N1)C MCULE-2112479012 [0,0,0,1,0,0|2,0,1]=4 2537 B6R1.5 CC1CC(N1)C MCULE-4224653730 [0,0,0,1,0,0|2,0,1]=4 2538 B6R1.5 CN1CC(=O)C1 MCULE-1685267969 [0,0,0,1,0,0|2,0,0]=3 2539 B6R1.5 CN1CC(=O)C1 MCULE-2242594777 [0,0,0,1,0,0|2,0,0]=3 2540 B6R1.5 CN1CC(C1)Cl MCULE-8475620447 [0,0,0,1,0,0|3,0,0]=4 2541 B6R1.5 CN1CC(C1)Cl MCULE-8543507391 [0,0,0,1,0,0|3,0,0]=4 2542 B6R1.5 CN1CC(C1)N MCULE-2180239206 [0,0,0,1,0,0|3,0,0]=4 2543 B6R1.5 CN1CC(C1)N MCULE-4181047352 [0,0,0,1,0,0|3,0,0]=4 2544 B6R1.5 CN1CC(C1)O MCULE-2897194266 [0,0,0,1,0,0|2,0,0]=3 2545 B6R1.5 CN1CC(C1)O MCULE-3717153558 [0,0,0,1,0,0|2,0,0]=3 2546 B6R1.5 CN1CC(C1)O MCULE-7229396078 [0,0,0,1,0,0|2,0,0]=3 2547 B6R1.5 C[C@@H]1CC(=O)O1 MCULE-3257475519 [0,0,0,1,0,0|2,0,0]=3 2548 B6R1.5 C[C@@H]1C[C@H](N1)C MCULE-1994890312 [0,0,0,1,0,0|2,0,1]=4 2549 B6R1.5 C[C@@H]1C[C@H](N1)C MCULE-7235151096 [0,0,0,1,0,0|2,0,1]=4 2550 B6R1.5 C[C@H]1C[C@@H](C1)N MCULE-1535311916 [0,0,0,1,0,0|2,0,1]=4 2551 B6R1.5 C[C@H]1C[C@@H](C1)N MCULE-2831484375 [0,0,0,1,0,0|2,0,1]=4 2552 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-4062075526 [0,0,0,1,0,0|2,0,1]=4 2553 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-8779826872 [0,0,0,1,0,0|2,0,1]=4 2554 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-9842353775 [0,0,0,1,0,0|2,0,1]=4 2555 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-9945333960 [0,0,0,1,0,0|2,0,1]=4 2556 B6R1.5 C[C@H]1C[C@H](C1)N MCULE-7323273959 [0,0,0,1,0,0|2,0,1]=4 2557 B6R1.5 C[C@H]1C[C@H](C1)N MCULE-9517005721 [0,0,0,1,0,0|2,0,1]=4 2558 B6R1.5 C[C@H]1C[C@H](C1)O MCULE-9757332081 [0,0,0,1,0,0|1,0,1]=3 2559 B6R1.5 C[C@H]1C[C@H](N1)C MCULE-1014047015 [0,0,0,1,0,0|2,0,1]=4 2560 B6R1.5 C[C@H]1C[C@H](N1)C MCULE-9280852387 [0,0,0,1,0,0|2,0,1]=4 2561 B6R1.5 NC1CC(=O)C1 MCULE-3450860282 [0,0,0,1,0,0|1,0,0]=2 2562 B6R1.5 NC1CC(=O)C1 MCULE-5974961836 [0,0,0,1,0,0|1,0,0]=2 2563 B6R1.5 NC1CC(C1)Br MCULE-1024702653 [0,0,0,1,0,0|2,0,1]=4 2564 B6R1.5 NC1CC(C1)Br MCULE-6956910745 [0,0,0,1,0,0|2,0,1]=4 2565 B6R1.5 NC1CC(C1)Cl MCULE-2079032271 [0,0,0,1,0,0|2,0,1]=4 2566 B6R1.5 NC1CC(C1)Cl MCULE-9907911910 [0,0,0,1,0,0|2,0,1]=4 2567 B6R1.5 NC1CC(C1)F MCULE-8668562856 [0,0,0,1,0,0|2,0,1]=4 2568 B6R1.5 NC1CC(C1)F MCULE-9413732351 [0,0,0,1,0,0|2,0,1]=4 2569 B6R1.5 NC1CC(C1)N MCULE-2499828215 [0,0,0,1,0,0|2,0,1]=4 2570 B6R1.5 NC1CC(C1)N MCULE-9585725038 [0,0,0,1,0,0|2,0,1]=4 2571 B6R1.5 NC1CC(C1)O MCULE-3800806511 [0,0,0,1,0,0|1,0,1]=3 2572 B6R1.5 NC1CC(C1)O MCULE-4101412744 [0,0,0,1,0,0|1,0,1]=3 2573 B6R1.5 NN1CC(C1)O MCULE-1883589988 [0,0,0,1,0,0|2,0,0]=3 2574 B6R1.5 NN1CC(C1)O MCULE-4736517920 [0,0,0,1,0,0|2,0,0]=3 2575 B6R1.5 N[C@H]1C[C@@H](C1)Br MCULE-2563959776 [0,0,0,1,0,0|2,0,1]=4 2576 B6R1.5 N[C@H]1C[C@@H](C1)Br MCULE-4159438704 [0,0,0,1,0,0|2,0,1]=4 2577 B6R1.5 N[C@H]1C[C@@H](C1)F MCULE-1693657713 [0,0,0,1,0,0|2,0,1]=4 2578 B6R1.5 N[C@H]1C[C@@H](C1)F MCULE-2842964955 [0,0,0,1,0,0|2,0,1]=4 2579 B6R1.5 N[C@H]1C[C@@H](C1)N MCULE-7371432215 [0,0,0,1,0,0|2,0,1]=4 2580 B6R1.5 N[C@H]1C[C@@H](C1)O MCULE-3690359453 [0,0,0,1,0,0|1,0,1]=3 2581 B6R1.5 N[C@H]1C[C@@H](C1)O MCULE-6031478808 [0,0,0,1,0,0|1,0,1]=3 2582 B6R1.5 N[C@H]1C[C@H](C1)F MCULE-7248556800 [0,0,0,1,0,0|2,0,1]=4 2583 B6R1.5 N[C@H]1C[C@H](C1)F MCULE-8169894230 [0,0,0,1,0,0|2,0,1]=4 2584 B6R1.5 N[C@H]1C[C@H](C1)N MCULE-2358029728 [0,0,0,1,0,0|2,0,1]=4 2585 B6R1.5 N[C@H]1C[C@H](C1)N MCULE-8703864989 [0,0,0,1,0,0|2,0,1]=4 2586 B6R1.5 N[C@H]1C[C@H](C1)O MCULE-2367486822 [0,0,0,1,0,0|1,0,1]=3 2587 B6R1.5 N[C@H]1C[C@H](C1)O MCULE-2477923057 [0,0,0,1,0,0|1,0,1]=3 2588 B6R1.5 O=C1CC(C1)Br MCULE-1715982282 [0,0,0,1,0,0|1,0,0]=2 2589 B6R1.5 O=C1CC(C1)F MCULE-2541516698 [0,0,0,1,0,0|1,0,0]=2 2590 B6R1.5 O=C1CC(C1)O MCULE-7099112258 [0,0,0,1,0,0|0,0,0]=1 2591 B6R1.5 OC1CC(C1)Br MCULE-8550195809 [0,0,0,1,0,0|1,0,1]=3 2592 B6R1.5 OC1CC(C1)F MCULE-7130501241 [0,0,0,1,0,0|1,0,1]=3 2593 B6R1.5 OC1CC(C1)O MCULE-4391504671 [0,0,0,1,0,0|0,0,2]=3 2594 B6R1.5 O[C@H]1C[C@@H](C1)F MCULE-8960643165 [0,0,0,1,0,0|1,0,1]=3 2595 B6R1.5 O[C@H]1C[C@@H](C1)O MCULE-5524471729 [0,0,0,1,0,0|0,0,2]=3 2596 B6R1.5 O[C@H]1C[C@H](C1)O MCULE-7725166436 [0,0,0,1,0,0|0,0,2]=3 2597 B6R1.5 [C@@H]1(C[C@@H](C1)N)N MCULE-6268630823 [0,0,0,1,0,0|2,0,1]=4 2598 B6R1.5 [C@@H]1(C[C@H](C1)F)O MCULE-5214761916 [0,0,0,1,0,0|1,0,1]=3 2599 B6R1.8 C=C1CC1CO MCULE-4338601055 [0,0,0,1,0,0|1,0,0]=2 2600 B6R1.8 CC1CC1CN MCULE-2810102174 [0,0,0,1,0,0|2,0,1]=4 2601 B6R1.8 CC1CC1CN MCULE-7518062300 [0,0,0,1,0,0|2,0,1]=4 2602 B6R1.8 CC1CC1CO MCULE-5196594569 [0,0,0,1,0,0|1,0,1]=3 2603 B6R1.8 CC1OC1CBr MCULE-3133107383 [0,0,0,1,0,0|1,0,2]=4 2604 B6R1.8 CC1OC1CO MCULE-1680425960 [0,0,0,1,0,0|0,0,2]=3 2605 B6R1.8 CCC1CC1N MCULE-6304873051 [0,0,0,1,0,0|2,0,1]=4 2606 B6R1.8 CC[C@@H]1C[C@@H]1N MCULE-9218626187 [0,0,0,1,0,0|2,0,1]=4 2607 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-5365117215 [0,0,0,1,0,0|2,0,1]=4 2608 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-9993971387 [0,0,0,1,0,0|2,0,1]=4 2609 B6R1.8 CC[C@H]1C[C@@H]1N MCULE-5971477946 [0,0,0,1,0,0|2,0,1]=4 2610 B6R1.8 CC[C@H]1C[C@H]1N MCULE-4387456908 [0,0,0,1,0,0|2,0,1]=4 2611 B6R1.8 C[C@@H]1C[C@@H]1CN MCULE-5971817939 [0,0,0,1,0,0|2,0,1]=4 2612 B6R1.8 C[C@@H]1C[C@@H]1CO MCULE-7143685612 [0,0,0,1,0,0|1,0,1]=3 2613 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3418148363 [0,0,0,1,0,0|2,0,1]=4 2614 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3519756910 [0,0,0,1,0,0|2,0,1]=4 2615 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3649923384 [0,0,0,1,0,0|2,0,1]=4 2616 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-8330237030 [0,0,0,1,0,0|2,0,1]=4 2617 B6R1.8 C[C@@H]1C[C@H]1CO MCULE-3741611930 [0,0,0,1,0,0|1,0,1]=3 2618 B6R1.8 C[C@H]1C[C@@H]1CN MCULE-9856477951 [0,0,0,1,0,0|2,0,1]=4 2619 B6R1.8 C[C@H]1C[C@@H]1CO MCULE-2846304871 [0,0,0,1,0,0|1,0,1]=3 2620 B6R1.8 C[C@H]1C[C@@H]1CO MCULE-9275931471 [0,0,0,1,0,0|1,0,1]=3 2621 B6R1.8 C[C@H]1C[C@H]1CN MCULE-4949172422 [0,0,0,1,0,0|2,0,1]=4 2622 B6R1.8 C[C@H]1C[C@H]1CO MCULE-3828120088 [0,0,0,1,0,0|1,0,1]=3 2623 B6R1.8 C[C@H]1C[C@H]1CO MCULE-8442952820 [0,0,0,1,0,0|1,0,1]=3 2624 B6R1.8 NC1CC1CO MCULE-7666097515 [0,0,0,1,0,0|1,0,1]=3 2625 B6R1.8 NCC1CC1N MCULE-4864283129 [0,0,0,1,0,0|2,0,1]=4 2626 B6R1.8 NCC1CC1N MCULE-7029010792 [0,0,0,1,0,0|2,0,1]=4 2627 B6R1.8 OCC1CC1Cl MCULE-1321755136 [0,0,0,1,0,0|1,0,1]=3 2628 B6R1.8 OCC1C[C@@H]1F MCULE-2637570432 [0,0,0,1,0,0|1,0,1]=3 2629 B6R1.8 OC[C@@H]1C[C@@H]1F MCULE-9090620006 [0,0,0,1,0,0|1,0,1]=3 2630 B6R1.8 OC[C@@H]1C[C@H]1Br MCULE-8344332753 [0,0,0,1,0,0|1,0,1]=3 2631 B6R1.8 OC[C@@H]1C[C@H]1F MCULE-6282037947 [0,0,0,1,0,0|1,0,1]=3 2632 B6R1.8 OC[C@@H]1C[C@H]1F MCULE-8944803823 [0,0,0,1,0,0|1,0,1]=3 2633 B6R1.8 OC[C@H]1C[C@@H]1F MCULE-3157094299 [0,0,0,1,0,0|1,0,1]=3 2634 B6R1.9 CC1(CC1Br)C MCULE-4060390279 [0,0,0,1,0,0|2,0,1]=4 2635 B6R1.9 CC1(CC1Br)N MCULE-2545863228 [0,0,0,1,0,0|2,0,1]=4 2636 B6R1.9 CC1(CC1Br)N MCULE-6976008667 [0,0,0,1,0,0|2,0,1]=4 2637 B6R1.9 CC1(CC1N)C MCULE-3767513819 [0,0,0,1,0,0|2,0,1]=4 2638 B6R1.9 CC1(CC1N)C MCULE-9259559793 [0,0,0,1,0,0|2,0,1]=4 2639 B6R1.9 CC1(CC1O)C MCULE-2207251369 [0,0,0,1,0,0|1,0,1]=3 2640 B6R1.9 CC1(C[C@@H]1N)C MCULE-8232974349 [0,0,0,1,0,0|2,0,1]=4 2641 B6R1.9 CC1(C[C@@H]1N)C MCULE-9299327749 [0,0,0,1,0,0|2,0,1]=4 2642 B6R1.9 CC1(C[C@H]1N)C MCULE-2015844172 [0,0,0,1,0,0|2,0,1]=4 2643 B6R1.9 CC1(C[C@H]1N)C MCULE-8301129744 [0,0,0,1,0,0|2,0,1]=4 2644 B6R1.9 CC1CC1(C)N MCULE-2748884505 [0,0,0,1,0,0|2,0,1]=4 2645 B6R1.9 CC1CC1(C)N MCULE-6309103404 [0,0,0,1,0,0|2,0,1]=4 2646 B6R1.9 OC1CC1(F)F MCULE-7582982777 [0,0,0,1,0,0|2,0,1]=4 2647 B6R1.10 CC1(CCC1)N MCULE-1932351179 [0,0,0,1,0,0|2,0,1]=4 2648 B6R1.10 CC1(CCC1)N MCULE-9177696302 [0,0,0,1,0,0|2,0,1]=4 2649 B6R1.10 CC1(CCC1)O MCULE-4021675717 [0,0,0,1,0,0|1,0,2]=4 2650 B6R1.10 CC1(CCN1)C MCULE-2285435720 [0,0,0,1,0,0|2,0,1]=4 2651 B6R1.10 CC1(CCN1)C MCULE-3069932253 [0,0,0,1,0,0|2,0,1]=4 2652 B6R1.10 C[Si]1(CCC1)C MCULE-9944003023 [0,0,0,1,0,0|2,1,0]=4 2653 B6R1.10 C[Si]1(CCC1)Cl MCULE-2261277636 [0,0,0,1,0,0|2,1,0]=4 2654 B6R1.10 N=S1(=O)CCC1 MCULE-7690864417 [0,0,0,1,0,0|3,0,0]=4 2655 B6R1.10 O=S1(=O)CCC1 MCULE-7796411172 [0,0,0,1,0,0|3,0,0]=4 2656 B6R1.10 O=S1(=O)CCN1 MCULE-8786764000 [0,0,0,1,0,0|3,0,0]=4 2657 B6R1.11 C=C(C)C1CO1 MCULE-3656533343 [0,0,0,1,0,0|1,0,0]=2 2658 B6R1.11 C=C(Cl)C1CO1 MCULE-5190310903 [0,0,0,1,0,0|1,0,1]=3 2659 B6R1.11 CC(=O)C1CC1 MCULE-3846146416 [0,0,0,1,0,0|1,0,0]=2 2660 B6R1.11 CC(=O)C1CO1 MCULE-4329154079 [0,0,0,1,0,0|0,0,0]=1 2661 B6R1.11 CC(C)C1CO1 MCULE-6294069717 [0,0,0,1,0,0|1,0,1]=3 2662 B6R1.11 CC(C)[C@@H]1CO1 MCULE-9181831987 [0,0,0,1,0,0|1,0,1]=3 2663 B6R1.11 CC(C)[C@H]1CO1 MCULE-1978831452 [0,0,0,1,0,0|1,0,1]=3 2664 B6R1.11 CC(Cl)C1CC1 MCULE-7361335709 [0,0,0,1,0,0|2,0,1]=4 2665 B6R1.11 CC(N)C1CC1 MCULE-2052303800 [0,0,0,1,0,0|2,0,1]=4 2666 B6R1.11 CC(N)C1CC1 MCULE-3007763115 [0,0,0,1,0,0|2,0,1]=4 2667 B6R1.11 CC(N)C1CC1 MCULE-3459276996 [0,0,0,1,0,0|2,0,1]=4 2668 B6R1.11 CC(N)C1CC1 MCULE-6761961556 [0,0,0,1,0,0|2,0,1]=4 2669 B6R1.11 CC(O)C1CC1 MCULE-8628810684 [0,0,0,1,0,0|1,0,2]=4 2670 B6R1.11 CC(O)C1CO1 MCULE-2044990126 [0,0,0,1,0,0|0,0,2]=3 2671 B6R1.11 CN(C)C1CC1 MCULE-5891640069 [0,0,0,1,0,0|3,0,0]=4 2672 B6R1.11 CN(C)C1CC1 MCULE-6751529979 [0,0,0,1,0,0|3,0,0]=4 2673 B6R1.11 CN(N)C1CC1 MCULE-4590166937 [0,0,0,1,0,0|3,0,0]=4 2674 B6R1.11 CN(N)C1CC1 MCULE-7317282450 [0,0,0,1,0,0|3,0,0]=4 2675 B6R1.11 C[C@@H](N)C1CC1 MCULE-2097889079 [0,0,0,1,0,0|2,0,1]=4 2676 B6R1.11 C[C@@H](N)C1CC1 MCULE-3667125695 [0,0,0,1,0,0|2,0,1]=4 2677 B6R1.11 C[C@@H](N)C1CC1 MCULE-4529741221 [0,0,0,1,0,0|2,0,1]=4 2678 B6R1.11 C[C@@H](N)C1CC1 MCULE-4996656085 [0,0,0,1,0,0|2,0,1]=4 2679 B6R1.11 C[C@@H](O)C1CC1 MCULE-8359847821 [0,0,0,1,0,0|1,0,2]=4 2680 B6R1.11 C[C@H](N)C1CC1 MCULE-5080052640 [0,0,0,1,0,0|2,0,1]=4 2681 B6R1.11 C[C@H](N)C1CC1 MCULE-8331040870 [0,0,0,1,0,0|2,0,1]=4 2682 B6R1.11 C[C@H](N)C1CC1 MCULE-8367240790 [0,0,0,1,0,0|2,0,1]=4 2683 B6R1.11 C[C@H](N)C1CC1 MCULE-8726268701 [0,0,0,1,0,0|2,0,1]=4 2684 B6R1.11 C[C@H](O)C1CC1 MCULE-2458075152 [0,0,0,1,0,0|1,0,2]=4 2685 B6R1.11 N=C(N)C1CC1 MCULE-1244673727 [0,0,0,1,0,0|3,0,0]=4 2686 B6R1.11 N=C(N)C1CC1 MCULE-2494860413 [0,0,0,1,0,0|3,0,0]=4 2687 B6R1.11 NC(=O)C1CC1 MCULE-9911054913 [0,0,0,1,0,0|2,0,0]=3 2688 B6R1.11 NC(=O)C1CO1 MCULE-6911744868 [0,0,0,1,0,0|1,0,0]=2 2689 B6R1.11 NC(=S)C1CC1 MCULE-7304936539 [0,0,0,1,0,0|2,1,0]=4 2690 B6R1.11 O=C(Cl)C1CC1 MCULE-8675746452 [0,0,0,1,0,0|2,0,0]=3 2691 B6R1.11 O=C(O)C1CC1 MCULE-4677373694 [0,0,0,1,0,0|2,0,0]=3 2692 B6R1.11 O=C(O)C1CN1 MCULE-3236125597 [0,0,0,1,0,0|2,0,0]=3 2693 B6R1.11 O=C(O)C1CO1 MCULE-2152916793 [0,0,0,1,0,0|1,0,0]=2 2694 B6R1.11 O=C(O)[C@@H]1CN1 MCULE-4363753412 [0,0,0,1,0,0|2,0,0]=3 2695 B6R1.11 O=C(O)[C@H]1CN1 MCULE-4830347195 [0,0,0,1,0,0|2,0,0]=3 2696 B6R1.11 O=C(O)[C@H]1CO1 MCULE-5204459723 [0,0,0,1,0,0|1,0,0]=2 2697 B6R1.11 O=C(O)[C@H]1CO1 MCULE-6983707093 [0,0,0,1,0,0|1,0,0]=2 2698 B6R1.11 O=C([O-])C1CN1 MCULE-6490437892 [0,0,0,1,0,0|2,0,0]=3 2699 B6R1.11 O=C([O-])C1CO1 MCULE-4586459966 [0,0,0,1,0,0|1,0,0]=2 2700 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1647975669 [0,0,0,1,0,0|1,0,0]=2 2701 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1906997950 [0,0,0,1,0,0|1,0,0]=2 2702 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-4899800766 [0,0,0,1,0,0|1,0,0]=2 2703 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-9148170094 [0,0,0,1,0,0|1,0,0]=2 2704 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-6663734494 [0,0,0,1,0,0|1,0,0]=2 2705 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-8580451361 [0,0,0,1,0,0|1,0,0]=2 2706 B6R1.11 O=S(O)C1CC1 MCULE-1616243918 [0,0,0,1,0,0|3,0,0]=4 2707 B6R1.11 O=S([O-])C1CC1 MCULE-9446364072 [0,0,0,1,0,0|3,0,0]=4 2708 B3R0.1 BrCCBr MCULE-7586462642 [2,0,0,0,0,0|2,0,0]=4 2709 B3R0.1 BrCCI MCULE-8691237057 [2,0,0,0,0,0|2,0,0]=4 2710 B3R0.1 C#CC=O MCULE-4187736819 [2,0,0,0,0,0|0,0,2]=4 2711 B3R0.1 C#CCC MCULE-8090253856 [2,0,0,0,0,0|0,0,2]=4 2712 B3R0.1 C#CCO MCULE-3909200923 [2,0,0,0,0,0|0,0,2]=4 2713 B3R0.1 C/B=N/O MCULE-5227399299 [2,0,0,0,0,0|2,0,0]=4 2714 B3R0.1 C/C=C/Br MCULE-4076369660 [2,0,0,0,0,0|1,0,1]=4 2715 B3R0.1 C/C=N/O MCULE-2376410404 [2,0,0,0,0,0|1,0,0]=3 2716 B3R0.1 C=CC=O MCULE-2104890669 [2,0,0,0,0,0|0,0,2]=4 2717 B3R0.1 C=CCBr MCULE-9486454833 [2,0,0,0,0,0|1,0,1]=4 2718 B3R0.1 C=CCC MCULE-8167907130 [2,0,0,0,0,0|0,0,1]=3 2719 B3R0.1 C=CCCl MCULE-4067772785 [2,0,0,0,0,0|1,0,1]=4 2720 B3R0.1 C=CCF MCULE-7783191980 [2,0,0,0,0,0|1,0,1]=4 2721 B3R0.1 C=CCI MCULE-5037698873 [2,0,0,0,0,0|1,0,1]=4 2722 B3R0.1 C=CCN MCULE-2424616806 [2,0,0,0,0,0|1,0,1]=4 2723 B3R0.1 C=CCN MCULE-2473480946 [2,0,0,0,0,0|1,0,1]=4 2724 B3R0.1 C=CCO MCULE-2145308838 [2,0,0,0,0,0|0,0,1]=3 2725 B3R0.1 C=CCS MCULE-7270484838 [2,0,0,0,0,0|0,1,1]=4 2726 B3R0.1 C=COC MCULE-4880746684 [2,0,0,0,0,0|1,0,1]=4 2727 B3R0.1 CC#CC MCULE-3721942346 [2,0,0,0,0,0|0,0,2]=4 2728 B3R0.1 CC=CBr MCULE-2098755460 [2,0,0,0,0,0|1,0,1]=4 2729 B3R0.1 CC=CCl MCULE-9225887510 [2,0,0,0,0,0|1,0,1]=4 2730 B3R0.1 CC=NO MCULE-9761317381 [2,0,0,0,0,0|1,0,0]=3 2731 B3R0.1 CCC#N MCULE-9484970536 [2,0,0,0,0,0|1,0,1]=4 2732 B3R0.1 CCC=O MCULE-4079744837 [2,0,0,0,0,0|0,0,0]=2 2733 B3R0.1 CCCBr MCULE-2393970713 [2,0,0,0,0,0|1,0,0]=3 2734 B3R0.1 CCCC MCULE-9760497805 [2,0,0,0,0,0|0,0,1]=3 2735 B3R0.1 CCCCl MCULE-3496412829 [2,0,0,0,0,0|1,0,0]=3 2736 B3R0.1 CCCF MCULE-8540338768 [2,0,0,0,0,0|1,0,0]=3 2737 B3R0.1 CCCI MCULE-1721488805 [2,0,0,0,0,0|1,0,0]=3 2738 B3R0.1 CCCN MCULE-2885523792 [2,0,0,0,0,0|1,0,0]=3 2739 B3R0.1 CCCN MCULE-4318907091 [2,0,0,0,0,0|1,0,0]=3 2740 B3R0.1 CCCN MCULE-6330457870 [2,0,0,0,0,0|1,0,0]=3 2741 B3R0.1 CCCN MCULE-7146820007 [2,0,0,0,0,0|1,0,0]=3 2742 B3R0.1 CCCO MCULE-6252105126 [2,0,0,0,0,0|0,0,0]=2 2743 B3R0.1 CCCS MCULE-8267649092 [2,0,0,0,0,0|0,1,0]=3 2744 B3R0.1 CCNC MCULE-7215376398 [2,0,0,0,0,0|1,0,0]=3 2745 B3R0.1 CCNC MCULE-9811899205 [2,0,0,0,0,0|1,0,0]=3 2746 B3R0.1 CCNN MCULE-4753127904 [2,0,0,0,0,0|2,0,0]=4 2747 B3R0.1 CCNN MCULE-7630363192 [2,0,0,0,0,0|2,0,0]=4 2748 B3R0.1 CCNN MCULE-8402230944 [2,0,0,0,0,0|2,0,0]=4 2749 B3R0.1 CCNO MCULE-1215586669 [2,0,0,0,0,0|1,0,0]=3 2750 B3R0.1 CCNO MCULE-7075818857 [2,0,0,0,0,0|1,0,0]=3 2751 B3R0.1 CCON MCULE-5316082054 [2,0,0,0,0,0|2,0,0]=4 2752 B3R0.1 CCON MCULE-6621418839 [2,0,0,0,0,0|2,0,0]=4 2753 B3R0.1 CCO[NH3+] MCULE-7670481464 [2,0,0,0,0,0|2,0,0]=4 2754 B3R0.1 CCO[NH3+] MCULE-7871083232 [2,0,0,0,0,0|2,0,0]=4 2755 B3R0.1 CCSC MCULE-6944750263 [2,0,0,0,0,0|1,0,0]=3 2756 B3R0.1 CN=C=O MCULE-7764606582 [2,0,0,0,0,0|1,0,1]=4 2757 B3R0.1 CNC=O MCULE-4739122677 [2,0,0,0,0,0|1,0,0]=3 2758 B3R0.1 CNC=S MCULE-1018523469 [2,0,0,0,0,0|1,1,0]=4 2759 B3R0.1 CNNC MCULE-5932476941 [2,0,0,0,0,0|2,0,0]=4 2760 B3R0.1 CNNC MCULE-6419598860 [2,0,0,0,0,0|2,0,0]=4 2761 B3R0.1 CNOC MCULE-1706082503 [2,0,0,0,0,0|2,0,0]=4 2762 B3R0.1 CNOC MCULE-6224540090 [2,0,0,0,0,0|2,0,0]=4 2763 B3R0.1 COC=O MCULE-9122749354 [2,0,0,0,0,0|1,0,0]=3 2764 B3R0.1 COCBr MCULE-2566721472 [2,0,0,0,0,0|2,0,0]=4 2765 B3R0.1 COCCl MCULE-5928768006 [2,0,0,0,0,0|2,0,0]=4 2766 B3R0.1 COCI MCULE-5215132549 [2,0,0,0,0,0|2,0,0]=4 2767 B3R0.1 CSCCl MCULE-1281800596 [2,0,0,0,0,0|2,0,0]=4 2768 B3R0.1 CSSC MCULE-7451882535 [2,0,0,0,0,0|2,0,0]=4 2769 B3R0.1 C[Se][Se]C MCULE-1189700302 [2,0,0,0,0,0|2,0,0]=4 2770 B3R0.1 ClCCBr MCULE-3933774075 [2,0,0,0,0,0|2,0,0]=4 2771 B3R0.1 ClCCCl MCULE-3493741440 [2,0,0,0,0,0|2,0,0]=4 2772 B3R0.1 ClCCI MCULE-7847880962 [2,0,0,0,0,0|2,0,0]=4 2773 B3R0.1 FCCBr MCULE-3117974140 [2,0,0,0,0,0|2,0,0]=4 2774 B3R0.1 FCCCl MCULE-1862981403 [2,0,0,0,0,0|2,0,0]=4 2775 B3R0.1 FCCF MCULE-1975194621 [2,0,0,0,0,0|2,0,0]=4 2776 B3R0.1 FCCI MCULE-3689313503 [2,0,0,0,0,0|2,0,0]=4 2777 B3R0.1 ICCI MCULE-8025471988 [2,0,0,0,0,0|2,0,0]=4 2778 B3R0.1 N/C=N/O MCULE-9567664507 [2,0,0,0,0,0|2,0,0]=4 2779 B3R0.1 NCCBr MCULE-3401124597 [2,0,0,0,0,0|2,0,0]=4 2780 B3R0.1 NCCBr MCULE-6215378497 [2,0,0,0,0,0|2,0,0]=4 2781 B3R0.1 NCCCl MCULE-1458699843 [2,0,0,0,0,0|2,0,0]=4 2782 B3R0.1 NCCCl MCULE-6944306112 [2,0,0,0,0,0|2,0,0]=4 2783 B3R0.1 NCCF MCULE-1670520169 [2,0,0,0,0,0|2,0,0]=4 2784 B3R0.1 NCCF MCULE-4963351029 [2,0,0,0,0,0|2,0,0]=4 2785 B3R0.1 NCCI MCULE-6905308399 [2,0,0,0,0,0|2,0,0]=4 2786 B3R0.1 NCCI MCULE-7487764362 [2,0,0,0,0,0|2,0,0]=4 2787 B3R0.1 NCCN MCULE-4740333723 [2,0,0,0,0,0|2,0,0]=4 2788 B3R0.1 NCCN MCULE-6795272853 [2,0,0,0,0,0|2,0,0]=4 2789 B3R0.1 NCCN MCULE-8304126024 [2,0,0,0,0,0|2,0,0]=4 2790 B3R0.1 NCCN MCULE-8325612144 [2,0,0,0,0,0|2,0,0]=4 2791 B3R0.1 NCCO MCULE-5175116598 [2,0,0,0,0,0|1,0,0]=3 2792 B3R0.1 NCCO MCULE-8624730373 [2,0,0,0,0,0|1,0,0]=3 2793 B3R0.1 NCCS MCULE-1838427828 [2,0,0,0,0,0|1,1,0]=4 2794 B3R0.1 NCCS MCULE-2418938683 [2,0,0,0,0,0|1,1,0]=4 2795 B3R0.1 NNC=O MCULE-6986968107 [2,0,0,0,0,0|2,0,0]=4 2796 B3R0.1 NOC=O MCULE-4489199776 [2,0,0,0,0,0|2,0,0]=4 2797 B3R0.1 O=CC=O MCULE-3212938778 [2,0,0,0,0,0|0,0,2]=4 2798 B3R0.1 O=CCBr MCULE-9076011270 [2,0,0,0,0,0|1,0,0]=3 2799 B3R0.1 O=CCCl MCULE-7307216184 [2,0,0,0,0,0|1,0,0]=3 2800 B3R0.1 O=CCI MCULE-1146810366 [2,0,0,0,0,0|1,0,0]=3 2801 B3R0.1 OCCBr MCULE-5097256006 [2,0,0,0,0,0|1,0,0]=3 2802 B3R0.1 OCCCl MCULE-5139580173 [2,0,0,0,0,0|1,0,0]=3 2803 B3R0.1 OCCF MCULE-7590677201 [2,0,0,0,0,0|1,0,0]=3 2804 B3R0.1 OCCI MCULE-8359750387 [2,0,0,0,0,0|1,0,0]=3 2805 B3R0.1 OCCO MCULE-6366313128 [2,0,0,0,0,0|0,0,1]=3 2806 B3R0.1 OCCS MCULE-2252943288 [2,0,0,0,0,0|0,1,0]=3 2807 B3R0.1 PCCP MCULE-2159678577 [2,0,0,0,0,0|2,0,0]=4 2808 B3R0.1 SCCBr MCULE-5899941299 [2,0,0,0,0,0|1,1,0]=4 2809 B3R0.1 SCCS MCULE-8277435664 [2,0,0,0,0,0|0,2,0]=4 2810 B3R0.1 [NH3+]CCS MCULE-6407472407 [2,0,0,0,0,0|1,1,0]=4 2811 B3R0.1 [NH3+]CC[NH3+] MCULE-5313549416 [2,0,0,0,0,0|2,0,0]=4 2812 B3R0.2 BN(C)C MCULE-2470964161 [2,0,0,0,0,0|2,0,0]=4 2813 B3R0.2 C=C(C)Br MCULE-7805530064 [2,0,0,0,0,0|1,0,1]=4 2814 B3R0.2 C=C(C)C MCULE-5640095130 [2,0,0,0,0,0|1,0,0]=3 2815 B3R0.2 C=C(C)Cl MCULE-1752401095 [2,0,0,0,0,0|1,0,1]=4 2816 B3R0.2 C=C(C)F MCULE-3213198231 [2,0,0,0,0,0|1,0,1]=4 2817 B3R0.2 C=[N+](C)C MCULE-4450980212 [2,0,0,0,0,0|2,0,0]=4 2818 B3R0.2 C=[N+](C)C MCULE-5309464837 [2,0,0,0,0,0|2,0,0]=4 2819 B3R0.2 C=[N+](C)C MCULE-9321779445 [2,0,0,0,0,0|2,0,0]=4 2820 B3R0.2 CB(O)O MCULE-3510763826 [2,0,0,0,0,0|1,0,1]=4 2821 B3R0.2 CC(=N)N MCULE-3235425606 [2,0,0,0,0,0|2,0,0]=4 2822 B3R0.2 CC(=N)N MCULE-3546679379 [2,0,0,0,0,0|2,0,0]=4 2823 B3R0.2 CC(=N)N MCULE-3597638887 [2,0,0,0,0,0|2,0,0]=4 2824 B3R0.2 CC(=N)N MCULE-9831274654 [2,0,0,0,0,0|2,0,0]=4 2825 B3R0.2 CC(=O)Br MCULE-4892265063 [2,0,0,0,0,0|1,0,0]=3 2826 B3R0.2 CC(=O)C MCULE-6679625040 [2,0,0,0,0,0|0,0,0]=2 2827 B3R0.2 CC(=O)Cl MCULE-9041746362 [2,0,0,0,0,0|1,0,0]=3 2828 B3R0.2 CC(=O)I MCULE-4812718701 [2,0,0,0,0,0|1,0,0]=3 2829 B3R0.2 CC(=O)N MCULE-9280264861 [2,0,0,0,0,0|1,0,0]=3 2830 B3R0.2 CC(=O)O MCULE-1502330578 [2,0,0,0,0,0|0,0,0]=2 2831 B3R0.2 CC(=O)O MCULE-5514028500 [2,0,0,0,0,0|0,0,0]=2 2832 B3R0.2 CC(=O)O MCULE-5942589566 [2,0,0,0,0,0|0,0,0]=2 2833 B3R0.2 CC(=O)O MCULE-6780070129 [2,0,0,0,0,0|0,0,0]=2 2834 B3R0.2 CC(=O)O MCULE-8295936189 [2,0,0,0,0,0|0,0,0]=2 2835 B3R0.2 CC(=O)O MCULE-9103972283 [2,0,0,0,0,0|0,0,0]=2 2836 B3R0.2 CC(=O)O MCULE-9900518424 [2,0,0,0,0,0|0,0,0]=2 2837 B3R0.2 CC(=O)S MCULE-5769447035 [2,0,0,0,0,0|0,1,0]=3 2838 B3R0.2 CC(=O)[O-] MCULE-2314460022 [2,0,0,0,0,0|0,0,1]=3 2839 B3R0.2 CC(=O)[O-] MCULE-2960771771 [2,0,0,0,0,0|0,0,1]=3 2840 B3R0.2 CC(=O)[O-] MCULE-5334052410 [2,0,0,0,0,0|0,0,1]=3 2841 B3R0.2 CC(=O)[O-] MCULE-5482908386 [2,0,0,0,0,0|0,0,1]=3 2842 B3R0.2 CC(=O)[O-] MCULE-9723570182 [2,0,0,0,0,0|0,0,1]=3 2843 B3R0.2 CC(=O)[O-] MCULE-9910426896 [2,0,0,0,0,0|0,0,1]=3 2844 B3R0.2 CC(=S)N MCULE-4635097605 [2,0,0,0,0,0|1,1,0]=4 2845 B3R0.2 CC(=S)[O-] MCULE-1878530758 [2,0,0,0,0,0|0,1,1]=4 2846 B3R0.2 CC(C)Br MCULE-4068304617 [2,0,0,0,0,0|1,0,1]=4 2847 B3R0.2 CC(C)C MCULE-6616676274 [2,0,0,0,0,0|1,0,1]=4 2848 B3R0.2 CC(C)Cl MCULE-3190141598 [2,0,0,0,0,0|1,0,1]=4 2849 B3R0.2 CC(C)F MCULE-5333357055 [2,0,0,0,0,0|1,0,1]=4 2850 B3R0.2 CC(C)I MCULE-6151711033 [2,0,0,0,0,0|1,0,1]=4 2851 B3R0.2 CC(C)N MCULE-1048799006 [2,0,0,0,0,0|1,0,1]=4 2852 B3R0.2 CC(C)N MCULE-1125416142 [2,0,0,0,0,0|1,0,1]=4 2853 B3R0.2 CC(C)N MCULE-2418429353 [2,0,0,0,0,0|1,0,1]=4 2854 B3R0.2 CC(C)N MCULE-7280647435 [2,0,0,0,0,0|1,0,1]=4 2855 B3R0.2 CC(C)O MCULE-6646752234 [2,0,0,0,0,0|0,0,2]=4 2856 B3R0.2 CC(C)S MCULE-8283942088 [2,0,0,0,0,0|0,1,1]=4 2857 B3R0.2 CN(=O)=O MCULE-8704524604 [2,0,0,0,0,0|1,0,1]=4 2858 B3R0.2 CN(C)C MCULE-5179437979 [2,0,0,0,0,0|2,0,0]=4 2859 B3R0.2 CN(C)C MCULE-6816696733 [2,0,0,0,0,0|2,0,0]=4 2860 B3R0.2 CN(C)C MCULE-7903544426 [2,0,0,0,0,0|2,0,0]=4 2861 B3R0.2 CN(C)N MCULE-7177216911 [2,0,0,0,0,0|2,0,0]=4 2862 B3R0.2 CN(C)N MCULE-8775366011 [2,0,0,0,0,0|2,0,0]=4 2863 B3R0.2 CN(C)O MCULE-6572915706 [2,0,0,0,0,0|1,0,1]=4 2864 B3R0.2 CN(C)O MCULE-6950647562 [2,0,0,0,0,0|1,0,1]=4 2865 B3R0.2 CP(=O)C MCULE-6150886622 [2,0,0,0,0,0|1,0,0]=3 2866 B3R0.2 CP(C)C MCULE-6703190251 [2,0,0,0,0,0|2,0,0]=4 2867 B3R0.2 CS(=O)C MCULE-2005841258 [2,0,0,0,0,0|1,0,0]=3 2868 B3R0.2 CS(=O)Cl MCULE-1292201352 [2,0,0,0,0,0|2,0,0]=4 2869 B3R0.2 CS(=O)N MCULE-5162949591 [2,0,0,0,0,0|2,0,0]=4 2870 B3R0.2 CS(=O)O MCULE-8711306710 [2,0,0,0,0,0|1,0,0]=3 2871 B3R0.2 CS(=O)[O-] MCULE-1437194827 [2,0,0,0,0,0|1,0,1]=4 2872 B3R0.2 C[Ga](C)C MCULE-6013775603 [2,0,0,0,0,0|2,0,0]=4 2873 B3R0.2 C[In](C)C MCULE-1424187192 [2,0,0,0,0,0|2,0,0]=4 2874 B3R0.2 C[O+](C)C MCULE-2925451414 [2,0,0,0,0,0|2,0,0]=4 2875 B3R0.2 C[S+](C)Br MCULE-2734391695 [2,0,0,0,0,0|2,0,0]=4 2876 B3R0.2 C[S+](C)Br MCULE-6411921824 [2,0,0,0,0,0|2,0,0]=4 2877 B3R0.2 C[S+](C)C MCULE-5867625832 [2,0,0,0,0,0|2,0,0]=4 2878 B3R0.2 C[S+](C)C MCULE-7678314643 [2,0,0,0,0,0|2,0,0]=4 2879 B3R0.2 C[S+](C)C MCULE-8005905986 [2,0,0,0,0,0|2,0,0]=4 2880 B3R0.2 C[Se](=O)C MCULE-4596040471 [2,0,0,0,0,0|1,0,0]=3 2881 B3R0.2 C[Se](=O)O MCULE-5568767851 [2,0,0,0,0,0|1,0,0]=3 2882 B3R0.2 NC(=O)N MCULE-3224868954 [2,0,0,0,0,0|2,0,0]=4 2883 B3R0.2 NC(=O)N MCULE-8513891094 [2,0,0,0,0,0|2,0,0]=4 2884 B3R0.2 NC(=O)O MCULE-1579038047 [2,0,0,0,0,0|1,0,0]=3 2885 B3R0.2 NC(=O)O MCULE-3232812015 [2,0,0,0,0,0|1,0,0]=3 2886 B3R0.2 O=C(Cl)[Au] MCULE-6601882022 [2,0,0,0,0,0|2,0,0]=4 2887 B3R0.2 O=C(O)O MCULE-3743781291 [2,0,0,0,0,0|1,0,0]=3 2888 B3R0.2 O=C(O)O MCULE-6373078171 [2,0,0,0,0,0|1,0,0]=3 2889 B3R0.2 O=C([O-])O MCULE-5529655359 [2,0,0,0,0,0|1,0,0]=3 2890 B3R0.2 O=C([O-])O MCULE-7293729150 [2,0,0,0,0,0|1,0,0]=3 2891 B3R0.2 O=C([O-])[O-] MCULE-1092668330 [2,0,0,0,0,0|1,0,1]=4 2892 B3R0.2 O=C([O-])[O-] MCULE-1095103800 [2,0,0,0,0,0|1,0,1]=4 2893 B3R0.2 O=C([O-])[O-] MCULE-1597066471 [2,0,0,0,0,0|1,0,1]=4 2894 B3R0.2 O=C([O-])[O-] MCULE-2005483457 [2,0,0,0,0,0|1,0,1]=4 2895 B3R0.2 O=C([O-])[O-] MCULE-3299525070 [2,0,0,0,0,0|1,0,1]=4 2896 B3R0.2 O=C([O-])[O-] MCULE-4074516840 [2,0,0,0,0,0|1,0,1]=4 2897 B3R0.2 O=C([O-])[O-] MCULE-4180727513 [2,0,0,0,0,0|1,0,1]=4 2898 B3R0.2 O=C([O-])[O-] MCULE-4294265087 [2,0,0,0,0,0|1,0,1]=4 2899 B3R0.2 O=C([O-])[O-] MCULE-5127021441 [2,0,0,0,0,0|1,0,1]=4 2900 B3R0.2 O=C([O-])[O-] MCULE-5345790821 [2,0,0,0,0,0|1,0,1]=4 2901 B3R0.2 O=C([O-])[O-] MCULE-6214917073 [2,0,0,0,0,0|1,0,1]=4 2902 B3R0.2 O=C([O-])[O-] MCULE-6757968396 [2,0,0,0,0,0|1,0,1]=4 2903 B3R0.2 O=C([O-])[O-] MCULE-7714638074 [2,0,0,0,0,0|1,0,1]=4 2904 B3R0.2 O=C([O-])[O-] MCULE-8731559807 [2,0,0,0,0,0|1,0,1]=4 2905 B3R0.2 O=I(=O)O MCULE-6335954469 [2,0,0,0,0,0|2,0,0]=4 2906 B3R0.2 O=I(=O)O MCULE-7906123102 [2,0,0,0,0,0|2,0,0]=4 2907 B3R0.2 O=N(=O)O MCULE-5926867268 [2,0,0,0,0,0|2,0,0]=4 2908 B3R0.2 O=N(=O)O MCULE-8501453871 [2,0,0,0,0,0|2,0,0]=4 2909 B3R0.2 O=P(=O)O MCULE-3007887617 [2,0,0,0,0,0|2,0,0]=4 2910 B3R0.2 O=P(O)O MCULE-8889145943 [2,0,0,0,0,0|2,0,0]=4 2911 B3R0.2 O=P([O-])O MCULE-3773885400 [2,0,0,0,0,0|2,0,0]=4 2912 B3R0.2 O=P([O-])O MCULE-6745348516 [2,0,0,0,0,0|2,0,0]=4 2913 B3R0.2 O=S(=O)O MCULE-7070708516 [2,0,0,0,0,0|2,0,0]=4 2914 B3R0.2 O=S(O)O MCULE-3188569799 [2,0,0,0,0,0|2,0,0]=4 2915 B3R0.2 O=S(O)O MCULE-7812738469 [2,0,0,0,0,0|2,0,0]=4 2916 B3R0.2 O=[Se](O)O MCULE-9081277469 [2,0,0,0,0,0|2,0,0]=4 2917 B3R0.2 O=[Si](O)O MCULE-3228936275 [2,0,0,0,0,0|1,1,0]=4 2918 B5R0.3 C#CC(=O)CC MCULE-1563732373 [1,1,0,0,0,0|0,0,1]=3 2919 B5R0.3 C#CC(=O)NC MCULE-8852565705 [1,1,0,0,0,0|0,0,2]=4 2920 B5R0.3 C#CC(=O)OC MCULE-5108326717 [1,1,0,0,0,0|0,0,2]=4 2921 B5R0.3 C/C(=C\N)/C=O MCULE-4713460468 [1,1,0,0,0,0|1,0,1]=4 2922 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [1,1,0,0,0,0|1,0,0]=3 2923 B5R0.3 C/C=C(\C)/C=O MCULE-2818872726 [1,1,0,0,0,0|0,0,1]=3 2924 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [1,1,0,0,0,0|1,0,0]=3 2925 B5R0.3 C/N=C(\N)/SC MCULE-1114021101 [1,1,0,0,0,0|2,0,0]=4 2926 B5R0.3 C/N=C(\N)/SC MCULE-4249574209 [1,1,0,0,0,0|2,0,0]=4 2927 B5R0.3 C=C(C#N)CO MCULE-4330549804 [1,1,0,0,0,0|1,0,1]=4 2928 B5R0.3 C=C(C=O)CC MCULE-2875154067 [1,1,0,0,0,0|0,0,1]=3 2929 B5R0.3 C=C(CBr)CBr MCULE-2855078657 [1,1,0,0,0,0|2,0,0]=4 2930 B5R0.3 C=C(CC)CBr MCULE-1652422688 [1,1,0,0,0,0|1,0,0]=3 2931 B5R0.3 C=C(CC)CC MCULE-9174509622 [1,1,0,0,0,0|1,0,0]=3 2932 B5R0.3 C=C(CC)CN MCULE-2269385026 [1,1,0,0,0,0|1,0,0]=3 2933 B5R0.3 C=C(CC)CN MCULE-3033447984 [1,1,0,0,0,0|1,0,0]=3 2934 B5R0.3 C=C(CC)CO MCULE-8127766352 [1,1,0,0,0,0|1,0,0]=3 2935 B5R0.3 C=C(CCl)CCl MCULE-2574913289 [1,1,0,0,0,0|2,0,0]=4 2936 B5R0.3 C=C(CI)CI MCULE-7592017619 [1,1,0,0,0,0|2,0,0]=4 2937 B5R0.3 C=C(CN)CN MCULE-5063132725 [1,1,0,0,0,0|2,0,0]=4 2938 B5R0.3 C=C(CO)CBr MCULE-9563589949 [1,1,0,0,0,0|1,0,0]=3 2939 B5R0.3 C=C(CO)CO MCULE-2682601949 [1,1,0,0,0,0|1,0,0]=3 2940 B5R0.3 C=C(SC)SC MCULE-8497326619 [1,1,0,0,0,0|2,0,0]=4 2941 B5R0.3 C=C/C(=C/C)/C MCULE-6445909882 [1,1,0,0,0,0|1,0,1]=4 2942 B5R0.3 C=CC(=CC)C MCULE-8585683674 [1,1,0,0,0,0|1,0,1]=4 2943 B5R0.3 C=CC(=O)CC MCULE-7277696617 [1,1,0,0,0,0|0,0,1]=3 2944 B5R0.3 C=CC(=O)NC MCULE-5619481947 [1,1,0,0,0,0|0,0,2]=4 2945 B5R0.3 C=CC(=O)NO MCULE-9528737042 [1,1,0,0,0,0|1,0,1]=4 2946 B5R0.3 C=CC(=O)OC MCULE-6010665978 [1,1,0,0,0,0|0,0,2]=4 2947 B5R0.3 C=CC(C)CC MCULE-8112547661 [1,1,0,0,0,0|1,0,1]=4 2948 B5R0.3 CC(=CCl)CCl MCULE-2732105685 [1,1,0,0,0,0|2,0,0]=4 2949 B5R0.3 CC(=CI)CI MCULE-3347686188 [1,1,0,0,0,0|2,0,0]=4 2950 B5R0.3 CC(=CI)CO MCULE-8491569199 [1,1,0,0,0,0|1,0,0]=3 2951 B5R0.3 CC(=CN)C=O MCULE-5507488903 [1,1,0,0,0,0|1,0,1]=4 2952 B5R0.3 CC(=NO)CS MCULE-9694340512 [1,1,0,0,0,0|0,1,1]=4 2953 B5R0.3 CC(C#N)CO MCULE-1644391554 [1,1,0,0,0,0|1,0,1]=4 2954 B5R0.3 CC(CN)CO MCULE-5880795484 [1,1,0,0,0,0|1,0,1]=4 2955 B5R0.3 CC(CN)CO MCULE-8083007887 [1,1,0,0,0,0|1,0,1]=4 2956 B5R0.3 CC(CO)CBr MCULE-3815333295 [1,1,0,0,0,0|1,0,1]=4 2957 B5R0.3 CC(CO)CBr MCULE-5695891877 [1,1,0,0,0,0|1,0,1]=4 2958 B5R0.3 CC(CO)CO MCULE-2340730326 [1,1,0,0,0,0|0,0,2]=4 2959 B5R0.3 CC(CO)CS MCULE-1990992504 [1,1,0,0,0,0|0,1,1]=4 2960 B5R0.3 CC(CO)NN MCULE-3362748538 [1,1,0,0,0,0|1,0,1]=4 2961 B5R0.3 CC(CO)NN MCULE-4440318216 [1,1,0,0,0,0|1,0,1]=4 2962 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [1,1,0,0,0,0|0,0,1]=3 2963 B5R0.3 CC/C(=N/O)/N MCULE-2794748611 [1,1,0,0,0,0|1,0,1]=4 2964 B5R0.3 CC/C(=N/O)/N MCULE-7162577220 [1,1,0,0,0,0|1,0,1]=4 2965 B5R0.3 CC=C(Br)C=O MCULE-4703333701 [1,1,0,0,0,0|1,0,1]=4 2966 B5R0.3 CC=C(C)C#N MCULE-4009455127 [1,1,0,0,0,0|1,0,1]=4 2967 B5R0.3 CC=C(C)C=O MCULE-9453566957 [1,1,0,0,0,0|0,0,1]=3 2968 B5R0.3 CC=C(C)CC MCULE-5790494157 [1,1,0,0,0,0|1,0,0]=3 2969 B5R0.3 CC=C(C)CCl MCULE-2444762050 [1,1,0,0,0,0|1,0,1]=4 2970 B5R0.3 CCC(=N)OC MCULE-4123543795 [1,1,0,0,0,0|1,0,0]=3 2971 B5R0.3 CCC(=N)OC MCULE-5346320805 [1,1,0,0,0,0|1,0,0]=3 2972 B5R0.3 CCC(=NO)C MCULE-1859652505 [1,1,0,0,0,0|0,0,1]=3 2973 B5R0.3 CCC(=O)CBr MCULE-7825573294 [1,1,0,0,0,0|0,0,0]=2 2974 B5R0.3 CCC(=O)CC MCULE-8236549739 [1,1,0,0,0,0|0,0,0]=2 2975 B5R0.3 CCC(=O)CCl MCULE-9019890380 [1,1,0,0,0,0|0,0,0]=2 2976 B5R0.3 CCC(=O)CN MCULE-1863418812 [1,1,0,0,0,0|0,0,0]=2 2977 B5R0.3 CCC(=O)CN MCULE-5831164340 [1,1,0,0,0,0|0,0,0]=2 2978 B5R0.3 CCC(=O)CO MCULE-8674894820 [1,1,0,0,0,0|0,0,0]=2 2979 B5R0.3 CCC(=O)NC MCULE-5612060170 [1,1,0,0,0,0|0,0,0]=2 2980 B5R0.3 CCC(=O)NN MCULE-1803705917 [1,1,0,0,0,0|1,0,0]=3 2981 B5R0.3 CCC(=O)NO MCULE-1033164448 [1,1,0,0,0,0|1,0,0]=3 2982 B5R0.3 CCC(=O)OC MCULE-7384824725 [1,1,0,0,0,0|0,0,0]=2 2983 B5R0.3 CCC(=O)SC MCULE-9712192191 [1,1,0,0,0,0|0,0,0]=2 2984 B5R0.3 CCC(Br)C=O MCULE-3064952987 [1,1,0,0,0,0|1,0,1]=4 2985 B5R0.3 CCC(Br)CBr MCULE-5254958560 [1,1,0,0,0,0|1,0,1]=4 2986 B5R0.3 CCC(Br)CC MCULE-7435628721 [1,1,0,0,0,0|1,0,1]=4 2987 B5R0.3 CCC(Br)CO MCULE-7211805716 [1,1,0,0,0,0|1,0,1]=4 2988 B5R0.3 CCC(C)C#N MCULE-6204122967 [1,1,0,0,0,0|1,0,1]=4 2989 B5R0.3 CCC(C)C=O MCULE-2523669899 [1,1,0,0,0,0|0,0,1]=3 2990 B5R0.3 CCC(C)CBr MCULE-5451416952 [1,1,0,0,0,0|1,0,1]=4 2991 B5R0.3 CCC(C)CC MCULE-2542807917 [1,1,0,0,0,0|1,0,1]=4 2992 B5R0.3 CCC(C)CCl MCULE-7450386476 [1,1,0,0,0,0|1,0,1]=4 2993 B5R0.3 CCC(C)CI MCULE-5444509280 [1,1,0,0,0,0|1,0,1]=4 2994 B5R0.3 CCC(C)CN MCULE-2777327284 [1,1,0,0,0,0|1,0,1]=4 2995 B5R0.3 CCC(C)CN MCULE-7014901600 [1,1,0,0,0,0|1,0,1]=4 2996 B5R0.3 CCC(C)CO MCULE-6521026296 [1,1,0,0,0,0|0,0,2]=4 2997 B5R0.3 CCC(C)CS MCULE-7795095685 [1,1,0,0,0,0|0,1,1]=4 2998 B5R0.3 CCC(C)NC MCULE-2676584804 [1,1,0,0,0,0|1,0,1]=4 2999 B5R0.3 CCC(C)NC MCULE-6158046887 [1,1,0,0,0,0|1,0,1]=4 3000 B5R0.3 CCC(C)NN MCULE-6074476998 [1,1,0,0,0,0|1,0,1]=4 3001 B5R0.3 CCC(C)NN MCULE-8130021960 [1,1,0,0,0,0|1,0,1]=4 3002 B5R0.3 CCC(C)NN MCULE-8519369369 [1,1,0,0,0,0|1,0,1]=4 3003 B5R0.3 CCC(C)NO MCULE-1247092627 [1,1,0,0,0,0|0,0,2]=4 3004 B5R0.3 CCC(C)NO MCULE-6169819668 [1,1,0,0,0,0|0,0,2]=4 3005 B5R0.3 CCC(C)OC MCULE-7354431606 [1,1,0,0,0,0|0,0,2]=4 3006 B5R0.3 CCC(C)ON MCULE-2907890438 [1,1,0,0,0,0|0,0,2]=4 3007 B5R0.3 CCC(C)ON MCULE-4364205813 [1,1,0,0,0,0|0,0,2]=4 3008 B5R0.3 CCC(Cl)C=O MCULE-5238776091 [1,1,0,0,0,0|1,0,1]=4 3009 B5R0.3 CCC(Cl)CCl MCULE-5122022797 [1,1,0,0,0,0|1,0,1]=4 3010 B5R0.3 CCC(Cl)CO MCULE-1756262629 [1,1,0,0,0,0|1,0,1]=4 3011 B5R0.3 CCC(F)CBr MCULE-3226052264 [1,1,0,0,0,0|1,0,1]=4 3012 B5R0.3 CCC(F)CN MCULE-1291385596 [1,1,0,0,0,0|1,0,1]=4 3013 B5R0.3 CCC(F)CN MCULE-7421331323 [1,1,0,0,0,0|1,0,1]=4 3014 B5R0.3 CCC(I)CC MCULE-1119844552 [1,1,0,0,0,0|1,0,1]=4 3015 B5R0.3 CCC(N)CBr MCULE-3567691924 [1,1,0,0,0,0|1,0,1]=4 3016 B5R0.3 CCC(N)CC MCULE-4261937519 [1,1,0,0,0,0|1,0,1]=4 3017 B5R0.3 CCC(N)CC MCULE-5899128891 [1,1,0,0,0,0|1,0,1]=4 3018 B5R0.3 CCC(N)CN MCULE-6911484065 [1,1,0,0,0,0|1,0,1]=4 3019 B5R0.3 CCC(N)CN MCULE-8376506697 [1,1,0,0,0,0|1,0,1]=4 3020 B5R0.3 CCC(N)CO MCULE-1135809021 [1,1,0,0,0,0|1,0,1]=4 3021 B5R0.3 CCC(N)CO MCULE-7588854111 [1,1,0,0,0,0|1,0,1]=4 3022 B5R0.3 CCC(O)CBr MCULE-4205031860 [1,1,0,0,0,0|0,0,2]=4 3023 B5R0.3 CCC(O)CC MCULE-5553645045 [1,1,0,0,0,0|0,0,2]=4 3024 B5R0.3 CCC(O)CCl MCULE-8359810208 [1,1,0,0,0,0|0,0,2]=4 3025 B5R0.3 CCC(O)CN MCULE-5197026448 [1,1,0,0,0,0|0,0,2]=4 3026 B5R0.3 CCC(O)CO MCULE-2488753438 [1,1,0,0,0,0|0,0,2]=4 3027 B5R0.3 CCC(O)CO MCULE-7297282094 [1,1,0,0,0,0|0,0,2]=4 3028 B5R0.3 CCC(S)CC MCULE-2556259434 [1,1,0,0,0,0|0,1,1]=4 3029 B5R0.3 CCC(S)CS MCULE-9332449950 [1,1,0,0,0,0|0,1,1]=4 3030 B5R0.3 CCC([NH3+])CBr MCULE-6971158198 [1,1,0,0,0,0|1,0,1]=4 3031 B5R0.3 CCN(C)C#N MCULE-1247613129 [1,1,0,0,0,0|2,0,0]=4 3032 B5R0.3 CCN(C)C=O MCULE-2308681384 [1,1,0,0,0,0|1,0,0]=3 3033 B5R0.3 CCN(C)CC MCULE-7207964917 [1,1,0,0,0,0|2,0,0]=4 3034 B5R0.3 CCN(N)CC MCULE-9853386945 [1,1,0,0,0,0|2,0,0]=4 3035 B5R0.3 CCN(N)CC MCULE-9962617398 [1,1,0,0,0,0|2,0,0]=4 3036 B5R0.3 CCN(O)CC MCULE-6022935768 [1,1,0,0,0,0|1,0,1]=4 3037 B5R0.3 CCP(=O)CC MCULE-2216184595 [1,1,0,0,0,0|1,0,0]=3 3038 B5R0.3 CCP(Cl)CC MCULE-4484529264 [1,1,0,0,0,0|2,0,0]=4 3039 B5R0.3 CCS(=O)CC MCULE-5102735179 [1,1,0,0,0,0|1,0,0]=3 3040 B5R0.3 CC[C@@H](C)CBr MCULE-5675886072 [1,1,0,0,0,0|1,0,1]=4 3041 B5R0.3 CC[C@@H](C)CN MCULE-7612408107 [1,1,0,0,0,0|1,0,1]=4 3042 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [1,1,0,0,0,0|0,0,2]=4 3043 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [1,1,0,0,0,0|0,0,2]=4 3044 B5R0.3 CC[C@@H](N)CO MCULE-3821348404 [1,1,0,0,0,0|1,0,1]=4 3045 B5R0.3 CC[C@@H](N)CO MCULE-7190248306 [1,1,0,0,0,0|1,0,1]=4 3046 B5R0.3 CC[C@@H](O)CN MCULE-2854535153 [1,1,0,0,0,0|0,0,2]=4 3047 B5R0.3 CC[C@@H](O)CN MCULE-8228547956 [1,1,0,0,0,0|0,0,2]=4 3048 B5R0.3 CC[C@@H](O)CO MCULE-3948477298 [1,1,0,0,0,0|0,0,2]=4 3049 B5R0.3 CC[C@@H](O)CO MCULE-5098109795 [1,1,0,0,0,0|0,0,2]=4 3050 B5R0.3 CC[C@H](C)C#N MCULE-9118306872 [1,1,0,0,0,0|1,0,1]=4 3051 B5R0.3 CC[C@H](C)CBr MCULE-3263714447 [1,1,0,0,0,0|1,0,1]=4 3052 B5R0.3 CC[C@H](C)CBr MCULE-3384648570 [1,1,0,0,0,0|1,0,1]=4 3053 B5R0.3 CC[C@H](C)CCl MCULE-6795758745 [1,1,0,0,0,0|1,0,1]=4 3054 B5R0.3 CC[C@H](C)CCl MCULE-8147276830 [1,1,0,0,0,0|1,0,1]=4 3055 B5R0.3 CC[C@H](C)CI MCULE-9690776923 [1,1,0,0,0,0|1,0,1]=4 3056 B5R0.3 CC[C@H](C)CN MCULE-1380819951 [1,1,0,0,0,0|1,0,1]=4 3057 B5R0.3 CC[C@H](C)CN MCULE-1396096112 [1,1,0,0,0,0|1,0,1]=4 3058 B5R0.3 CC[C@H](C)CN MCULE-2971933862 [1,1,0,0,0,0|1,0,1]=4 3059 B5R0.3 CC[C@H](C)CN MCULE-3698084674 [1,1,0,0,0,0|1,0,1]=4 3060 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [1,1,0,0,0,0|0,0,2]=4 3061 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [1,1,0,0,0,0|0,0,2]=4 3062 B5R0.3 CC[C@H](N)CF MCULE-3646304583 [1,1,0,0,0,0|1,0,1]=4 3063 B5R0.3 CC[C@H](N)CF MCULE-4493834638 [1,1,0,0,0,0|1,0,1]=4 3064 B5R0.3 CC[C@H](N)CO MCULE-5500083870 [1,1,0,0,0,0|1,0,1]=4 3065 B5R0.3 CC[C@H](N)CO MCULE-6312512384 [1,1,0,0,0,0|1,0,1]=4 3066 B5R0.3 CC[C@H](O)CN MCULE-4385930741 [1,1,0,0,0,0|0,0,2]=4 3067 B5R0.3 CC[C@H](O)CO MCULE-2194264642 [1,1,0,0,0,0|0,0,2]=4 3068 B5R0.3 CC[C@H](O)CO MCULE-5503575962 [1,1,0,0,0,0|0,0,2]=4 3069 B5R0.3 CNC(=N)CO MCULE-3239749882 [1,1,0,0,0,0|1,0,0]=3 3070 B5R0.3 CNC(=N)NC MCULE-7703075263 [1,1,0,0,0,0|2,0,0]=4 3071 B5R0.3 CNC(=O)CBr MCULE-1439209307 [1,1,0,0,0,0|1,0,0]=3 3072 B5R0.3 CNC(=O)CCl MCULE-1437904095 [1,1,0,0,0,0|1,0,0]=3 3073 B5R0.3 CNC(=O)CI MCULE-1687694185 [1,1,0,0,0,0|1,0,0]=3 3074 B5R0.3 CNC(=O)CN MCULE-1901033297 [1,1,0,0,0,0|1,0,0]=3 3075 B5R0.3 CNC(=O)CN MCULE-8532774234 [1,1,0,0,0,0|1,0,0]=3 3076 B5R0.3 CNC(=O)CO MCULE-5899226107 [1,1,0,0,0,0|0,0,0]=2 3077 B5R0.3 CNC(=O)CS MCULE-7032391129 [1,1,0,0,0,0|0,1,0]=3 3078 B5R0.3 CNC(=O)NC MCULE-5319497155 [1,1,0,0,0,0|1,0,0]=3 3079 B5R0.3 CNC(=O)NN MCULE-2093843774 [1,1,0,0,0,0|2,0,0]=4 3080 B5R0.3 CNC(=O)OC MCULE-1162861376 [1,1,0,0,0,0|1,0,0]=3 3081 B5R0.3 CNC(=S)NC MCULE-7998520647 [1,1,0,0,0,0|1,1,0]=4 3082 B5R0.3 CNC(C)CO MCULE-3841057780 [1,1,0,0,0,0|1,0,1]=4 3083 B5R0.3 CNC(C)CO MCULE-6474892275 [1,1,0,0,0,0|1,0,1]=4 3084 B5R0.3 CN[C@@H](C)CO MCULE-1633741835 [1,1,0,0,0,0|1,0,1]=4 3085 B5R0.3 CN[C@@H](C)CO MCULE-6736108875 [1,1,0,0,0,0|1,0,1]=4 3086 B5R0.3 CN[C@@H](C)CO MCULE-7554801630 [1,1,0,0,0,0|1,0,1]=4 3087 B5R0.3 CN[C@@H](C)CO MCULE-9312521497 [1,1,0,0,0,0|1,0,1]=4 3088 B5R0.3 CN[C@H](C)CO MCULE-2402322400 [1,1,0,0,0,0|1,0,1]=4 3089 B5R0.3 CN[C@H](C)CO MCULE-4362091386 [1,1,0,0,0,0|1,0,1]=4 3090 B5R0.3 CN[C@H](C)CO MCULE-5426855707 [1,1,0,0,0,0|1,0,1]=4 3091 B5R0.3 CN[C@H](C)CO MCULE-9777995604 [1,1,0,0,0,0|1,0,1]=4 3092 B5R0.3 COC(=N)CCl MCULE-2713131753 [1,1,0,0,0,0|2,0,0]=4 3093 B5R0.3 COC(=N)CCl MCULE-6471252676 [1,1,0,0,0,0|2,0,0]=4 3094 B5R0.3 COC(=O)C#N MCULE-8762838190 [1,1,0,0,0,0|1,0,1]=4 3095 B5R0.3 COC(=O)C=O MCULE-2685327079 [1,1,0,0,0,0|0,0,2]=4 3096 B5R0.3 COC(=O)CBr MCULE-2684954408 [1,1,0,0,0,0|1,0,0]=3 3097 B5R0.3 COC(=O)CCl MCULE-5886832940 [1,1,0,0,0,0|1,0,0]=3 3098 B5R0.3 COC(=O)CF MCULE-4367430175 [1,1,0,0,0,0|1,0,0]=3 3099 B5R0.3 COC(=O)CI MCULE-9545584156 [1,1,0,0,0,0|1,0,0]=3 3100 B5R0.3 COC(=O)CN MCULE-7462799100 [1,1,0,0,0,0|1,0,0]=3 3101 B5R0.3 COC(=O)CN MCULE-8887061469 [1,1,0,0,0,0|1,0,0]=3 3102 B5R0.3 COC(=O)CO MCULE-8734582763 [1,1,0,0,0,0|0,0,0]=2 3103 B5R0.3 COC(=O)CS MCULE-3020830180 [1,1,0,0,0,0|0,1,0]=3 3104 B5R0.3 COC(=O)NN MCULE-2637794839 [1,1,0,0,0,0|2,0,0]=4 3105 B5R0.3 COC(=O)OC MCULE-7488725621 [1,1,0,0,0,0|1,0,0]=3 3106 B5R0.3 COC(=O)SCl MCULE-1018411491 [1,1,0,0,0,0|2,0,0]=4 3107 B5R0.3 COC(=S)SC MCULE-7665194168 [1,1,0,0,0,0|1,1,0]=4 3108 B5R0.3 COC(C)CO MCULE-5269990702 [1,1,0,0,0,0|0,0,2]=4 3109 B5R0.3 COC(C)CO MCULE-7173093332 [1,1,0,0,0,0|0,0,2]=4 3110 B5R0.3 CON(C)C=O MCULE-6743121315 [1,1,0,0,0,0|2,0,0]=4 3111 B5R0.3 COS(=O)OC MCULE-9352053920 [1,1,0,0,0,0|2,0,0]=4 3112 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [1,1,0,0,0,0|0,0,2]=4 3113 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [1,1,0,0,0,0|0,0,2]=4 3114 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [1,1,0,0,0,0|0,0,2]=4 3115 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [1,1,0,0,0,0|0,0,2]=4 3116 B5R0.3 CS/C(=N/O)/C MCULE-8496912522 [1,1,0,0,0,0|1,0,1]=4 3117 B5R0.3 CSC(=NO)C MCULE-1500524467 [1,1,0,0,0,0|1,0,1]=4 3118 B5R0.3 CSC(=O)SC MCULE-7167992573 [1,1,0,0,0,0|1,0,0]=3 3119 B5R0.3 CSC(=S)SC MCULE-5023087703 [1,1,0,0,0,0|1,1,0]=4 3120 B5R0.3 CSC(C)CO MCULE-4646435737 [1,1,0,0,0,0|0,1,1]=4 3121 B5R0.3 C[C@@H](CN)CO MCULE-4662215148 [1,1,0,0,0,0|1,0,1]=4 3122 B5R0.3 C[C@@H](CN)CO MCULE-7870198689 [1,1,0,0,0,0|1,0,1]=4 3123 B5R0.3 C[C@@H](CO)CBr MCULE-3691541800 [1,1,0,0,0,0|1,0,1]=4 3124 B5R0.3 C[C@@H](CO)CBr MCULE-4447849056 [1,1,0,0,0,0|1,0,1]=4 3125 B5R0.3 C[C@H](CO)CBr MCULE-4031825779 [1,1,0,0,0,0|1,0,1]=4 3126 B5R0.3 C[C@H](CO)CBr MCULE-6846167456 [1,1,0,0,0,0|1,0,1]=4 3127 B5R0.3 N/C(=N/O)/CF MCULE-8149459701 [1,1,0,0,0,0|2,0,0]=4 3128 B5R0.3 N/C(=N/O)/CO MCULE-1684161600 [1,1,0,0,0,0|1,0,1]=4 3129 B5R0.3 N/C(=N\O)/CCl MCULE-4486676288 [1,1,0,0,0,0|2,0,0]=4 3130 B5R0.3 NC(CO)CF MCULE-3756808200 [1,1,0,0,0,0|1,0,1]=4 3131 B5R0.3 NC(CO)CF MCULE-9468719402 [1,1,0,0,0,0|1,0,1]=4 3132 B5R0.3 NC(CO)CO MCULE-1559988016 [1,1,0,0,0,0|1,0,1]=4 3133 B5R0.3 NC(CO)CO MCULE-4954119952 [1,1,0,0,0,0|1,0,1]=4 3134 B5R0.3 NCC(=O)CN MCULE-2420991481 [1,1,0,0,0,0|1,0,0]=3 3135 B5R0.3 NCC(=O)CN MCULE-8626789745 [1,1,0,0,0,0|1,0,0]=3 3136 B5R0.3 NCC(=O)NN MCULE-2318099199 [1,1,0,0,0,0|2,0,0]=4 3137 B5R0.3 NCC(=O)NN MCULE-3392354502 [1,1,0,0,0,0|2,0,0]=4 3138 B5R0.3 NCC(=O)NO MCULE-5417617455 [1,1,0,0,0,0|1,0,0]=3 3139 B5R0.3 NCC(F)CO MCULE-6156319956 [1,1,0,0,0,0|1,0,1]=4 3140 B5R0.3 NCC(F)CO MCULE-7472307328 [1,1,0,0,0,0|1,0,1]=4 3141 B5R0.3 NCC(O)CO MCULE-2689763818 [1,1,0,0,0,0|0,0,2]=4 3142 B5R0.3 NCC(O)CO MCULE-6096620010 [1,1,0,0,0,0|0,0,2]=4 3143 B5R0.3 NCC(O)CO MCULE-7307777212 [1,1,0,0,0,0|0,0,2]=4 3144 B5R0.3 NC[C@@H](F)CO MCULE-3273711180 [1,1,0,0,0,0|1,0,1]=4 3145 B5R0.3 NC[C@@H](F)CO MCULE-6673969522 [1,1,0,0,0,0|1,0,1]=4 3146 B5R0.3 NC[C@@H](N)CO MCULE-7333007012 [1,1,0,0,0,0|1,0,1]=4 3147 B5R0.3 NC[C@@H](N)CO MCULE-9200386635 [1,1,0,0,0,0|1,0,1]=4 3148 B5R0.3 NC[C@@H](O)CO MCULE-7897503444 [1,1,0,0,0,0|0,0,2]=4 3149 B5R0.3 NC[C@@H](O)CO MCULE-8044821624 [1,1,0,0,0,0|0,0,2]=4 3150 B5R0.3 NC[C@@H](O)CO MCULE-9443333756 [1,1,0,0,0,0|0,0,2]=4 3151 B5R0.3 NC[C@H](F)CO MCULE-2595736378 [1,1,0,0,0,0|1,0,1]=4 3152 B5R0.3 NC[C@H](F)CO MCULE-7417074078 [1,1,0,0,0,0|1,0,1]=4 3153 B5R0.3 NC[C@H](F)CO MCULE-7938231499 [1,1,0,0,0,0|1,0,1]=4 3154 B5R0.3 NC[C@H](N)CO MCULE-1060049548 [1,1,0,0,0,0|1,0,1]=4 3155 B5R0.3 NC[C@H](N)CO MCULE-9942356112 [1,1,0,0,0,0|1,0,1]=4 3156 B5R0.3 NC[C@H](O)CO MCULE-5835551322 [1,1,0,0,0,0|0,0,2]=4 3157 B5R0.3 NC[C@H](O)CO MCULE-6021133883 [1,1,0,0,0,0|0,0,2]=4 3158 B5R0.3 NC[C@H](O)CO MCULE-7461568841 [1,1,0,0,0,0|0,0,2]=4 3159 B5R0.3 NC[C@H](O)CO MCULE-8112454132 [1,1,0,0,0,0|0,0,2]=4 3160 B5R0.3 NNC(=O)CCl MCULE-2158347473 [1,1,0,0,0,0|2,0,0]=4 3161 B5R0.3 NNC(=O)CCl MCULE-9762553206 [1,1,0,0,0,0|2,0,0]=4 3162 B5R0.3 NNC(=O)CO MCULE-8443636349 [1,1,0,0,0,0|1,0,0]=3 3163 B5R0.3 NNC(=O)CS MCULE-4913925166 [1,1,0,0,0,0|1,1,0]=4 3164 B5R0.3 NNC(=O)NO MCULE-7106168898 [1,1,0,0,0,0|2,0,0]=4 3165 B5R0.3 N[C@@H](CO)CF MCULE-1103631898 [1,1,0,0,0,0|1,0,1]=4 3166 B5R0.3 N[C@@H](CO)CF MCULE-1137418239 [1,1,0,0,0,0|1,0,1]=4 3167 B5R0.3 N[C@@H](CO)CF MCULE-7452275160 [1,1,0,0,0,0|1,0,1]=4 3168 B5R0.3 N[C@@H](CO)CF MCULE-9154795583 [1,1,0,0,0,0|1,0,1]=4 3169 B5R0.3 N[C@H](CO)CF MCULE-1070351343 [1,1,0,0,0,0|1,0,1]=4 3170 B5R0.3 N[C@H](CO)CF MCULE-4715788718 [1,1,0,0,0,0|1,0,1]=4 3171 B5R0.3 N[C@H](CO)CF MCULE-8220585202 [1,1,0,0,0,0|1,0,1]=4 3172 B5R0.3 N[C@H](CO)CF MCULE-8991857376 [1,1,0,0,0,0|1,0,1]=4 3173 B5R0.3 O=C(CBr)CBr MCULE-5262523719 [1,1,0,0,0,0|1,0,0]=3 3174 B5R0.3 O=C(CCl)CCl MCULE-2048636813 [1,1,0,0,0,0|1,0,0]=3 3175 B5R0.3 O=C(CF)CF MCULE-8790300272 [1,1,0,0,0,0|1,0,0]=3 3176 B5R0.3 O=C(CO)CO MCULE-7188810449 [1,1,0,0,0,0|0,0,0]=2 3177 B5R0.3 O=CC(=CO)Br MCULE-8777401868 [1,1,0,0,0,0|1,0,1]=4 3178 B5R0.3 O=CC(=O)CO MCULE-7273475675 [1,1,0,0,0,0|0,0,1]=3 3179 B5R0.3 O=CC(O)CO MCULE-9581740191 [1,1,0,0,0,0|1,0,1]=4 3180 B5R0.3 O=C[C@@H](O)CO MCULE-3883857491 [1,1,0,0,0,0|1,0,1]=4 3181 B5R0.3 O=C[C@@H](O)CO MCULE-7852783182 [1,1,0,0,0,0|1,0,1]=4 3182 B5R0.3 O=C[C@H](O)CO MCULE-4574984840 [1,1,0,0,0,0|1,0,1]=4 3183 B5R0.3 OCC(Br)CBr MCULE-9616107956 [1,1,0,0,0,0|1,0,1]=4 3184 B5R0.3 OCC(Br)CO MCULE-9272628834 [1,1,0,0,0,0|1,0,1]=4 3185 B5R0.3 OCC(Cl)CCl MCULE-2120585852 [1,1,0,0,0,0|1,0,1]=4 3186 B5R0.3 OCC(Cl)CO MCULE-7487945326 [1,1,0,0,0,0|1,0,1]=4 3187 B5R0.3 OCC(F)CBr MCULE-2889937576 [1,1,0,0,0,0|1,0,1]=4 3188 B5R0.3 OCC(F)CO MCULE-2970537690 [1,1,0,0,0,0|1,0,1]=4 3189 B5R0.3 OCC(O)CBr MCULE-9116190245 [1,1,0,0,0,0|0,0,2]=4 3190 B5R0.3 OCC(O)CCl MCULE-7895191088 [1,1,0,0,0,0|0,0,2]=4 3191 B5R0.3 OCC(O)CCl MCULE-8992242488 [1,1,0,0,0,0|0,0,2]=4 3192 B5R0.3 OCC(O)CF MCULE-3575952891 [1,1,0,0,0,0|0,0,2]=4 3193 B5R0.3 OCC(O)CF MCULE-8981430411 [1,1,0,0,0,0|0,0,2]=4 3194 B5R0.3 OCC(O)CI MCULE-6705992930 [1,1,0,0,0,0|0,0,2]=4 3195 B5R0.3 OCC(O)CO MCULE-6349111826 [1,1,0,0,0,0|0,0,2]=4 3196 B5R0.3 OCC(O)CS MCULE-6300188207 [1,1,0,0,0,0|0,0,2]=4 3197 B5R0.3 OCC(S)CS MCULE-9735516119 [1,1,0,0,0,0|0,1,1]=4 3198 B5R0.3 OC[C@@H](O)CCl MCULE-1311776512 [1,1,0,0,0,0|0,0,2]=4 3199 B5R0.3 OC[C@@H](O)CCl MCULE-2685107404 [1,1,0,0,0,0|0,0,2]=4 3200 B5R0.3 OC[C@@H](O)CF MCULE-3274443966 [1,1,0,0,0,0|0,0,2]=4 3201 B5R0.3 OC[C@@H](O)CF MCULE-5908395855 [1,1,0,0,0,0|0,0,2]=4 3202 B5R0.3 OC[C@H](O)CBr MCULE-5035020863 [1,1,0,0,0,0|0,0,2]=4 3203 B5R0.3 OC[C@H](O)CCl MCULE-2098232262 [1,1,0,0,0,0|0,0,2]=4 3204 B5R0.3 OC[C@H](O)CCl MCULE-5801605349 [1,1,0,0,0,0|0,0,2]=4 3205 B5R0.3 OC[C@H](O)CF MCULE-3309672397 [1,1,0,0,0,0|0,0,2]=4 3206 B5R0.3 OC[C@H](O)CF MCULE-7695783253 [1,1,0,0,0,0|0,0,2]=4 3207 B5R0.3 P(=O)(OC)OC MCULE-7918891029 [1,1,0,0,0,0|2,0,0]=4 3208 B5R0.4 CC(C)(Br)CO MCULE-5949221311 [1,1,0,0,0,0|1,0,1]=4 3209 B5R0.4 CC(C)(C)CO MCULE-4399535684 [1,1,0,0,0,0|1,0,1]=4 3210 B5R0.4 CC(C)(F)CO MCULE-1700621997 [1,1,0,0,0,0|1,0,1]=4 3211 B5R0.4 CC(C)(N)CO MCULE-4072416202 [1,1,0,0,0,0|1,0,1]=4 3212 B5R0.4 CC(C)(N)CO MCULE-4209651459 [1,1,0,0,0,0|1,0,1]=4 3213 B5R0.4 CC(C)(N)CO MCULE-6047079177 [1,1,0,0,0,0|1,0,1]=4 3214 B5R0.4 CC(C)(O)CO MCULE-6797456030 [1,1,0,0,0,0|0,0,2]=4 3215 B5R0.4 CC(C)(S)CO MCULE-6119329508 [1,1,0,0,0,0|0,1,1]=4 3216 B5R0.4 CC(F)(F)CO MCULE-1049181656 [1,1,0,0,0,0|1,0,1]=4 3217 B5R0.4 CCC(C)(C)Br MCULE-8895489875 [1,1,0,0,0,0|1,0,1]=4 3218 B5R0.4 CCC(C)(C)C MCULE-3388707671 [1,1,0,0,0,0|1,0,1]=4 3219 B5R0.4 CCC(C)(C)Cl MCULE-9597829372 [1,1,0,0,0,0|1,0,1]=4 3220 B5R0.4 CCC(C)(C)I MCULE-3678105747 [1,1,0,0,0,0|1,0,1]=4 3221 B5R0.4 CCC(C)(C)N MCULE-5538333672 [1,1,0,0,0,0|1,0,1]=4 3222 B5R0.4 CCC(C)(C)O MCULE-7894262803 [1,1,0,0,0,0|0,0,2]=4 3223 B5R0.4 CCC(C)(Cl)Cl MCULE-7771494508 [1,1,0,0,0,0|1,0,1]=4 3224 B5R0.4 CCC(C)(F)F MCULE-9944788511 [1,1,0,0,0,0|1,0,1]=4 3225 B5R0.4 CCP(=O)(Cl)Cl MCULE-3811520604 [1,1,0,0,0,0|2,0,0]=4 3226 B5R0.4 CCP(=O)(O)O MCULE-5185791919 [1,1,0,0,0,0|2,0,0]=4 3227 B5R0.4 CCS(=N)(=O)C MCULE-6682726319 [1,1,0,0,0,0|1,0,0]=3 3228 B5R0.4 CCS(=O)(=O)C MCULE-8932195925 [1,1,0,0,0,0|1,0,0]=3 3229 B5R0.4 CCS(=O)(=O)Cl MCULE-4280260185 [1,1,0,0,0,0|2,0,0]=4 3230 B5R0.4 CCS(=O)(=O)F MCULE-9460711277 [1,1,0,0,0,0|2,0,0]=4 3231 B5R0.4 CCS(=O)(=O)N MCULE-4542844597 [1,1,0,0,0,0|2,0,0]=4 3232 B5R0.4 CCS(=O)(=O)O MCULE-4408374633 [1,1,0,0,0,0|2,0,0]=4 3233 B5R0.4 CCS(=O)(=S)O MCULE-3229359913 [1,1,0,0,0,0|2,0,0]=4 3234 B5R0.4 CCS(=O)(=S)[O-] MCULE-8602343929 [1,1,0,0,0,0|2,0,0]=4 3235 B5R0.4 CC[N+](C)(C)C MCULE-6470651588 [1,1,0,0,0,0|2,0,0]=4 3236 B5R0.4 CC[N+](C)(C)C MCULE-9796203912 [1,1,0,0,0,0|2,0,0]=4 3237 B5R0.4 CC[Si](C)(C)C MCULE-3153744967 [1,1,0,0,0,0|1,1,0]=4 3238 B5R0.4 CC[Si](C)(C)Cl MCULE-8119153773 [1,1,0,0,0,0|1,1,0]=4 3239 B5R0.4 CC[Si](C)(Cl)Cl MCULE-6915255927 [1,1,0,0,0,0|1,1,0]=4 3240 B5R0.4 CNS(=O)(=O)C MCULE-1909911079 [1,1,0,0,0,0|2,0,0]=4 3241 B5R0.4 COS(=O)(=O)C MCULE-4411511042 [1,1,0,0,0,0|2,0,0]=4 3242 B5R0.4 CP(=O)(C)CCl MCULE-8860798375 [1,1,0,0,0,0|2,0,0]=4 3243 B5R0.4 CS(=O)(=O)CBr MCULE-2231437619 [1,1,0,0,0,0|2,0,0]=4 3244 B5R0.4 CS(=O)(=O)CCl MCULE-3138137071 [1,1,0,0,0,0|2,0,0]=4 3245 B5R0.4 CS(=O)(=O)NO MCULE-6576734604 [1,1,0,0,0,0|2,0,0]=4 3246 B5R0.4 CSS(=O)(=O)C MCULE-2094653694 [1,1,0,0,0,0|2,0,0]=4 3247 B5R0.4 C[Si](C)(C)CO MCULE-7434746060 [1,1,0,0,0,0|1,1,0]=4 3248 B5R0.4 O=P(O)(O)CO MCULE-9997097349 [1,1,0,0,0,0|2,0,0]=4 3249 B5R0.4 O=S(=O)(O)CO MCULE-9647441782 [1,1,0,0,0,0|2,0,0]=4 3250 B5R0.4 O=S(=O)([O-])CO MCULE-5488503909 [1,1,0,0,0,0|2,0,0]=4 3251 B5R0.5 C=C(C)B(O)O MCULE-1381151629 [1,1,0,0,0,0|2,0,0]=4 3252 B5R0.5 C=C(C)C(=C)C MCULE-6799765242 [1,1,0,0,0,0|1,0,1]=4 3253 B5R0.5 C=C(C)C(=O)C MCULE-5872425076 [1,1,0,0,0,0|0,0,1]=3 3254 B5R0.5 C=C(C)C(=O)Cl MCULE-9163474336 [1,1,0,0,0,0|1,0,1]=4 3255 B5R0.5 C=C(C)C(=O)N MCULE-3416322097 [1,1,0,0,0,0|1,0,1]=4 3256 B5R0.5 C=C(C)C(=O)O MCULE-9899621926 [1,1,0,0,0,0|1,0,1]=4 3257 B5R0.5 C=C(C)C(=O)[O-] MCULE-5299174444 [1,1,0,0,0,0|1,0,1]=4 3258 B5R0.5 C=C(C)C(=O)[O-] MCULE-7320418926 [1,1,0,0,0,0|1,0,1]=4 3259 B5R0.5 C=C(C)C(=O)[O-] MCULE-7347881815 [1,1,0,0,0,0|1,0,1]=4 3260 B5R0.5 C=C(C)C(C)C MCULE-2535284443 [1,1,0,0,0,0|1,0,0]=3 3261 B5R0.5 C=C(C)C(C)Cl MCULE-5294924458 [1,1,0,0,0,0|1,0,0]=3 3262 B5R0.5 C=C(C)C(C)O MCULE-3768810742 [1,1,0,0,0,0|1,0,0]=3 3263 B5R0.5 C=C(C)C(Cl)Cl MCULE-4460311331 [1,1,0,0,0,0|2,0,0]=4 3264 B5R0.5 C=C(C)C(Cl)Cl MCULE-5923487420 [1,1,0,0,0,0|2,0,0]=4 3265 B5R0.5 CC(=C(C)Br)C MCULE-2244219065 [1,1,0,0,0,0|1,0,1]=4 3266 B5R0.5 CC(=C(C)C)C MCULE-2888318026 [1,1,0,0,0,0|1,0,1]=4 3267 B5R0.5 CC(=O)C(=O)C MCULE-5742661187 [1,1,0,0,0,0|0,0,1]=3 3268 B5R0.5 CC(=O)C(=O)Cl MCULE-3413498860 [1,1,0,0,0,0|0,0,2]=4 3269 B5R0.5 CC(=O)C(=O)N MCULE-6804734996 [1,1,0,0,0,0|0,0,2]=4 3270 B5R0.5 CC(=O)C(=O)O MCULE-8587144313 [1,1,0,0,0,0|0,0,1]=3 3271 B5R0.5 CC(=O)C(=O)[O-] MCULE-2773521709 [1,1,0,0,0,0|0,0,2]=4 3272 B5R0.5 CC(=O)C(=O)[O-] MCULE-7007482346 [1,1,0,0,0,0|0,0,2]=4 3273 B5R0.5 CC(=O)C(=O)[O-] MCULE-8344520452 [1,1,0,0,0,0|0,0,2]=4 3274 B5R0.5 CC(=O)C(=S)N MCULE-3142518834 [1,1,0,0,0,0|0,1,1]=4 3275 B5R0.5 CC(=O)C(C)Br MCULE-3764525199 [1,1,0,0,0,0|0,0,0]=2 3276 B5R0.5 CC(=O)C(C)C MCULE-5982732938 [1,1,0,0,0,0|0,0,0]=2 3277 B5R0.5 CC(=O)C(C)Cl MCULE-5065840606 [1,1,0,0,0,0|0,0,0]=2 3278 B5R0.5 CC(=O)C(C)F MCULE-2129925918 [1,1,0,0,0,0|0,0,0]=2 3279 B5R0.5 CC(=O)C(C)N MCULE-5716124999 [1,1,0,0,0,0|0,0,0]=2 3280 B5R0.5 CC(=O)C(C)N MCULE-9248002534 [1,1,0,0,0,0|0,0,0]=2 3281 B5R0.5 CC(=O)C(C)O MCULE-5374414264 [1,1,0,0,0,0|0,0,0]=2 3282 B5R0.5 CC(=O)C(C)S MCULE-2716722148 [1,1,0,0,0,0|0,0,0]=2 3283 B5R0.5 CC(=O)C(Cl)Cl MCULE-9043899746 [1,1,0,0,0,0|1,0,0]=3 3284 B5R0.5 CC(=O)C(F)F MCULE-9206168077 [1,1,0,0,0,0|1,0,0]=3 3285 B5R0.5 CC(=O)N(C)C MCULE-4256511309 [1,1,0,0,0,0|1,0,0]=3 3286 B5R0.5 CC(=O)N(C)N MCULE-2447375293 [1,1,0,0,0,0|1,0,0]=3 3287 B5R0.5 CC(=O)[C@H](C)N MCULE-2609095078 [1,1,0,0,0,0|0,0,0]=2 3288 B5R0.5 CC(=O)[C@H](C)N MCULE-6039921944 [1,1,0,0,0,0|0,0,0]=2 3289 B5R0.5 CC(=O)[C@H](C)N MCULE-6387613992 [1,1,0,0,0,0|0,0,0]=2 3290 B5R0.5 CC(=O)[C@H](C)N MCULE-7052375323 [1,1,0,0,0,0|0,0,0]=2 3291 B5R0.5 CC(=S)N(C)C MCULE-6797990305 [1,1,0,0,0,0|1,1,0]=4 3292 B5R0.5 CC(Br)C(=O)Br MCULE-2400047844 [1,1,0,0,0,0|1,0,0]=3 3293 B5R0.5 CC(Br)C(=O)Cl MCULE-7431871683 [1,1,0,0,0,0|1,0,0]=3 3294 B5R0.5 CC(Br)C(=O)N MCULE-9226586148 [1,1,0,0,0,0|1,0,0]=3 3295 B5R0.5 CC(Br)C(=O)O MCULE-3935837943 [1,1,0,0,0,0|1,0,0]=3 3296 B5R0.5 CC(Br)C(=O)O MCULE-6068441065 [1,1,0,0,0,0|1,0,0]=3 3297 B5R0.5 CC(Br)C(C)Br MCULE-8272754345 [1,1,0,0,0,0|1,0,1]=4 3298 B5R0.5 CC(C)C(=N)N MCULE-2464075086 [1,1,0,0,0,0|2,0,0]=4 3299 B5R0.5 CC(C)C(=N)N MCULE-6743996580 [1,1,0,0,0,0|2,0,0]=4 3300 B5R0.5 CC(C)C(=O)Br MCULE-3679003896 [1,1,0,0,0,0|1,0,0]=3 3301 B5R0.5 CC(C)C(=O)Cl MCULE-6582236331 [1,1,0,0,0,0|1,0,0]=3 3302 B5R0.5 CC(C)C(=O)N MCULE-9773835068 [1,1,0,0,0,0|1,0,0]=3 3303 B5R0.5 CC(C)C(=O)O MCULE-7783770647 [1,1,0,0,0,0|1,0,0]=3 3304 B5R0.5 CC(C)C(=O)S MCULE-9552406593 [1,1,0,0,0,0|1,0,0]=3 3305 B5R0.5 CC(C)C(=S)N MCULE-3546856315 [1,1,0,0,0,0|1,1,0]=4 3306 B5R0.5 CC(C)C(C)Br MCULE-8934980523 [1,1,0,0,0,0|1,0,1]=4 3307 B5R0.5 CC(C)C(C)C MCULE-7887644548 [1,1,0,0,0,0|1,0,1]=4 3308 B5R0.5 CC(C)C(C)I MCULE-7528764320 [1,1,0,0,0,0|1,0,1]=4 3309 B5R0.5 CC(C)C(C)N MCULE-1630754475 [1,1,0,0,0,0|1,0,1]=4 3310 B5R0.5 CC(C)C(C)N MCULE-1801901816 [1,1,0,0,0,0|1,0,1]=4 3311 B5R0.5 CC(C)C(C)N MCULE-3544463874 [1,1,0,0,0,0|1,0,1]=4 3312 B5R0.5 CC(C)C(C)N MCULE-4774844065 [1,1,0,0,0,0|1,0,1]=4 3313 B5R0.5 CC(C)C(C)O MCULE-4829392845 [1,1,0,0,0,0|0,0,2]=4 3314 B5R0.5 CC(C)C(C)S MCULE-7489203323 [1,1,0,0,0,0|0,1,1]=4 3315 B5R0.5 CC(C)N(=O)=O MCULE-8418443353 [1,1,0,0,0,0|2,0,0]=4 3316 B5R0.5 CC(C)N(C)C MCULE-1993251030 [1,1,0,0,0,0|2,0,0]=4 3317 B5R0.5 CC(C)S(=O)N MCULE-8425110407 [1,1,0,0,0,0|2,0,0]=4 3318 B5R0.5 CC(C)S(=O)O MCULE-5200056082 [1,1,0,0,0,0|2,0,0]=4 3319 B5R0.5 CC(C)S(=O)[O-] MCULE-2354817364 [1,1,0,0,0,0|2,0,0]=4 3320 B5R0.5 CC(C)[C@@H](C)N MCULE-1953734886 [1,1,0,0,0,0|1,0,1]=4 3321 B5R0.5 CC(C)[C@@H](C)N MCULE-3105334197 [1,1,0,0,0,0|1,0,1]=4 3322 B5R0.5 CC(C)[C@@H](C)N MCULE-9470429569 [1,1,0,0,0,0|1,0,1]=4 3323 B5R0.5 CC(C)[C@@H](C)O MCULE-3565458505 [1,1,0,0,0,0|0,0,2]=4 3324 B5R0.5 CC(C)[C@H](C)N MCULE-2859174363 [1,1,0,0,0,0|1,0,1]=4 3325 B5R0.5 CC(C)[C@H](C)N MCULE-3034457659 [1,1,0,0,0,0|1,0,1]=4 3326 B5R0.5 CC(C)[C@H](C)N MCULE-5904658917 [1,1,0,0,0,0|1,0,1]=4 3327 B5R0.5 CC(C)[C@H](C)O MCULE-1553214756 [1,1,0,0,0,0|0,0,2]=4 3328 B5R0.5 CC(C)[C@H](C)O MCULE-8141633445 [1,1,0,0,0,0|0,0,2]=4 3329 B5R0.5 CC(Cl)C(=N)N MCULE-2357555185 [1,1,0,0,0,0|2,0,0]=4 3330 B5R0.5 CC(Cl)C(=N)N MCULE-5302250002 [1,1,0,0,0,0|2,0,0]=4 3331 B5R0.5 CC(Cl)C(=O)Cl MCULE-6547241717 [1,1,0,0,0,0|1,0,0]=3 3332 B5R0.5 CC(Cl)C(=O)N MCULE-5322078211 [1,1,0,0,0,0|1,0,0]=3 3333 B5R0.5 CC(Cl)C(=O)O MCULE-3597230803 [1,1,0,0,0,0|1,0,0]=3 3334 B5R0.5 CC(Cl)C(=O)O MCULE-5449120618 [1,1,0,0,0,0|1,0,0]=3 3335 B5R0.5 CC(Cl)C(C)Cl MCULE-6954506926 [1,1,0,0,0,0|1,0,1]=4 3336 B5R0.5 CC(F)C(=O)O MCULE-7334922730 [1,1,0,0,0,0|1,0,0]=3 3337 B5R0.5 CC(I)C(=O)N MCULE-8608495554 [1,1,0,0,0,0|1,0,0]=3 3338 B5R0.5 CC(N)C(=O)N MCULE-1264398810 [1,1,0,0,0,0|1,0,0]=3 3339 B5R0.5 CC(N)C(=O)N MCULE-2251123672 [1,1,0,0,0,0|1,0,0]=3 3340 B5R0.5 CC(N)C(=O)N MCULE-2273926073 [1,1,0,0,0,0|1,0,0]=3 3341 B5R0.5 CC(N)C(=O)N MCULE-5340923071 [1,1,0,0,0,0|1,0,0]=3 3342 B5R0.5 CC(N)C(=O)N MCULE-6061233032 [1,1,0,0,0,0|1,0,0]=3 3343 B5R0.5 CC(N)C(=O)N MCULE-9273221837 [1,1,0,0,0,0|1,0,0]=3 3344 B5R0.5 CC(N)C(=O)O MCULE-3498369789 [1,1,0,0,0,0|1,0,0]=3 3345 B5R0.5 CC(N)C(=O)O MCULE-3809839392 [1,1,0,0,0,0|1,0,0]=3 3346 B5R0.5 CC(N)C(=O)O MCULE-4751903561 [1,1,0,0,0,0|1,0,0]=3 3347 B5R0.5 CC(N)C(=O)O MCULE-6963397848 [1,1,0,0,0,0|1,0,0]=3 3348 B5R0.5 CC(N)C(C)N MCULE-6724099648 [1,1,0,0,0,0|1,0,1]=4 3349 B5R0.5 CC(N)C(C)O MCULE-3512899672 [1,1,0,0,0,0|0,0,2]=4 3350 B5R0.5 CC(N)C(C)O MCULE-6286987696 [1,1,0,0,0,0|0,0,2]=4 3351 B5R0.5 CC(O)C(=N)N MCULE-4358846536 [1,1,0,0,0,0|2,0,0]=4 3352 B5R0.5 CC(O)C(=N)N MCULE-5644516205 [1,1,0,0,0,0|2,0,0]=4 3353 B5R0.5 CC(O)C(=O)N MCULE-6247123668 [1,1,0,0,0,0|1,0,0]=3 3354 B5R0.5 CC(O)C(=O)N MCULE-7823792358 [1,1,0,0,0,0|1,0,0]=3 3355 B5R0.5 CC(O)C(=O)O MCULE-3922256529 [1,1,0,0,0,0|1,0,0]=3 3356 B5R0.5 CC(O)C(=O)O MCULE-5387110670 [1,1,0,0,0,0|1,0,0]=3 3357 B5R0.5 CC(O)C(=O)[O-] MCULE-1056716990 [1,1,0,0,0,0|1,0,0]=3 3358 B5R0.5 CC(O)C(=O)[O-] MCULE-8184872865 [1,1,0,0,0,0|1,0,0]=3 3359 B5R0.5 CC(O)C(=O)[O-] MCULE-8730993694 [1,1,0,0,0,0|1,0,0]=3 3360 B5R0.5 CC(O)C(C)Br MCULE-1140424623 [1,1,0,0,0,0|0,0,2]=4 3361 B5R0.5 CC(O)C(C)Cl MCULE-3352632568 [1,1,0,0,0,0|0,0,2]=4 3362 B5R0.5 CC(O)C(C)O MCULE-2858785316 [1,1,0,0,0,0|0,0,2]=4 3363 B5R0.5 CC(O)C(C)S MCULE-3741743569 [1,1,0,0,0,0|0,0,2]=4 3364 B5R0.5 CC(S)C(=O)N MCULE-1465182001 [1,1,0,0,0,0|1,0,0]=3 3365 B5R0.5 CC(S)C(=O)O MCULE-6944738352 [1,1,0,0,0,0|1,0,0]=3 3366 B5R0.5 CC(S)C(C)S MCULE-3508721208 [1,1,0,0,0,0|0,1,1]=4 3367 B5R0.5 CN(C)C(=O)Cl MCULE-1738506605 [1,1,0,0,0,0|2,0,0]=4 3368 B5R0.5 CN(C)C(=O)N MCULE-3142720631 [1,1,0,0,0,0|2,0,0]=4 3369 B5R0.5 CN(C)C(=O)O MCULE-1039144559 [1,1,0,0,0,0|2,0,0]=4 3370 B5R0.5 CN(C)C(=O)[O-] MCULE-5405204721 [1,1,0,0,0,0|2,0,0]=4 3371 B5R0.5 CN(N)C(=O)N MCULE-9114734246 [1,1,0,0,0,0|2,0,0]=4 3372 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8303539222 [1,1,0,0,0,0|1,0,0]=3 3373 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8530283309 [1,1,0,0,0,0|1,0,0]=3 3374 B5R0.5 C[C@@H](Cl)C(=O)Cl MCULE-3579498695 [1,1,0,0,0,0|1,0,0]=3 3375 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-6578788045 [1,1,0,0,0,0|1,0,0]=3 3376 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-8314108697 [1,1,0,0,0,0|1,0,0]=3 3377 B5R0.5 C[C@@H](F)C(=O)N MCULE-1505685009 [1,1,0,0,0,0|1,0,0]=3 3378 B5R0.5 C[C@@H](N)C(=O)N MCULE-4677983549 [1,1,0,0,0,0|1,0,0]=3 3379 B5R0.5 C[C@@H](N)C(=O)N MCULE-6112443507 [1,1,0,0,0,0|1,0,0]=3 3380 B5R0.5 C[C@@H](N)C(=O)N MCULE-7940270709 [1,1,0,0,0,0|1,0,0]=3 3381 B5R0.5 C[C@@H](N)C(=O)N MCULE-8482332558 [1,1,0,0,0,0|1,0,0]=3 3382 B5R0.5 C[C@@H](N)C(=O)O MCULE-3571488623 [1,1,0,0,0,0|1,0,0]=3 3383 B5R0.5 C[C@@H](N)C(=O)O MCULE-9756365751 [1,1,0,0,0,0|1,0,0]=3 3384 B5R0.5 C[C@@H](N)[C@@H](C)N MCULE-5194916344 [1,1,0,0,0,0|1,0,1]=4 3385 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-4537991630 [1,1,0,0,0,0|0,0,2]=4 3386 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5710552020 [1,1,0,0,0,0|0,0,2]=4 3387 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5951487868 [1,1,0,0,0,0|0,0,2]=4 3388 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8093543292 [1,1,0,0,0,0|0,0,2]=4 3389 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8196664475 [1,1,0,0,0,0|0,0,2]=4 3390 B5R0.5 C[C@@H](O)C(=N)N MCULE-1498978023 [1,1,0,0,0,0|2,0,0]=4 3391 B5R0.5 C[C@@H](O)C(=N)N MCULE-6124491136 [1,1,0,0,0,0|2,0,0]=4 3392 B5R0.5 C[C@@H](O)C(=N)N MCULE-7410387081 [1,1,0,0,0,0|2,0,0]=4 3393 B5R0.5 C[C@@H](O)C(=N)N MCULE-9566288141 [1,1,0,0,0,0|2,0,0]=4 3394 B5R0.5 C[C@@H](O)C(=O)N MCULE-2026557726 [1,1,0,0,0,0|1,0,0]=3 3395 B5R0.5 C[C@@H](O)C(=O)N MCULE-8056291801 [1,1,0,0,0,0|1,0,0]=3 3396 B5R0.5 C[C@@H](O)C(=O)O MCULE-4625208788 [1,1,0,0,0,0|1,0,0]=3 3397 B5R0.5 C[C@@H](O)C(=O)O MCULE-9141235095 [1,1,0,0,0,0|1,0,0]=3 3398 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-5673591667 [1,1,0,0,0,0|1,0,0]=3 3399 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-8146434340 [1,1,0,0,0,0|1,0,0]=3 3400 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-9026662277 [1,1,0,0,0,0|1,0,0]=3 3401 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-2843927827 [1,1,0,0,0,0|0,0,2]=4 3402 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-3739961672 [1,1,0,0,0,0|0,0,2]=4 3403 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-5488313047 [1,1,0,0,0,0|0,0,2]=4 3404 B5R0.5 C[C@H](Br)C(=O)Cl MCULE-2960953088 [1,1,0,0,0,0|1,0,0]=3 3405 B5R0.5 C[C@H](Br)C(=O)O MCULE-4788730445 [1,1,0,0,0,0|1,0,0]=3 3406 B5R0.5 C[C@H](Br)C(=O)O MCULE-9354978281 [1,1,0,0,0,0|1,0,0]=3 3407 B5R0.5 C[C@H](Br)[C@@H](C)Br MCULE-7263507123 [1,1,0,0,0,0|1,0,1]=4 3408 B5R0.5 C[C@H](Cl)C(=O)O MCULE-4816831649 [1,1,0,0,0,0|1,0,0]=3 3409 B5R0.5 C[C@H](Cl)C(=O)O MCULE-8389122613 [1,1,0,0,0,0|1,0,0]=3 3410 B5R0.5 C[C@H](F)C(=O)N MCULE-7457242428 [1,1,0,0,0,0|1,0,0]=3 3411 B5R0.5 C[C@H](N)C(=O)N MCULE-4716963408 [1,1,0,0,0,0|1,0,0]=3 3412 B5R0.5 C[C@H](N)C(=O)N MCULE-6879702251 [1,1,0,0,0,0|1,0,0]=3 3413 B5R0.5 C[C@H](N)C(=O)N MCULE-7090555441 [1,1,0,0,0,0|1,0,0]=3 3414 B5R0.5 C[C@H](N)C(=O)N MCULE-7293369315 [1,1,0,0,0,0|1,0,0]=3 3415 B5R0.5 C[C@H](N)C(=O)N MCULE-7341432132 [1,1,0,0,0,0|1,0,0]=3 3416 B5R0.5 C[C@H](N)C(=O)N MCULE-7556063213 [1,1,0,0,0,0|1,0,0]=3 3417 B5R0.5 C[C@H](N)C(=O)N MCULE-8320991932 [1,1,0,0,0,0|1,0,0]=3 3418 B5R0.5 C[C@H](N)C(=O)N MCULE-8491573930 [1,1,0,0,0,0|1,0,0]=3 3419 B5R0.5 C[C@H](N)C(=O)O MCULE-4916719758 [1,1,0,0,0,0|1,0,0]=3 3420 B5R0.5 C[C@H](N)C(=O)O MCULE-5261590548 [1,1,0,0,0,0|1,0,0]=3 3421 B5R0.5 C[C@H](N)C(=O)O MCULE-7791919887 [1,1,0,0,0,0|1,0,0]=3 3422 B5R0.5 C[C@H](N)C(=O)O MCULE-8724854497 [1,1,0,0,0,0|1,0,0]=3 3423 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-6389040758 [1,1,0,0,0,0|0,0,2]=4 3424 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-7956913866 [1,1,0,0,0,0|0,0,2]=4 3425 B5R0.5 C[C@H](N)[C@H](C)N MCULE-1560418234 [1,1,0,0,0,0|1,0,1]=4 3426 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1340338147 [1,1,0,0,0,0|0,0,2]=4 3427 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1738016964 [1,1,0,0,0,0|0,0,2]=4 3428 B5R0.5 C[C@H](N)[C@H](C)O MCULE-2254798251 [1,1,0,0,0,0|0,0,2]=4 3429 B5R0.5 C[C@H](N)[C@H](C)O MCULE-7688101680 [1,1,0,0,0,0|0,0,2]=4 3430 B5R0.5 C[C@H](O)C(=O)N MCULE-8400190365 [1,1,0,0,0,0|1,0,0]=3 3431 B5R0.5 C[C@H](O)C(=O)O MCULE-5695391344 [1,1,0,0,0,0|1,0,0]=3 3432 B5R0.5 C[C@H](O)C(=O)O MCULE-8864689875 [1,1,0,0,0,0|1,0,0]=3 3433 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-1034285072 [1,1,0,0,0,0|1,0,0]=3 3434 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-3598405830 [1,1,0,0,0,0|1,0,0]=3 3435 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-7525689298 [1,1,0,0,0,0|1,0,0]=3 3436 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8057429776 [1,1,0,0,0,0|1,0,0]=3 3437 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8729310894 [1,1,0,0,0,0|1,0,0]=3 3438 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-3776841970 [1,1,0,0,0,0|0,0,2]=4 3439 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-4906999918 [1,1,0,0,0,0|0,0,2]=4 3440 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5860404631 [1,1,0,0,0,0|0,0,2]=4 3441 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5888789996 [1,1,0,0,0,0|0,0,2]=4 3442 B5R0.5 C[C@H](O)[C@@H](C)O MCULE-8389904530 [1,1,0,0,0,0|0,0,2]=4 3443 B5R0.5 C[C@H](O)[C@H](C)O MCULE-8448870055 [1,1,0,0,0,0|0,0,2]=4 3444 B5R0.5 C[C@H](O)[C@H](C)O MCULE-9615630900 [1,1,0,0,0,0|0,0,2]=4 3445 B5R0.5 C[C@H](S)[C@@H](C)O MCULE-3347141817 [1,1,0,0,0,0|0,0,2]=4 3446 B5R0.5 NC(=O)C(=O)O MCULE-4442165428 [1,1,0,0,0,0|1,0,1]=4 3447 B5R0.5 NC(=O)C(Cl)Br MCULE-9082770089 [1,1,0,0,0,0|2,0,0]=4 3448 B5R0.5 NC(=O)C(Cl)Cl MCULE-3389337354 [1,1,0,0,0,0|2,0,0]=4 3449 B5R0.5 NC(=O)C(F)Br MCULE-8795303515 [1,1,0,0,0,0|2,0,0]=4 3450 B5R0.5 NC(=O)C(F)Cl MCULE-4267127037 [1,1,0,0,0,0|2,0,0]=4 3451 B5R0.5 NC(=O)C(F)F MCULE-7881392368 [1,1,0,0,0,0|2,0,0]=4 3452 B5R0.5 NC(=O)C(F)I MCULE-6067421301 [1,1,0,0,0,0|2,0,0]=4 3453 B5R0.5 NC(O)C(=O)O MCULE-6546070388 [1,1,0,0,0,0|1,0,0]=3 3454 B5R0.5 O=C(Cl)C(Cl)Cl MCULE-2883143305 [1,1,0,0,0,0|2,0,0]=4 3455 B5R0.5 O=C(Cl)C(F)Cl MCULE-1579940277 [1,1,0,0,0,0|2,0,0]=4 3456 B5R0.5 O=C(Cl)C(F)F MCULE-6700400389 [1,1,0,0,0,0|2,0,0]=4 3457 B5R0.5 O=C(F)C(F)F MCULE-6722746663 [1,1,0,0,0,0|2,0,0]=4 3458 B5R0.5 O=C(O)C(=O)O MCULE-2859436444 [1,1,0,0,0,0|1,0,1]=4 3459 B5R0.5 O=C(O)C(=O)O MCULE-3054574273 [1,1,0,0,0,0|1,0,1]=4 3460 B5R0.5 O=C(O)C(=O)O MCULE-4285591204 [1,1,0,0,0,0|1,0,1]=4 3461 B5R0.5 O=C(O)C(=O)O MCULE-4461843798 [1,1,0,0,0,0|1,0,1]=4 3462 B5R0.5 O=C(O)C(=O)O MCULE-6031758101 [1,1,0,0,0,0|1,0,1]=4 3463 B5R0.5 O=C(O)C(=O)O MCULE-6647815245 [1,1,0,0,0,0|1,0,1]=4 3464 B5R0.5 O=C(O)C(=O)O MCULE-7895971003 [1,1,0,0,0,0|1,0,1]=4 3465 B5R0.5 O=C(O)C(=O)O MCULE-8046063377 [1,1,0,0,0,0|1,0,1]=4 3466 B5R0.5 O=C(O)C(=O)O MCULE-8198551041 [1,1,0,0,0,0|1,0,1]=4 3467 B5R0.5 O=C(O)C(=O)O MCULE-8472527874 [1,1,0,0,0,0|1,0,1]=4 3468 B5R0.5 O=C(O)C(=O)O MCULE-9701145416 [1,1,0,0,0,0|1,0,1]=4 3469 B5R0.5 O=C(O)C(Br)Br MCULE-4908900588 [1,1,0,0,0,0|2,0,0]=4 3470 B5R0.5 O=C(O)C(Cl)Br MCULE-4569127340 [1,1,0,0,0,0|2,0,0]=4 3471 B5R0.5 O=C(O)C(Cl)Cl MCULE-1246638159 [1,1,0,0,0,0|2,0,0]=4 3472 B5R0.5 O=C(O)C(F)Br MCULE-5639771935 [1,1,0,0,0,0|2,0,0]=4 3473 B5R0.5 O=C(O)C(F)Cl MCULE-8791727704 [1,1,0,0,0,0|2,0,0]=4 3474 B5R0.5 O=C(O)C(F)F MCULE-9791449975 [1,1,0,0,0,0|2,0,0]=4 3475 B5R0.5 O=C(O)C(F)I MCULE-2596137309 [1,1,0,0,0,0|2,0,0]=4 3476 B5R0.5 O=C(O)C(O)O MCULE-8045135900 [1,1,0,0,0,0|1,0,0]=3 3477 B5R0.5 O=C(O)[C@@H](F)Cl MCULE-9934674808 [1,1,0,0,0,0|2,0,0]=4 3478 B5R0.5 O=C(O)[C@H](F)Cl MCULE-8184552815 [1,1,0,0,0,0|2,0,0]=4 3479 B5R0.5 O=C([O-])C(F)Br MCULE-3214706920 [1,1,0,0,0,0|2,0,0]=4 3480 B5R0.5 O=C([O-])C(F)Cl MCULE-6121365584 [1,1,0,0,0,0|2,0,0]=4 3481 B5R0.5 O=C([O-])C(F)I MCULE-5263796115 [1,1,0,0,0,0|2,0,0]=4 3482 B5R0.5 [C@@H](C)(O)C(=O)N MCULE-6953360641 [1,1,0,0,0,0|1,0,0]=3 3483 B5R0.5 [NH3+]C(C)C(C)[NH3+] MCULE-4215582247 [1,1,0,0,0,0|1,0,1]=4 3484 B5R0.2 BrC/C=C/CBr MCULE-9004545331 [1,1,0,0,0,0|1,0,1]=4 3485 B5R0.2 BrCC=CCBr MCULE-4240565660 [1,1,0,0,0,0|1,0,1]=4 3486 B5R0.2 BrCCCCBr MCULE-5088378536 [1,1,0,0,0,0|1,0,1]=4 3487 B5R0.2 C#CCCC=C MCULE-4858099861 [1,1,0,0,0,0|1,0,1]=4 3488 B5R0.2 C#CCCC=O MCULE-9994552907 [1,1,0,0,0,0|1,0,0]=3 3489 B5R0.2 C#CCCCC MCULE-5706969297 [1,1,0,0,0,0|1,0,1]=4 3490 B5R0.2 C#CCCCO MCULE-6360852809 [1,1,0,0,0,0|0,0,2]=4 3491 B5R0.2 C#CCCNC MCULE-1590490287 [1,1,0,0,0,0|2,0,0]=4 3492 B5R0.2 C#CCCNC MCULE-4004733974 [1,1,0,0,0,0|2,0,0]=4 3493 B5R0.2 C#CCCNC MCULE-7566671614 [1,1,0,0,0,0|2,0,0]=4 3494 B5R0.2 C#CCCOC MCULE-7152168835 [1,1,0,0,0,0|0,0,2]=4 3495 B5R0.2 C(=CCCl)CN MCULE-8092426171 [1,1,0,0,0,0|1,0,1]=4 3496 B5R0.2 C(=CCCl)CN MCULE-9706120646 [1,1,0,0,0,0|1,0,1]=4 3497 B5R0.2 C(=C\CCl)\CN MCULE-3474871402 [1,1,0,0,0,0|1,0,1]=4 3498 B5R0.2 C/C=C/CC#N MCULE-3707973146 [1,1,0,0,0,0|1,0,1]=4 3499 B5R0.2 C/C=C/CCC MCULE-9851656818 [1,1,0,0,0,0|1,0,0]=3 3500 B5R0.2 C/C=C/CCO MCULE-3952855392 [1,1,0,0,0,0|0,0,0]=2 3501 B5R0.2 C/C=C/OCC MCULE-2891896400 [1,1,0,0,0,0|1,0,1]=4 3502 B5R0.2 C/C=C\CCC MCULE-1013657748 [1,1,0,0,0,0|1,0,0]=3 3503 B5R0.2 C=C=CCCBr MCULE-5561919067 [1,1,0,0,0,0|1,0,1]=4 3504 B5R0.2 C=C=CCCI MCULE-7583015374 [1,1,0,0,0,0|1,0,1]=4 3505 B5R0.2 C=C=CCCN MCULE-5814175873 [1,1,0,0,0,0|1,0,1]=4 3506 B5R0.2 C=C=CCCN MCULE-8177198091 [1,1,0,0,0,0|1,0,1]=4 3507 B5R0.2 C=C=CCCO MCULE-1054355649 [1,1,0,0,0,0|0,0,1]=3 3508 B5R0.2 C=CC#CCO MCULE-5199716906 [1,1,0,0,0,0|0,0,2]=4 3509 B5R0.2 C=CC/C=C/C MCULE-8732875285 [1,1,0,0,0,0|1,0,1]=4 3510 B5R0.2 C=CCC=CC MCULE-8643449832 [1,1,0,0,0,0|1,0,1]=4 3511 B5R0.2 C=CCCC#N MCULE-8967750268 [1,1,0,0,0,0|1,0,1]=4 3512 B5R0.2 C=CCCC=C MCULE-2599309974 [1,1,0,0,0,0|1,0,1]=4 3513 B5R0.2 C=CCCC=O MCULE-7850336174 [1,1,0,0,0,0|1,0,0]=3 3514 B5R0.2 C=CCCCBr MCULE-5027518679 [1,1,0,0,0,0|1,0,1]=4 3515 B5R0.2 C=CCCCC MCULE-4750698031 [1,1,0,0,0,0|1,0,1]=4 3516 B5R0.2 C=CCCCCl MCULE-3877430809 [1,1,0,0,0,0|1,0,1]=4 3517 B5R0.2 C=CCCCI MCULE-8692831514 [1,1,0,0,0,0|1,0,1]=4 3518 B5R0.2 C=CCCCN MCULE-5787926547 [1,1,0,0,0,0|1,0,1]=4 3519 B5R0.2 C=CCCCN MCULE-7346989227 [1,1,0,0,0,0|1,0,1]=4 3520 B5R0.2 C=CCCCO MCULE-5946342321 [1,1,0,0,0,0|0,0,1]=3 3521 B5R0.2 C=CCCNC MCULE-2124263362 [1,1,0,0,0,0|1,0,1]=4 3522 B5R0.2 C=CCCNC MCULE-5024925990 [1,1,0,0,0,0|1,0,1]=4 3523 B5R0.2 C=CCCOC MCULE-4681354270 [1,1,0,0,0,0|0,0,1]=3 3524 B5R0.2 C=CCCON MCULE-3476228435 [1,1,0,0,0,0|0,0,1]=3 3525 B5R0.2 C=CCCON MCULE-9206052895 [1,1,0,0,0,0|0,0,1]=3 3526 B5R0.2 C=CCNC=O MCULE-1911798514 [1,1,0,0,0,0|1,0,1]=4 3527 B5R0.2 C=CCNCC MCULE-6987567673 [1,1,0,0,0,0|1,0,1]=4 3528 B5R0.2 C=CCNCC MCULE-8318544337 [1,1,0,0,0,0|1,0,1]=4 3529 B5R0.2 C=CCOC=O MCULE-4161785970 [1,1,0,0,0,0|1,0,1]=4 3530 B5R0.2 C=CCOCC MCULE-4363356618 [1,1,0,0,0,0|1,0,1]=4 3531 B5R0.2 C=CCOCCl MCULE-6656252526 [1,1,0,0,0,0|1,0,1]=4 3532 B5R0.2 C=CCSCC MCULE-3816911529 [1,1,0,0,0,0|1,0,1]=4 3533 B5R0.2 C=COCCC MCULE-4423853666 [1,1,0,0,0,0|1,0,1]=4 3534 B5R0.2 C=COCCCl MCULE-7782311030 [1,1,0,0,0,0|1,0,1]=4 3535 B5R0.2 C=COCCN MCULE-8052872924 [1,1,0,0,0,0|1,0,1]=4 3536 B5R0.2 C=COCCN MCULE-8496820259 [1,1,0,0,0,0|1,0,1]=4 3537 B5R0.2 C=COCCO MCULE-9383372818 [1,1,0,0,0,0|0,0,1]=3 3538 B5R0.2 CC#CCC=O MCULE-6071390808 [1,1,0,0,0,0|1,0,1]=4 3539 B5R0.2 CC#CCCBr MCULE-5650557113 [1,1,0,0,0,0|1,0,1]=4 3540 B5R0.2 CC#CCCC MCULE-8179328151 [1,1,0,0,0,0|1,0,1]=4 3541 B5R0.2 CC#CCCN MCULE-2130545109 [1,1,0,0,0,0|1,0,1]=4 3542 B5R0.2 CC#CCCN MCULE-7156357315 [1,1,0,0,0,0|1,0,1]=4 3543 B5R0.2 CC#CCCO MCULE-9400138491 [1,1,0,0,0,0|0,0,1]=3 3544 B5R0.2 CC#CCON MCULE-6251915377 [1,1,0,0,0,0|0,0,2]=4 3545 B5R0.2 CC#CCON MCULE-7089104173 [1,1,0,0,0,0|0,0,2]=4 3546 B5R0.2 CC/C=C/C=O MCULE-5102906061 [1,1,0,0,0,0|1,0,1]=4 3547 B5R0.2 CC/C=C/CC MCULE-6762040186 [1,1,0,0,0,0|1,0,1]=4 3548 B5R0.2 CC/C=C\CC MCULE-9418110460 [1,1,0,0,0,0|1,0,1]=4 3549 B5R0.2 CC/C=C\CO MCULE-5480473249 [1,1,0,0,0,0|0,0,1]=3 3550 B5R0.2 CC=CCC#N MCULE-6960681395 [1,1,0,0,0,0|1,0,1]=4 3551 B5R0.2 CC=CCCBr MCULE-7329159278 [1,1,0,0,0,0|1,0,0]=3 3552 B5R0.2 CC=CCCC MCULE-8736231124 [1,1,0,0,0,0|1,0,0]=3 3553 B5R0.2 CC=CCCN MCULE-5129102475 [1,1,0,0,0,0|1,0,0]=3 3554 B5R0.2 CC=CCCN MCULE-8500001929 [1,1,0,0,0,0|1,0,0]=3 3555 B5R0.2 CC=CCCO MCULE-4302367089 [1,1,0,0,0,0|0,0,0]=2 3556 B5R0.2 CC=COCC MCULE-1473170404 [1,1,0,0,0,0|1,0,1]=4 3557 B5R0.2 CCC#CC=O MCULE-3889262436 [1,1,0,0,0,0|1,0,1]=4 3558 B5R0.2 CCC#CCO MCULE-8633965917 [1,1,0,0,0,0|0,0,2]=4 3559 B5R0.2 CCC=CC=O MCULE-1318250395 [1,1,0,0,0,0|1,0,1]=4 3560 B5R0.2 CCC=CCBr MCULE-5326763881 [1,1,0,0,0,0|1,0,1]=4 3561 B5R0.2 CCC=CCC MCULE-5435957422 [1,1,0,0,0,0|1,0,1]=4 3562 B5R0.2 CCC=CCO MCULE-5633399984 [1,1,0,0,0,0|0,0,1]=3 3563 B5R0.2 CCCC=NO MCULE-7364375780 [1,1,0,0,0,0|0,0,2]=4 3564 B5R0.2 CCCCC#N MCULE-4015236167 [1,1,0,0,0,0|1,0,1]=4 3565 B5R0.2 CCCCC=O MCULE-4736782822 [1,1,0,0,0,0|1,0,0]=3 3566 B5R0.2 CCCCCBr MCULE-8513521912 [1,1,0,0,0,0|1,0,1]=4 3567 B5R0.2 CCCCCC MCULE-3465692202 [1,1,0,0,0,0|1,0,1]=4 3568 B5R0.2 CCCCCCl MCULE-4412759460 [1,1,0,0,0,0|1,0,1]=4 3569 B5R0.2 CCCCCF MCULE-6399883281 [1,1,0,0,0,0|1,0,1]=4 3570 B5R0.2 CCCCCI MCULE-4590300793 [1,1,0,0,0,0|1,0,1]=4 3571 B5R0.2 CCCCCN MCULE-3371742982 [1,1,0,0,0,0|1,0,1]=4 3572 B5R0.2 CCCCCN MCULE-4371067300 [1,1,0,0,0,0|1,0,1]=4 3573 B5R0.2 CCCCCN MCULE-6547961798 [1,1,0,0,0,0|1,0,1]=4 3574 B5R0.2 CCCCCN MCULE-7483248760 [1,1,0,0,0,0|1,0,1]=4 3575 B5R0.2 CCCCCO MCULE-8714292632 [1,1,0,0,0,0|0,0,1]=3 3576 B5R0.2 CCCCCS MCULE-5476379340 [1,1,0,0,0,0|0,1,1]=4 3577 B5R0.2 CCCCNC MCULE-9321610906 [1,1,0,0,0,0|1,0,1]=4 3578 B5R0.2 CCCCNN MCULE-6681305566 [1,1,0,0,0,0|1,0,1]=4 3579 B5R0.2 CCCCNN MCULE-6890760890 [1,1,0,0,0,0|1,0,1]=4 3580 B5R0.2 CCCCNN MCULE-7362497327 [1,1,0,0,0,0|1,0,1]=4 3581 B5R0.2 CCCCNN MCULE-8463623644 [1,1,0,0,0,0|1,0,1]=4 3582 B5R0.2 CCCCNO MCULE-1911206569 [1,1,0,0,0,0|0,0,1]=3 3583 B5R0.2 CCCCNO MCULE-3820646216 [1,1,0,0,0,0|0,0,1]=3 3584 B5R0.2 CCCCOC MCULE-9814272675 [1,1,0,0,0,0|0,0,1]=3 3585 B5R0.2 CCCCON MCULE-7582349983 [1,1,0,0,0,0|0,0,1]=3 3586 B5R0.2 CCCCON MCULE-8175627798 [1,1,0,0,0,0|0,0,1]=3 3587 B5R0.2 CCCCSC MCULE-2799775567 [1,1,0,0,0,0|0,1,1]=4 3588 B5R0.2 CCCN=C=O MCULE-9014468293 [1,1,0,0,0,0|1,0,1]=4 3589 B5R0.2 CCCNC=O MCULE-6344556391 [1,1,0,0,0,0|1,0,0]=3 3590 B5R0.2 CCCNCC MCULE-7948828264 [1,1,0,0,0,0|1,0,1]=4 3591 B5R0.2 CCCNCC MCULE-9107549207 [1,1,0,0,0,0|1,0,1]=4 3592 B5R0.2 CCCOC=O MCULE-3133604529 [1,1,0,0,0,0|1,0,0]=3 3593 B5R0.2 CCCOCBr MCULE-3585683043 [1,1,0,0,0,0|1,0,1]=4 3594 B5R0.2 CCCOCC MCULE-9971916790 [1,1,0,0,0,0|1,0,1]=4 3595 B5R0.2 CCCOCCl MCULE-1932627202 [1,1,0,0,0,0|1,0,1]=4 3596 B5R0.2 CCCSCC MCULE-4547385568 [1,1,0,0,0,0|1,0,1]=4 3597 B5R0.2 CCCSSC MCULE-3127072032 [1,1,0,0,0,0|2,0,0]=4 3598 B5R0.2 CCNCCCl MCULE-2589770119 [1,1,0,0,0,0|1,0,1]=4 3599 B5R0.2 CCNCCCl MCULE-3098032672 [1,1,0,0,0,0|1,0,1]=4 3600 B5R0.2 CCNCCN MCULE-7854769899 [1,1,0,0,0,0|1,0,1]=4 3601 B5R0.2 CCNCCO MCULE-2537734730 [1,1,0,0,0,0|0,0,1]=3 3602 B5R0.2 CCNCCO MCULE-3738714907 [1,1,0,0,0,0|0,0,1]=3 3603 B5R0.2 CCOCCBr MCULE-4818900555 [1,1,0,0,0,0|1,0,1]=4 3604 B5R0.2 CCOCCCl MCULE-1290576729 [1,1,0,0,0,0|1,0,1]=4 3605 B5R0.2 CCOCCI MCULE-1833092968 [1,1,0,0,0,0|1,0,1]=4 3606 B5R0.2 CCOCCN MCULE-1254431240 [1,1,0,0,0,0|1,0,1]=4 3607 B5R0.2 CCOCCN MCULE-4039110889 [1,1,0,0,0,0|1,0,1]=4 3608 B5R0.2 CCOCCN MCULE-4400456933 [1,1,0,0,0,0|1,0,1]=4 3609 B5R0.2 CCOCCO MCULE-4311513289 [1,1,0,0,0,0|0,0,1]=3 3610 B5R0.2 CCOCCS MCULE-3968740645 [1,1,0,0,0,0|0,1,1]=4 3611 B5R0.2 CCSCC=O MCULE-8069035019 [1,1,0,0,0,0|1,0,0]=3 3612 B5R0.2 CCSCCBr MCULE-9449933342 [1,1,0,0,0,0|1,0,1]=4 3613 B5R0.2 CCSCCCl MCULE-4057847237 [1,1,0,0,0,0|1,0,1]=4 3614 B5R0.2 CCSCCN MCULE-3375644872 [1,1,0,0,0,0|1,0,1]=4 3615 B5R0.2 CCSCCN MCULE-4466279976 [1,1,0,0,0,0|1,0,1]=4 3616 B5R0.2 CCSCCO MCULE-3557086162 [1,1,0,0,0,0|0,0,1]=3 3617 B5R0.2 CCSCCS MCULE-4583054157 [1,1,0,0,0,0|0,1,1]=4 3618 B5R0.2 CNCCC#N MCULE-6686234290 [1,1,0,0,0,0|2,0,0]=4 3619 B5R0.2 CNCCCBr MCULE-3376600253 [1,1,0,0,0,0|1,0,1]=4 3620 B5R0.2 CNCCCBr MCULE-6212326106 [1,1,0,0,0,0|1,0,1]=4 3621 B5R0.2 CNCCCCl MCULE-1007719210 [1,1,0,0,0,0|1,0,1]=4 3622 B5R0.2 CNCCCCl MCULE-6146901643 [1,1,0,0,0,0|1,0,1]=4 3623 B5R0.2 CNCCCF MCULE-7647417887 [1,1,0,0,0,0|1,0,1]=4 3624 B5R0.2 CNCCCN MCULE-1736081896 [1,1,0,0,0,0|1,0,1]=4 3625 B5R0.2 CNCCCO MCULE-9530478547 [1,1,0,0,0,0|0,0,1]=3 3626 B5R0.2 CNCCNC MCULE-1378979868 [1,1,0,0,0,0|2,0,0]=4 3627 B5R0.2 CNCCNC MCULE-3281508478 [1,1,0,0,0,0|2,0,0]=4 3628 B5R0.2 CNCCOC MCULE-2857904484 [1,1,0,0,0,0|1,0,0]=3 3629 B5R0.2 CNCCOC MCULE-5342712496 [1,1,0,0,0,0|1,0,0]=3 3630 B5R0.2 CNCCSC MCULE-2812984399 [1,1,0,0,0,0|1,1,0]=4 3631 B5R0.2 CNCCSC MCULE-2942435951 [1,1,0,0,0,0|1,1,0]=4 3632 B5R0.2 CNOCCN MCULE-3163962093 [1,1,0,0,0,0|2,0,0]=4 3633 B5R0.2 CNOCCN MCULE-7379538500 [1,1,0,0,0,0|2,0,0]=4 3634 B5R0.2 COCCC#N MCULE-3009737584 [1,1,0,0,0,0|1,0,1]=4 3635 B5R0.2 COCCC=O MCULE-2812117208 [1,1,0,0,0,0|0,0,0]=2 3636 B5R0.2 COCCCBr MCULE-6489536401 [1,1,0,0,0,0|1,0,1]=4 3637 B5R0.2 COCCCCl MCULE-9192274624 [1,1,0,0,0,0|1,0,1]=4 3638 B5R0.2 COCCCF MCULE-5055725246 [1,1,0,0,0,0|1,0,1]=4 3639 B5R0.2 COCCCI MCULE-9111605439 [1,1,0,0,0,0|1,0,1]=4 3640 B5R0.2 COCCCN MCULE-1421362990 [1,1,0,0,0,0|1,0,1]=4 3641 B5R0.2 COCCCN MCULE-4783132205 [1,1,0,0,0,0|1,0,1]=4 3642 B5R0.2 COCCCO MCULE-4041418048 [1,1,0,0,0,0|0,0,1]=3 3643 B5R0.2 COCCCS MCULE-2371333731 [1,1,0,0,0,0|0,1,1]=4 3644 B5R0.2 COCCNN MCULE-2086510453 [1,1,0,0,0,0|2,0,0]=4 3645 B5R0.2 COCCNN MCULE-4830987822 [1,1,0,0,0,0|2,0,0]=4 3646 B5R0.2 COCCNN MCULE-8361975855 [1,1,0,0,0,0|2,0,0]=4 3647 B5R0.2 COCCOC MCULE-7572196731 [1,1,0,0,0,0|1,0,0]=3 3648 B5R0.2 COCCON MCULE-3507489398 [1,1,0,0,0,0|1,0,0]=3 3649 B5R0.2 COCCON MCULE-8506879697 [1,1,0,0,0,0|1,0,0]=3 3650 B5R0.2 COCCSC MCULE-5362054021 [1,1,0,0,0,0|1,0,0]=3 3651 B5R0.2 COCN=C=O MCULE-6951734265 [1,1,0,0,0,0|1,0,1]=4 3652 B5R0.2 CONCCN MCULE-3332727097 [1,1,0,0,0,0|2,0,0]=4 3653 B5R0.2 CONCCN MCULE-5066538639 [1,1,0,0,0,0|2,0,0]=4 3654 B5R0.2 CONCCO MCULE-9787830121 [1,1,0,0,0,0|1,0,0]=3 3655 B5R0.2 CSCCC#N MCULE-5755086116 [1,1,0,0,0,0|2,0,0]=4 3656 B5R0.2 CSCCC=O MCULE-6273241704 [1,1,0,0,0,0|0,1,0]=3 3657 B5R0.2 CSCCCBr MCULE-8399851816 [1,1,0,0,0,0|1,0,1]=4 3658 B5R0.2 CSCCCCl MCULE-1829120476 [1,1,0,0,0,0|1,0,1]=4 3659 B5R0.2 CSCCCN MCULE-1030938424 [1,1,0,0,0,0|1,0,1]=4 3660 B5R0.2 CSCCCN MCULE-4664984921 [1,1,0,0,0,0|1,0,1]=4 3661 B5R0.2 CSCCCO MCULE-9232413185 [1,1,0,0,0,0|0,0,1]=3 3662 B5R0.2 CSCCCS MCULE-8405766359 [1,1,0,0,0,0|0,1,1]=4 3663 B5R0.2 CSCCON MCULE-9125601960 [1,1,0,0,0,0|1,0,0]=3 3664 B5R0.2 CSSCCN MCULE-7065189564 [1,1,0,0,0,0|2,0,0]=4 3665 B5R0.2 CSSCCN MCULE-8654200268 [1,1,0,0,0,0|2,0,0]=4 3666 B5R0.2 ClC/C=C/CCl MCULE-3586653669 [1,1,0,0,0,0|1,0,1]=4 3667 B5R0.2 ClC/C=C\CCl MCULE-9193094097 [1,1,0,0,0,0|1,0,1]=4 3668 B5R0.2 ClCC=CCCl MCULE-9190878082 [1,1,0,0,0,0|1,0,1]=4 3669 B5R0.2 ClCCCCBr MCULE-7973194927 [1,1,0,0,0,0|1,0,1]=4 3670 B5R0.2 ClCCCCCl MCULE-4863501782 [1,1,0,0,0,0|1,0,1]=4 3671 B5R0.2 ClCCCCI MCULE-4303507089 [1,1,0,0,0,0|1,0,1]=4 3672 B5R0.2 ClCCOCCl MCULE-7585684590 [1,1,0,0,0,0|2,0,0]=4 3673 B5R0.2 ClCOCCBr MCULE-6843473950 [1,1,0,0,0,0|2,0,0]=4 3674 B5R0.2 FCCCCBr MCULE-8408956872 [1,1,0,0,0,0|1,0,1]=4 3675 B5R0.2 FCCCCF MCULE-1347438150 [1,1,0,0,0,0|1,0,1]=4 3676 B5R0.2 ICCCCI MCULE-1390457250 [1,1,0,0,0,0|1,0,1]=4 3677 B5R0.2 N#CCCC=O MCULE-9521735106 [1,1,0,0,0,0|1,0,0]=3 3678 B5R0.2 N#CCCCO MCULE-2108386837 [1,1,0,0,0,0|0,0,2]=4 3679 B5R0.2 N#CCCON MCULE-4242787851 [1,1,0,0,0,0|1,0,1]=4 3680 B5R0.2 N#CCCON MCULE-9943219810 [1,1,0,0,0,0|1,0,1]=4 3681 B5R0.2 N#CCOC=O MCULE-4453241991 [1,1,0,0,0,0|1,0,1]=4 3682 B5R0.2 N#N=NCC=O MCULE-8370335984 [1,1,0,0,0,0|2,0,0]=4 3683 B5R0.2 N#N=NCCO MCULE-6147827656 [1,1,0,0,0,0|2,0,0]=4 3684 B5R0.2 NC/C=C/CN MCULE-3194321905 [1,1,0,0,0,0|1,0,1]=4 3685 B5R0.2 NC/C=C/CN MCULE-8357316852 [1,1,0,0,0,0|1,0,1]=4 3686 B5R0.2 NC/C=C\CCl MCULE-7895966955 [1,1,0,0,0,0|1,0,1]=4 3687 B5R0.2 NC/C=C\CN MCULE-6310541400 [1,1,0,0,0,0|1,0,1]=4 3688 B5R0.2 NC/C=C\CN MCULE-8765736519 [1,1,0,0,0,0|1,0,1]=4 3689 B5R0.2 NCC#CCO MCULE-4844677613 [1,1,0,0,0,0|0,0,2]=4 3690 B5R0.2 NCC#CCO MCULE-9095239812 [1,1,0,0,0,0|0,0,2]=4 3691 B5R0.2 NCC=CCN MCULE-3768809289 [1,1,0,0,0,0|1,0,1]=4 3692 B5R0.2 NCC=CCN MCULE-4004493343 [1,1,0,0,0,0|1,0,1]=4 3693 B5R0.2 NCC=CCN MCULE-6780035248 [1,1,0,0,0,0|1,0,1]=4 3694 B5R0.2 NCC=CCO MCULE-4993379992 [1,1,0,0,0,0|0,0,1]=3 3695 B5R0.2 NCCCCBr MCULE-7095299053 [1,1,0,0,0,0|1,0,1]=4 3696 B5R0.2 NCCCCBr MCULE-7716027825 [1,1,0,0,0,0|1,0,1]=4 3697 B5R0.2 NCCCCCl MCULE-8484381726 [1,1,0,0,0,0|1,0,1]=4 3698 B5R0.2 NCCCCCl MCULE-9917306082 [1,1,0,0,0,0|1,0,1]=4 3699 B5R0.2 NCCCCF MCULE-4260727945 [1,1,0,0,0,0|1,0,1]=4 3700 B5R0.2 NCCCCF MCULE-7716720921 [1,1,0,0,0,0|1,0,1]=4 3701 B5R0.2 NCCCCN MCULE-3098044935 [1,1,0,0,0,0|1,0,1]=4 3702 B5R0.2 NCCCCN MCULE-7898833229 [1,1,0,0,0,0|1,0,1]=4 3703 B5R0.2 NCCCCN MCULE-8029479697 [1,1,0,0,0,0|1,0,1]=4 3704 B5R0.2 NCCCCN MCULE-8509656776 [1,1,0,0,0,0|1,0,1]=4 3705 B5R0.2 NCCCCO MCULE-7395674091 [1,1,0,0,0,0|0,0,1]=3 3706 B5R0.2 NCCCCS MCULE-4353910418 [1,1,0,0,0,0|0,1,1]=4 3707 B5R0.2 NCCCCS MCULE-9812416858 [1,1,0,0,0,0|0,1,1]=4 3708 B5R0.2 NCCCON MCULE-1071170242 [1,1,0,0,0,0|1,0,1]=4 3709 B5R0.2 NCCCON MCULE-7767315563 [1,1,0,0,0,0|1,0,1]=4 3710 B5R0.2 NNCCCO MCULE-5557482626 [1,1,0,0,0,0|1,0,1]=4 3711 B5R0.2 NNCCCO MCULE-7351853032 [1,1,0,0,0,0|1,0,1]=4 3712 B5R0.2 NNCCCO MCULE-7919314403 [1,1,0,0,0,0|1,0,1]=4 3713 B5R0.2 NOC/C=C/Cl MCULE-3781481075 [1,1,0,0,0,0|1,0,1]=4 3714 B5R0.2 NOC/C=C/Cl MCULE-8874475488 [1,1,0,0,0,0|1,0,1]=4 3715 B5R0.2 NOCC=CCl MCULE-5233830243 [1,1,0,0,0,0|1,0,1]=4 3716 B5R0.2 NOCC=CCl MCULE-7677577759 [1,1,0,0,0,0|1,0,1]=4 3717 B5R0.2 NOCCCO MCULE-1072312935 [1,1,0,0,0,0|0,0,2]=4 3718 B5R0.2 NOCCCO MCULE-3715520109 [1,1,0,0,0,0|0,0,2]=4 3719 B5R0.2 NOCCCS MCULE-2063976508 [1,1,0,0,0,0|0,1,1]=4 3720 B5R0.2 NOCCCS MCULE-3464018652 [1,1,0,0,0,0|0,1,1]=4 3721 B5R0.2 NOCCON MCULE-2027662613 [1,1,0,0,0,0|2,0,0]=4 3722 B5R0.2 NOCCON MCULE-3458073239 [1,1,0,0,0,0|2,0,0]=4 3723 B5R0.2 O=C=NCCBr MCULE-9707894644 [1,1,0,0,0,0|1,0,1]=4 3724 B5R0.2 O=C=NCCCl MCULE-8919918461 [1,1,0,0,0,0|1,0,1]=4 3725 B5R0.2 O=CCCC=O MCULE-3362810468 [1,1,0,0,0,0|0,0,1]=3 3726 B5R0.2 O=CCCC=O MCULE-3813951568 [1,1,0,0,0,0|0,0,1]=3 3727 B5R0.2 O=CCCCBr MCULE-7239613396 [1,1,0,0,0,0|1,0,0]=3 3728 B5R0.2 O=CCCCCl MCULE-3011225716 [1,1,0,0,0,0|1,0,0]=3 3729 B5R0.2 O=CCCCI MCULE-3153720790 [1,1,0,0,0,0|1,0,0]=3 3730 B5R0.2 O=CCCCO MCULE-8728420992 [1,1,0,0,0,0|0,0,0]=2 3731 B5R0.2 O=CNCCO MCULE-3688614090 [1,1,0,0,0,0|0,0,0]=2 3732 B5R0.2 O=COCCO MCULE-1922672843 [1,1,0,0,0,0|0,0,0]=2 3733 B5R0.2 OC/C=C/CCl MCULE-4378785113 [1,1,0,0,0,0|0,0,1]=3 3734 B5R0.2 OC/C=C/CO MCULE-4752272005 [1,1,0,0,0,0|0,0,1]=3 3735 B5R0.2 OC/C=C\CO MCULE-2695577582 [1,1,0,0,0,0|0,0,1]=3 3736 B5R0.2 OC=CCCBr MCULE-3964604828 [1,1,0,0,0,0|1,0,1]=4 3737 B5R0.2 OC=CCCBr MCULE-5728835735 [1,1,0,0,0,0|1,0,1]=4 3738 B5R0.2 OCC#CCBr MCULE-1662147427 [1,1,0,0,0,0|0,0,2]=4 3739 B5R0.2 OCC#CCCl MCULE-9445494949 [1,1,0,0,0,0|0,0,2]=4 3740 B5R0.2 OCC#CCO MCULE-2650636766 [1,1,0,0,0,0|0,0,2]=4 3741 B5R0.2 OCC=CCCl MCULE-7597942117 [1,1,0,0,0,0|0,0,1]=3 3742 B5R0.2 OCC=CCO MCULE-9559211408 [1,1,0,0,0,0|0,0,1]=3 3743 B5R0.2 OCCCCBr MCULE-9231591925 [1,1,0,0,0,0|0,0,1]=3 3744 B5R0.2 OCCCCCl MCULE-3507644812 [1,1,0,0,0,0|0,0,1]=3 3745 B5R0.2 OCCCCF MCULE-9242285588 [1,1,0,0,0,0|0,0,1]=3 3746 B5R0.2 OCCCCI MCULE-8723720522 [1,1,0,0,0,0|0,0,1]=3 3747 B5R0.2 OCCCCO MCULE-2010022287 [1,1,0,0,0,0|0,0,1]=3 3748 B5R0.2 OCCCCO MCULE-6551106098 [1,1,0,0,0,0|0,0,1]=3 3749 B5R0.2 OCCCCS MCULE-8169490949 [1,1,0,0,0,0|0,0,1]=3 3750 B5R0.2 OCCNCO MCULE-2141033453 [1,1,0,0,0,0|1,0,0]=3 3751 B5R0.2 SCCCCS MCULE-6695609899 [1,1,0,0,0,0|0,1,1]=4 3752 B7R0.2 C#CC(C)CC(=O)O MCULE-8780802803 [0,2,0,0,0,0|2,0,0]=4 3753 B7R0.2 C#CC(O)CC(C)C MCULE-1610080651 [0,2,0,0,0,0|1,0,1]=4 3754 B7R0.2 C(O)(CN)CC(=O)O MCULE-8378388788 [0,2,0,0,0,0|1,0,0]=3 3755 B7R0.2 C/C(=N\O)/CC(C)C MCULE-1223937315 [0,2,0,0,0,0|1,0,1]=4 3756 B7R0.2 C=C(C)CC(C)CC MCULE-1001667584 [0,2,0,0,0,0|2,0,0]=4 3757 B7R0.2 C=C(C)CC(N)CO MCULE-9114906744 [0,2,0,0,0,0|1,0,0]=3 3758 B7R0.2 C=CC(=O)CC(C)C MCULE-2912404970 [0,2,0,0,0,0|1,0,1]=4 3759 B7R0.2 C=CC(C)CC(=O)O MCULE-4817084034 [0,2,0,0,0,0|2,0,0]=4 3760 B7R0.2 C=CC(C)OC(=O)C MCULE-9221300039 [0,2,0,0,0,0|1,0,1]=4 3761 B7R0.2 C=CC(N)CC(=O)O MCULE-1733618438 [0,2,0,0,0,0|2,0,0]=4 3762 B7R0.2 C=CC(N)CC(=O)O MCULE-9636299966 [0,2,0,0,0,0|2,0,0]=4 3763 B7R0.2 C=CC(O)CC(=O)O MCULE-2383393271 [0,2,0,0,0,0|1,0,0]=3 3764 B7R0.2 C=CC(O)CC(C)C MCULE-7389371130 [0,2,0,0,0,0|1,0,1]=4 3765 B7R0.2 CC(=CC(=O)O)C=O MCULE-7652207149 [0,2,0,0,0,0|0,0,2]=4 3766 B7R0.2 CC(=NO)CC(C)C MCULE-1446840557 [0,2,0,0,0,0|1,0,1]=4 3767 B7R0.2 CC(=O)NC(=O)CBr MCULE-3222708274 [0,2,0,0,0,0|1,0,1]=4 3768 B7R0.2 CC(=O)NC(C)CN MCULE-4226474809 [0,2,0,0,0,0|1,0,0]=3 3769 B7R0.2 CC(=O)NC(C)CN MCULE-7570690280 [0,2,0,0,0,0|1,0,0]=3 3770 B7R0.2 CC(=O)NC(C)CO MCULE-9455210462 [0,2,0,0,0,0|0,0,0]=2 3771 B7R0.2 CC(=O)N[C@H](C)CO MCULE-2174899443 [0,2,0,0,0,0|0,0,0]=2 3772 B7R0.2 CC(=O)N[C@H](C)CO MCULE-5097293473 [0,2,0,0,0,0|0,0,0]=2 3773 B7R0.2 CC(=O)OC(Br)CBr MCULE-7215936142 [0,2,0,0,0,0|1,0,0]=3 3774 B7R0.2 CC(C)CC(=O)C#N MCULE-7628756423 [0,2,0,0,0,0|1,0,1]=4 3775 B7R0.2 CC(C)CC(=O)CBr MCULE-3556695745 [0,2,0,0,0,0|1,0,0]=3 3776 B7R0.2 CC(C)CC(=O)CCl MCULE-6858533367 [0,2,0,0,0,0|1,0,0]=3 3777 B7R0.2 CC(C)CC(=O)CN MCULE-2435223768 [0,2,0,0,0,0|1,0,0]=3 3778 B7R0.2 CC(C)CC(=O)CN MCULE-7131454463 [0,2,0,0,0,0|1,0,0]=3 3779 B7R0.2 CC(C)CC(=O)NN MCULE-7719387931 [0,2,0,0,0,0|2,0,0]=4 3780 B7R0.2 CC(C)CC(C)C=O MCULE-4209363554 [0,2,0,0,0,0|1,0,1]=4 3781 B7R0.2 CC(C)CC(C)CO MCULE-5856507691 [0,2,0,0,0,0|1,0,1]=4 3782 B7R0.2 CC(C)CC(N)CO MCULE-6347344178 [0,2,0,0,0,0|1,0,1]=4 3783 B7R0.2 CC(C)CC(N)CO MCULE-7024759986 [0,2,0,0,0,0|1,0,1]=4 3784 B7R0.2 CC(C)CC(O)C#N MCULE-7308674465 [0,2,0,0,0,0|1,0,1]=4 3785 B7R0.2 CC(C)CC(O)CN MCULE-9414833333 [0,2,0,0,0,0|1,0,1]=4 3786 B7R0.2 CC(C)CC(O)CN MCULE-9784331526 [0,2,0,0,0,0|1,0,1]=4 3787 B7R0.2 CC(C)CN(C)N=O MCULE-1639713023 [0,2,0,0,0,0|2,0,0]=4 3788 B7R0.2 CC(C)C[C@@H](N)CO MCULE-1979401982 [0,2,0,0,0,0|1,0,1]=4 3789 B7R0.2 CC(C)C[C@@H](N)CO MCULE-3025407298 [0,2,0,0,0,0|1,0,1]=4 3790 B7R0.2 CC(C)C[C@H](N)CO MCULE-2790872575 [0,2,0,0,0,0|1,0,1]=4 3791 B7R0.2 CC(C)C[C@H](N)CO MCULE-9198147139 [0,2,0,0,0,0|1,0,1]=4 3792 B7R0.2 CC(C)NC(=O)CBr MCULE-1272363222 [0,2,0,0,0,0|2,0,0]=4 3793 B7R0.2 CC(C)NC(=O)CCl MCULE-8342964960 [0,2,0,0,0,0|2,0,0]=4 3794 B7R0.2 CC(C)NC(=O)CI MCULE-8316056040 [0,2,0,0,0,0|2,0,0]=4 3795 B7R0.2 CC(C)NC(=O)CN MCULE-7188824856 [0,2,0,0,0,0|2,0,0]=4 3796 B7R0.2 CC(C)NC(=O)CN MCULE-8867435369 [0,2,0,0,0,0|2,0,0]=4 3797 B7R0.2 CC(C)NC(=O)CO MCULE-5386700783 [0,2,0,0,0,0|2,0,0]=4 3798 B7R0.2 CC(C)OC(=O)CBr MCULE-1610339208 [0,2,0,0,0,0|2,0,0]=4 3799 B7R0.2 CC(C)OC(=O)CCl MCULE-3017211046 [0,2,0,0,0,0|2,0,0]=4 3800 B7R0.2 CC(C)OC(=O)CN MCULE-4475626262 [0,2,0,0,0,0|2,0,0]=4 3801 B7R0.2 CC(C)OC(=O)CN MCULE-5696337645 [0,2,0,0,0,0|2,0,0]=4 3802 B7R0.2 CC(C)OC(=O)CO MCULE-4694316703 [0,2,0,0,0,0|2,0,0]=4 3803 B7R0.2 CC(C)OC(=O)CS MCULE-5298940210 [0,2,0,0,0,0|2,0,0]=4 3804 B7R0.2 CC(CC(=O)O)NN MCULE-2614719429 [0,2,0,0,0,0|2,0,0]=4 3805 B7R0.2 CC(CC(=O)O)NN MCULE-2739806820 [0,2,0,0,0,0|2,0,0]=4 3806 B7R0.2 CC(CCl)CC(=O)Cl MCULE-3163826919 [0,2,0,0,0,0|2,0,0]=4 3807 B7R0.2 CC(CCl)OC(=O)N MCULE-7734729292 [0,2,0,0,0,0|2,0,0]=4 3808 B7R0.2 CC(CN)CC(=O)O MCULE-1594242184 [0,2,0,0,0,0|2,0,0]=4 3809 B7R0.2 CC(CN)CC(=O)O MCULE-8074816359 [0,2,0,0,0,0|2,0,0]=4 3810 B7R0.2 CC(CO)CN(C)C MCULE-3103307387 [0,2,0,0,0,0|2,0,0]=4 3811 B7R0.2 CC(O)CC(=O)NN MCULE-2521784411 [0,2,0,0,0,0|1,0,0]=3 3812 B7R0.2 CC(O)CC(C)CN MCULE-3086796159 [0,2,0,0,0,0|1,0,1]=4 3813 B7R0.2 CCC(=O)CC(=O)C MCULE-1892470405 [0,2,0,0,0,0|1,0,0]=3 3814 B7R0.2 CCC(=O)CC(=O)O MCULE-1083768149 [0,2,0,0,0,0|0,0,1]=3 3815 B7R0.2 CCC(=O)CC(C)C MCULE-8378320990 [0,2,0,0,0,0|1,0,0]=3 3816 B7R0.2 CCC(=O)NC(C)C MCULE-3565002235 [0,2,0,0,0,0|2,0,0]=4 3817 B7R0.2 CCC(=O)OC(=O)C MCULE-8264492254 [0,2,0,0,0,0|1,0,1]=4 3818 B7R0.2 CCC(=O)OC(C)C MCULE-6546381101 [0,2,0,0,0,0|2,0,0]=4 3819 B7R0.2 CCC(C)CC(=O)C MCULE-5801548800 [0,2,0,0,0,0|1,0,0]=3 3820 B7R0.2 CCC(C)CC(=O)Cl MCULE-3063561496 [0,2,0,0,0,0|2,0,0]=4 3821 B7R0.2 CCC(C)CC(=O)O MCULE-3409782202 [0,2,0,0,0,0|2,0,0]=4 3822 B7R0.2 CCC(C)CC(=O)O MCULE-6537278030 [0,2,0,0,0,0|2,0,0]=4 3823 B7R0.2 CCC(C)NC(=O)N MCULE-6186330882 [0,2,0,0,0,0|2,0,0]=4 3824 B7R0.2 CCC(C)OC(=O)C MCULE-8410375215 [0,2,0,0,0,0|1,0,0]=3 3825 B7R0.2 CCC(C)OC(=O)Cl MCULE-1512790698 [0,2,0,0,0,0|2,0,0]=4 3826 B7R0.2 CCC(C)SC(=O)Cl MCULE-4681925921 [0,2,0,0,0,0|2,0,0]=4 3827 B7R0.2 CCC(N)CC(=O)O MCULE-1744910444 [0,2,0,0,0,0|2,0,0]=4 3828 B7R0.2 CCC(N)CC(=O)O MCULE-5610499925 [0,2,0,0,0,0|2,0,0]=4 3829 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [0,2,0,0,0,0|1,0,1]=4 3830 B7R0.2 CCC(O)CC(=O)C MCULE-1222748729 [0,2,0,0,0,0|0,0,0]=2 3831 B7R0.2 CCC(O)CC(=O)O MCULE-4663578527 [0,2,0,0,0,0|1,0,0]=3 3832 B7R0.2 CCC(O)CC(C)O MCULE-3115543235 [0,2,0,0,0,0|0,0,2]=4 3833 B7R0.2 CCC(O)CN(=O)=O MCULE-6965491054 [0,2,0,0,0,0|2,0,0]=4 3834 B7R0.2 CCC(O)CN(C)C MCULE-5823673760 [0,2,0,0,0,0|2,0,0]=4 3835 B7R0.2 CCN(C)CC(=O)C MCULE-5302720081 [0,2,0,0,0,0|1,0,0]=3 3836 B7R0.2 CCN(C)CC(=O)C MCULE-7283054437 [0,2,0,0,0,0|1,0,0]=3 3837 B7R0.2 CCN(C)CC(=O)O MCULE-3102395413 [0,2,0,0,0,0|2,0,0]=4 3838 B7R0.2 CCS(=O)CC(=O)O MCULE-5648298475 [0,2,0,0,0,0|1,0,1]=4 3839 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-5550070887 [0,2,0,0,0,0|2,0,0]=4 3840 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-9572363620 [0,2,0,0,0,0|2,0,0]=4 3841 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-1158271004 [0,2,0,0,0,0|2,0,0]=4 3842 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-2354820947 [0,2,0,0,0,0|2,0,0]=4 3843 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-4284161835 [0,2,0,0,0,0|2,0,0]=4 3844 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-9523089766 [0,2,0,0,0,0|2,0,0]=4 3845 B7R0.2 CC[C@H](C)CC(=O)O MCULE-4177365854 [0,2,0,0,0,0|2,0,0]=4 3846 B7R0.2 CC[C@H](C)CC(=O)O MCULE-5173108207 [0,2,0,0,0,0|2,0,0]=4 3847 B7R0.2 CC[C@H](N)CC(=O)O MCULE-1463536674 [0,2,0,0,0,0|2,0,0]=4 3848 B7R0.2 CC[C@H](N)CC(=O)O MCULE-2865599647 [0,2,0,0,0,0|2,0,0]=4 3849 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4506847599 [0,2,0,0,0,0|2,0,0]=4 3850 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4819674539 [0,2,0,0,0,0|2,0,0]=4 3851 B7R0.2 CN(C)CC(N)CO MCULE-2789134862 [0,2,0,0,0,0|2,0,0]=4 3852 B7R0.2 CN(C)CC(N)CO MCULE-4090276677 [0,2,0,0,0,0|2,0,0]=4 3853 B7R0.2 CN(C)CC(O)CCl MCULE-3657515294 [0,2,0,0,0,0|2,0,0]=4 3854 B7R0.2 CN(C)CC(O)CCl MCULE-8459273595 [0,2,0,0,0,0|2,0,0]=4 3855 B7R0.2 CN(C)CC(O)CN MCULE-7476161270 [0,2,0,0,0,0|2,0,0]=4 3856 B7R0.2 CN(C)CC(O)CN MCULE-8533203733 [0,2,0,0,0,0|2,0,0]=4 3857 B7R0.2 CN(C)CC(O)CO MCULE-3436894516 [0,2,0,0,0,0|2,0,0]=4 3858 B7R0.2 CN(C)C[C@@H](O)CO MCULE-7101033572 [0,2,0,0,0,0|2,0,0]=4 3859 B7R0.2 CN(C)C[C@H](O)CO MCULE-4297947949 [0,2,0,0,0,0|2,0,0]=4 3860 B7R0.2 CN(C=O)CC(=O)O MCULE-2679649056 [0,2,0,0,0,0|1,0,1]=4 3861 B7R0.2 CN(CC(=O)O)N=O MCULE-5473244336 [0,2,0,0,0,0|1,0,1]=4 3862 B7R0.2 CNC(=O)CC(=N)N MCULE-4798896062 [0,2,0,0,0,0|1,0,1]=4 3863 B7R0.2 CNC(=O)CC(=N)N MCULE-6994336455 [0,2,0,0,0,0|1,0,1]=4 3864 B7R0.2 CNC(=O)CC(=O)C MCULE-4316009681 [0,2,0,0,0,0|0,0,2]=4 3865 B7R0.2 CNC(=O)CC(=O)O MCULE-3506871336 [0,2,0,0,0,0|0,0,1]=3 3866 B7R0.2 CNC(=O)CC(=S)N MCULE-1637389152 [0,2,0,0,0,0|0,1,1]=4 3867 B7R0.2 CNC(=O)CC(C)C MCULE-2303112628 [0,2,0,0,0,0|1,0,0]=3 3868 B7R0.2 CNC(=O)CC(C)N MCULE-7773306348 [0,2,0,0,0,0|1,0,0]=3 3869 B7R0.2 CNC(=O)CC(C)N MCULE-8658175271 [0,2,0,0,0,0|1,0,0]=3 3870 B7R0.2 CNC(=O)CN(=O)=O MCULE-2253664059 [0,2,0,0,0,0|1,0,1]=4 3871 B7R0.2 CNC(C)CC(=O)N MCULE-1474658720 [0,2,0,0,0,0|2,0,0]=4 3872 B7R0.2 CNC(C)CC(=O)N MCULE-4481385519 [0,2,0,0,0,0|2,0,0]=4 3873 B7R0.2 CNC(C)CC(=O)O MCULE-6592893730 [0,2,0,0,0,0|2,0,0]=4 3874 B7R0.2 CNC(C)CC(=O)O MCULE-7655437452 [0,2,0,0,0,0|2,0,0]=4 3875 B7R0.2 CNC(C)CS(=O)C MCULE-5598071425 [0,2,0,0,0,0|2,0,0]=4 3876 B7R0.2 COC(=CC(=O)C)C MCULE-1939113485 [0,2,0,0,0,0|0,0,2]=4 3877 B7R0.2 COC(=N)CC(C)C MCULE-4603041381 [0,2,0,0,0,0|2,0,0]=4 3878 B7R0.2 COC(=N)CC(C)C MCULE-5838686710 [0,2,0,0,0,0|2,0,0]=4 3879 B7R0.2 COC(=O)CC(=N)N MCULE-3622266378 [0,2,0,0,0,0|1,0,1]=4 3880 B7R0.2 COC(=O)CC(=N)N MCULE-8717458518 [0,2,0,0,0,0|1,0,1]=4 3881 B7R0.2 COC(=O)CC(=O)C MCULE-1265364784 [0,2,0,0,0,0|0,0,1]=3 3882 B7R0.2 COC(=O)CC(=O)Cl MCULE-5016603273 [0,2,0,0,0,0|0,0,2]=4 3883 B7R0.2 COC(=O)CC(=O)N MCULE-7129379910 [0,2,0,0,0,0|0,0,2]=4 3884 B7R0.2 COC(=O)CC(=O)O MCULE-7983457925 [0,2,0,0,0,0|0,0,1]=3 3885 B7R0.2 COC(=O)CC(=O)[O-] MCULE-4316322156 [0,2,0,0,0,0|0,0,2]=4 3886 B7R0.2 COC(=O)CC(=S)N MCULE-3325362226 [0,2,0,0,0,0|0,1,1]=4 3887 B7R0.2 COC(=O)CC(C)Br MCULE-4193147778 [0,2,0,0,0,0|1,0,0]=3 3888 B7R0.2 COC(=O)CC(C)C MCULE-2808202854 [0,2,0,0,0,0|1,0,0]=3 3889 B7R0.2 COC(=O)CC(C)Cl MCULE-2734734940 [0,2,0,0,0,0|1,0,0]=3 3890 B7R0.2 COC(=O)CC(C)N MCULE-2402304310 [0,2,0,0,0,0|1,0,0]=3 3891 B7R0.2 COC(=O)CC(C)N MCULE-3520358398 [0,2,0,0,0,0|1,0,0]=3 3892 B7R0.2 COC(=O)CC(C)N MCULE-4044567169 [0,2,0,0,0,0|1,0,0]=3 3893 B7R0.2 COC(=O)CC(C)N MCULE-5962991844 [0,2,0,0,0,0|1,0,0]=3 3894 B7R0.2 COC(=O)CC(C)O MCULE-7542131760 [0,2,0,0,0,0|0,0,0]=2 3895 B7R0.2 COC(=O)CC(C)O MCULE-7559608260 [0,2,0,0,0,0|0,0,0]=2 3896 B7R0.2 COC(=O)CC(C)S MCULE-8423856471 [0,2,0,0,0,0|0,1,0]=3 3897 B7R0.2 COC(=O)CN(=O)=O MCULE-9778666398 [0,2,0,0,0,0|1,0,1]=4 3898 B7R0.2 COC(=O)CN(C)C MCULE-2035644817 [0,2,0,0,0,0|2,0,0]=4 3899 B7R0.2 COC(=O)CN(C)C MCULE-2356820620 [0,2,0,0,0,0|2,0,0]=4 3900 B7R0.2 COC(=O)CS(=O)C MCULE-6286293391 [0,2,0,0,0,0|1,0,1]=4 3901 B7R0.2 COC(=O)C[C@@H](C)N MCULE-1483636974 [0,2,0,0,0,0|1,0,0]=3 3902 B7R0.2 COC(=O)C[C@@H](C)N MCULE-4260923997 [0,2,0,0,0,0|1,0,0]=3 3903 B7R0.2 COC(=O)C[C@@H](C)N MCULE-6569883717 [0,2,0,0,0,0|1,0,0]=3 3904 B7R0.2 COC(=O)C[C@@H](C)N MCULE-9853158708 [0,2,0,0,0,0|1,0,0]=3 3905 B7R0.2 COC(=O)C[C@@H](C)O MCULE-1647366037 [0,2,0,0,0,0|0,0,0]=2 3906 B7R0.2 COC(=O)C[C@@H](C)O MCULE-7832771936 [0,2,0,0,0,0|0,0,0]=2 3907 B7R0.2 COC(=O)C[C@H](C)N MCULE-1385999778 [0,2,0,0,0,0|1,0,0]=3 3908 B7R0.2 COC(=O)C[C@H](C)N MCULE-1446150641 [0,2,0,0,0,0|1,0,0]=3 3909 B7R0.2 COC(=O)C[C@H](C)N MCULE-2979603570 [0,2,0,0,0,0|1,0,0]=3 3910 B7R0.2 COC(=O)C[C@H](C)N MCULE-7679126750 [0,2,0,0,0,0|1,0,0]=3 3911 B7R0.2 COC(=O)C[C@H](C)O MCULE-5154734951 [0,2,0,0,0,0|0,0,0]=2 3912 B7R0.2 COC(=O)C[C@H](C)O MCULE-7031738180 [0,2,0,0,0,0|0,0,0]=2 3913 B7R0.2 COC(=O)NC(C)C MCULE-4552685948 [0,2,0,0,0,0|2,0,0]=4 3914 B7R0.2 COC(=O)OC(C)C MCULE-4462394604 [0,2,0,0,0,0|2,0,0]=4 3915 B7R0.2 COC(=O)SC(C)C MCULE-9908884347 [0,2,0,0,0,0|2,0,0]=4 3916 B7R0.2 COC(C)CC(=O)O MCULE-7063015720 [0,2,0,0,0,0|1,0,0]=3 3917 B7R0.2 COC(C)CC(C)O MCULE-3635789827 [0,2,0,0,0,0|0,0,2]=4 3918 B7R0.2 CSC(=O)CC(C)C MCULE-5433173038 [0,2,0,0,0,0|1,0,0]=3 3919 B7R0.2 CSC(C)CC(=O)O MCULE-7827833531 [0,2,0,0,0,0|1,1,0]=4 3920 B7R0.2 C[C@H](CN)CC(=O)O MCULE-4808630217 [0,2,0,0,0,0|2,0,0]=4 3921 B7R0.2 C[C@H](CN)CC(=O)O MCULE-5474405940 [0,2,0,0,0,0|2,0,0]=4 3922 B7R0.2 N#CC(N)CC(=O)N MCULE-6918234601 [0,2,0,0,0,0|2,0,0]=4 3923 B7R0.2 N/C(=N/O)/CC(=O)O MCULE-5236282846 [0,2,0,0,0,0|1,0,1]=4 3924 B7R0.2 NC(=O)C/C(=N\O)/N MCULE-7090967368 [0,2,0,0,0,0|1,0,1]=4 3925 B7R0.2 NC(CO)CC(=O)O MCULE-4749383822 [0,2,0,0,0,0|1,0,0]=3 3926 B7R0.2 NC(CO)CC(=O)O MCULE-7973334774 [0,2,0,0,0,0|1,0,0]=3 3927 B7R0.2 NC(CO)CC(=O)O MCULE-8406665261 [0,2,0,0,0,0|1,0,0]=3 3928 B7R0.2 NCC(N)CC(=O)O MCULE-5523883615 [0,2,0,0,0,0|2,0,0]=4 3929 B7R0.2 NCC(N)CC(=O)O MCULE-7594259237 [0,2,0,0,0,0|2,0,0]=4 3930 B7R0.2 NCC(O)CC(=O)O MCULE-9221352157 [0,2,0,0,0,0|1,0,0]=3 3931 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-6348974465 [0,2,0,0,0,0|2,0,0]=4 3932 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-9397628218 [0,2,0,0,0,0|2,0,0]=4 3933 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-2174350055 [0,2,0,0,0,0|1,0,0]=3 3934 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-8177708130 [0,2,0,0,0,0|1,0,0]=3 3935 B7R0.2 NC[C@H](N)CC(=O)O MCULE-6133569516 [0,2,0,0,0,0|2,0,0]=4 3936 B7R0.2 NC[C@H](N)CC(=O)O MCULE-7098533469 [0,2,0,0,0,0|2,0,0]=4 3937 B7R0.2 NC[C@H](O)CC(=O)O MCULE-6634973995 [0,2,0,0,0,0|1,0,0]=3 3938 B7R0.2 NC[C@H](O)CC(=O)O MCULE-8055679819 [0,2,0,0,0,0|1,0,0]=3 3939 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-1773927420 [0,2,0,0,0,0|1,0,0]=3 3940 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-2797951743 [0,2,0,0,0,0|1,0,0]=3 3941 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-3839766977 [0,2,0,0,0,0|1,0,0]=3 3942 B7R0.2 N[C@H](CO)CC(=O)O MCULE-4130106630 [0,2,0,0,0,0|1,0,0]=3 3943 B7R0.2 O=C(Br)CC(=O)CBr MCULE-5776576043 [0,2,0,0,0,0|0,0,2]=4 3944 B7R0.2 O=C(Cl)CC(=O)CCl MCULE-6416318811 [0,2,0,0,0,0|0,0,2]=4 3945 B7R0.2 O=C(O)CC(=O)CCl MCULE-9671015150 [0,2,0,0,0,0|0,0,1]=3 3946 B7R0.2 O=C(O)CC(=O)CO MCULE-2224143705 [0,2,0,0,0,0|0,0,1]=3 3947 B7R0.2 O=C(O)CC(O)CO MCULE-2851149196 [0,2,0,0,0,0|1,0,0]=3 3948 B7R0.2 O=C(O)C[C@H](O)CO MCULE-5671818548 [0,2,0,0,0,0|1,0,0]=3 3949 B7R0.2 O=C([O-])CC(O)CO MCULE-5202762172 [0,2,0,0,0,0|1,0,0]=3 3950 B7R0.2 O=C([O-])CC(O)CO MCULE-6219855770 [0,2,0,0,0,0|1,0,0]=3 3951 B7R0.2 O=CN(O)CC(=O)O MCULE-7408790227 [0,2,0,0,0,0|2,0,0]=4 3952 B7R0.2 [NH3+][C@H](CO)CC(=O)[O-] MCULE-5131942851 [0,2,0,0,0,0|1,0,0]=3 3953 B7R0.3 C#CCCC(=O)OC MCULE-8778440511 [0,2,0,0,0,0|1,0,0]=3 3954 B7R0.3 C#CCNC(=O)CBr MCULE-4982494323 [0,2,0,0,0,0|1,0,1]=4 3955 B7R0.3 C#CCNC(=O)CC MCULE-2258533582 [0,2,0,0,0,0|1,0,1]=4 3956 B7R0.3 C#CCNC(=O)CCl MCULE-8014837574 [0,2,0,0,0,0|1,0,1]=4 3957 B7R0.3 C#CCNC(=O)CI MCULE-1660068128 [0,2,0,0,0,0|1,0,1]=4 3958 B7R0.3 C#CCNC(=O)CN MCULE-4492178837 [0,2,0,0,0,0|1,0,1]=4 3959 B7R0.3 C#CCNC(=O)CN MCULE-7672614770 [0,2,0,0,0,0|1,0,1]=4 3960 B7R0.3 C#CCNC(=O)NC MCULE-5171868572 [0,2,0,0,0,0|1,0,1]=4 3961 B7R0.3 C#CCNC(=O)OC MCULE-3058580094 [0,2,0,0,0,0|1,0,1]=4 3962 B7R0.3 C#CCOC(=O)CC MCULE-9368945481 [0,2,0,0,0,0|1,0,1]=4 3963 B7R0.3 C#CCOC(=O)OC MCULE-7912235498 [0,2,0,0,0,0|1,0,1]=4 3964 B7R0.3 C/C=C/CC(=O)OC MCULE-7204157194 [0,2,0,0,0,0|1,0,1]=4 3965 B7R0.3 C=C(C=O)CCC#N MCULE-3479954551 [0,2,0,0,0,0|1,0,1]=4 3966 B7R0.3 C=C(C=O)CCCC MCULE-4974026399 [0,2,0,0,0,0|1,0,1]=4 3967 B7R0.3 C=C(CC)CCCC MCULE-5118701402 [0,2,0,0,0,0|2,0,0]=4 3968 B7R0.3 C=C(CCl)OCOC MCULE-3049043061 [0,2,0,0,0,0|2,0,0]=4 3969 B7R0.3 C=CC(=C)CCCO MCULE-3558306961 [0,2,0,0,0,0|1,0,1]=4 3970 B7R0.3 C=CC(=O)CCCCl MCULE-7188402172 [0,2,0,0,0,0|1,0,1]=4 3971 B7R0.3 C=CC(=O)NCCC MCULE-5704500398 [0,2,0,0,0,0|1,0,1]=4 3972 B7R0.3 C=CC(=O)NCCN MCULE-5552021639 [0,2,0,0,0,0|1,0,1]=4 3973 B7R0.3 C=CC(=O)NCCN MCULE-6417335153 [0,2,0,0,0,0|1,0,1]=4 3974 B7R0.3 C=CC(=O)NCCO MCULE-2036150536 [0,2,0,0,0,0|0,0,1]=3 3975 B7R0.3 C=CC(=O)OCCBr MCULE-3258133915 [0,2,0,0,0,0|1,0,1]=4 3976 B7R0.3 C=CC(=O)OCCC MCULE-5292603407 [0,2,0,0,0,0|1,0,1]=4 3977 B7R0.3 C=CC(=O)OCCCl MCULE-6902160724 [0,2,0,0,0,0|1,0,1]=4 3978 B7R0.3 C=CC(=O)OCCF MCULE-6798260659 [0,2,0,0,0,0|1,0,1]=4 3979 B7R0.3 C=CC(=O)OCCN MCULE-9056583453 [0,2,0,0,0,0|1,0,1]=4 3980 B7R0.3 C=CC(=O)OCCO MCULE-3147939665 [0,2,0,0,0,0|0,0,1]=3 3981 B7R0.3 C=CCCC(=O)CBr MCULE-8443541398 [0,2,0,0,0,0|1,0,0]=3 3982 B7R0.3 C=CCCC(=O)CC MCULE-7933484898 [0,2,0,0,0,0|1,0,0]=3 3983 B7R0.3 C=CCCC(=O)CCl MCULE-4669619111 [0,2,0,0,0,0|1,0,0]=3 3984 B7R0.3 C=CCCC(=O)NC MCULE-9859680580 [0,2,0,0,0,0|1,0,0]=3 3985 B7R0.3 C=CCCC(=O)NN MCULE-1170308182 [0,2,0,0,0,0|2,0,0]=4 3986 B7R0.3 C=CCCC(=O)OC MCULE-8671478952 [0,2,0,0,0,0|1,0,0]=3 3987 B7R0.3 C=CCCC(=S)OC MCULE-4709907145 [0,2,0,0,0,0|1,1,0]=4 3988 B7R0.3 C=CCNC(=O)CBr MCULE-5894560132 [0,2,0,0,0,0|1,0,1]=4 3989 B7R0.3 C=CCNC(=O)CCl MCULE-4830676670 [0,2,0,0,0,0|1,0,1]=4 3990 B7R0.3 C=CCNC(=O)CN MCULE-8221456161 [0,2,0,0,0,0|1,0,1]=4 3991 B7R0.3 C=CCNC(=O)CN MCULE-9764331326 [0,2,0,0,0,0|1,0,1]=4 3992 B7R0.3 C=CCNC(=O)CO MCULE-1240234665 [0,2,0,0,0,0|1,0,1]=4 3993 B7R0.3 C=CCNC(=O)CS MCULE-1040670812 [0,2,0,0,0,0|1,0,1]=4 3994 B7R0.3 C=CCOC(=O)CBr MCULE-1915528510 [0,2,0,0,0,0|1,0,1]=4 3995 B7R0.3 C=CCOC(=O)CCl MCULE-4722834512 [0,2,0,0,0,0|1,0,1]=4 3996 B7R0.3 C=CCOC(=O)CI MCULE-1155914135 [0,2,0,0,0,0|1,0,1]=4 3997 B7R0.3 C=CCOC(=O)CN MCULE-2053601318 [0,2,0,0,0,0|1,0,1]=4 3998 B7R0.3 C=CCOC(=O)CN MCULE-8513191813 [0,2,0,0,0,0|1,0,1]=4 3999 B7R0.3 C=CCOC(=O)CS MCULE-3191036289 [0,2,0,0,0,0|1,0,1]=4 4000 B7R0.3 C=CCOC(=O)OC MCULE-9416609870 [0,2,0,0,0,0|1,0,1]=4 4001 B7R0.3 CC#CCC(=O)OC MCULE-4727663716 [0,2,0,0,0,0|1,0,1]=4 4002 B7R0.3 CC(C=O)CCC#N MCULE-6355316754 [0,2,0,0,0,0|1,0,1]=4 4003 B7R0.3 CC(CCCO)NN MCULE-8201748999 [0,2,0,0,0,0|1,0,1]=4 4004 B7R0.3 CC(CN)CCCO MCULE-2908684674 [0,2,0,0,0,0|1,0,1]=4 4005 B7R0.3 CC(CN)CCCO MCULE-5608783947 [0,2,0,0,0,0|1,0,1]=4 4006 B7R0.3 CC(CN)CCCO MCULE-9269954426 [0,2,0,0,0,0|1,0,1]=4 4007 B7R0.3 CC(CO)CCCO MCULE-8589885622 [0,2,0,0,0,0|0,0,2]=4 4008 B7R0.3 CC(CO)NCCO MCULE-5180763491 [0,2,0,0,0,0|0,0,2]=4 4009 B7R0.3 CC/C=C/C(=O)OC MCULE-5661442711 [0,2,0,0,0,0|1,0,1]=4 4010 B7R0.3 CC=CCC(=O)OC MCULE-9658428283 [0,2,0,0,0,0|1,0,1]=4 4011 B7R0.3 CCC(=O)CCCBr MCULE-3298679210 [0,2,0,0,0,0|1,0,0]=3 4012 B7R0.3 CCC(=O)CCCCl MCULE-3397599793 [0,2,0,0,0,0|1,0,0]=3 4013 B7R0.3 CCC(=O)NCCN MCULE-3384406070 [0,2,0,0,0,0|1,0,0]=3 4014 B7R0.3 CCC(=O)NCCN MCULE-3992696592 [0,2,0,0,0,0|1,0,0]=3 4015 B7R0.3 CCC(=O)NCCN MCULE-4556462042 [0,2,0,0,0,0|1,0,0]=3 4016 B7R0.3 CCC(=O)NCCO MCULE-7351790148 [0,2,0,0,0,0|0,0,0]=2 4017 B7R0.3 CCC(=O)OCCCl MCULE-7825392065 [0,2,0,0,0,0|1,0,0]=3 4018 B7R0.3 CCC(=O)OCCO MCULE-6019276519 [0,2,0,0,0,0|0,0,0]=2 4019 B7R0.3 CCC(=O)OCOC MCULE-8101176829 [0,2,0,0,0,0|1,0,0]=3 4020 B7R0.3 CCC(C)CCCO MCULE-2323419626 [0,2,0,0,0,0|1,0,1]=4 4021 B7R0.3 CCC(C)NCCO MCULE-1340916666 [0,2,0,0,0,0|1,0,1]=4 4022 B7R0.3 CCC(N)CCCO MCULE-3868205501 [0,2,0,0,0,0|1,0,1]=4 4023 B7R0.3 CCC(N)CCOC MCULE-8279767210 [0,2,0,0,0,0|1,0,1]=4 4024 B7R0.3 CCC(O)CCCO MCULE-1099760826 [0,2,0,0,0,0|0,0,2]=4 4025 B7R0.3 CCC(O)CCOC MCULE-1245099360 [0,2,0,0,0,0|0,0,2]=4 4026 B7R0.3 CCC=CC(=O)OC MCULE-2390679048 [0,2,0,0,0,0|1,0,1]=4 4027 B7R0.3 CCCC=C(C)CC MCULE-4699949699 [0,2,0,0,0,0|2,0,0]=4 4028 B7R0.3 CCCCC(=N)OC MCULE-3917139857 [0,2,0,0,0,0|2,0,0]=4 4029 B7R0.3 CCCCC(=N)OC MCULE-8394549097 [0,2,0,0,0,0|2,0,0]=4 4030 B7R0.3 CCCCC(=NO)C MCULE-8239265636 [0,2,0,0,0,0|1,0,1]=4 4031 B7R0.3 CCCCC(=O)CBr MCULE-5866288227 [0,2,0,0,0,0|1,0,0]=3 4032 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [0,2,0,0,0,0|1,0,0]=3 4033 B7R0.3 CCCCC(=O)CCl MCULE-9673190063 [0,2,0,0,0,0|1,0,0]=3 4034 B7R0.3 CCCCC(=O)NC MCULE-6810865419 [0,2,0,0,0,0|1,0,0]=3 4035 B7R0.3 CCCCC(=O)NN MCULE-9535710488 [0,2,0,0,0,0|2,0,0]=4 4036 B7R0.3 CCCCC(=O)OC MCULE-8635651818 [0,2,0,0,0,0|1,0,0]=3 4037 B7R0.3 CCCC[C@H](C)C=O MCULE-7821873587 [0,2,0,0,0,0|1,0,1]=4 4038 B7R0.3 CCCNC(=O)CBr MCULE-3357000060 [0,2,0,0,0,0|1,0,0]=3 4039 B7R0.3 CCCNC(=O)CCl MCULE-3171078913 [0,2,0,0,0,0|1,0,0]=3 4040 B7R0.3 CCCNC(=O)CN MCULE-2964958967 [0,2,0,0,0,0|1,0,0]=3 4041 B7R0.3 CCCNC(=O)CN MCULE-4880764199 [0,2,0,0,0,0|1,0,0]=3 4042 B7R0.3 CCCNC(=O)NN MCULE-9369722445 [0,2,0,0,0,0|2,0,0]=4 4043 B7R0.3 CCCOC(=O)CBr MCULE-9392658897 [0,2,0,0,0,0|1,0,0]=3 4044 B7R0.3 CCCOC(=O)CC MCULE-2749425161 [0,2,0,0,0,0|1,0,0]=3 4045 B7R0.3 CCCOC(=O)CCl MCULE-4900509903 [0,2,0,0,0,0|1,0,0]=3 4046 B7R0.3 CCCOC(=O)CN MCULE-5016724090 [0,2,0,0,0,0|1,0,0]=3 4047 B7R0.3 CCCOC(=O)CN MCULE-9899563764 [0,2,0,0,0,0|1,0,0]=3 4048 B7R0.3 CCCOC(=O)CS MCULE-7918412380 [0,2,0,0,0,0|1,0,0]=3 4049 B7R0.3 CCCOC(=O)OC MCULE-7254829881 [0,2,0,0,0,0|1,0,0]=3 4050 B7R0.3 CCN(C)CCCO MCULE-9090885474 [0,2,0,0,0,0|2,0,0]=4 4051 B7R0.3 CCNCC(=O)NC MCULE-6292959559 [0,2,0,0,0,0|1,0,0]=3 4052 B7R0.3 CCNCC(=O)OC MCULE-7988488004 [0,2,0,0,0,0|1,0,0]=3 4053 B7R0.3 CCNCC(=O)OC MCULE-9483901468 [0,2,0,0,0,0|1,0,0]=3 4054 B7R0.3 CCO/C=C(/C)\C=O MCULE-3167895853 [0,2,0,0,0,0|1,0,1]=4 4055 B7R0.3 CCO/C=C(\C)/C=O MCULE-5904529641 [0,2,0,0,0,0|1,0,1]=4 4056 B7R0.3 CCOC=C(C)C=O MCULE-8349392891 [0,2,0,0,0,0|1,0,1]=4 4057 B7R0.3 CCOCC(=O)CCl MCULE-3495077500 [0,2,0,0,0,0|1,0,0]=3 4058 B7R0.3 CCOCC(=O)NN MCULE-1157330147 [0,2,0,0,0,0|2,0,0]=4 4059 B7R0.3 CCOCC(=O)NN MCULE-3371253482 [0,2,0,0,0,0|2,0,0]=4 4060 B7R0.3 CCOCC(=O)OC MCULE-5158396979 [0,2,0,0,0,0|1,0,0]=3 4061 B7R0.3 CCONC(=O)CN MCULE-8014418978 [0,2,0,0,0,0|2,0,0]=4 4062 B7R0.3 CCONC(=O)CN MCULE-9229677559 [0,2,0,0,0,0|2,0,0]=4 4063 B7R0.3 CCSCC(=O)NN MCULE-2532030709 [0,2,0,0,0,0|2,0,0]=4 4064 B7R0.3 CCSCC(=O)OC MCULE-2538182357 [0,2,0,0,0,0|1,0,0]=3 4065 B7R0.3 CC[C@H](C)CCCO MCULE-1760153718 [0,2,0,0,0,0|1,0,1]=4 4066 B7R0.3 CC[C@H](C)CCCO MCULE-3488695651 [0,2,0,0,0,0|1,0,1]=4 4067 B7R0.3 CNC(=O)C=CCN MCULE-3646722223 [0,2,0,0,0,0|1,0,1]=4 4068 B7R0.3 CNC(=O)C=CCN MCULE-6988679780 [0,2,0,0,0,0|1,0,1]=4 4069 B7R0.3 CNC(=O)CCCCl MCULE-9460684794 [0,2,0,0,0,0|1,0,0]=3 4070 B7R0.3 CNC(=O)CCCN MCULE-4766031038 [0,2,0,0,0,0|1,0,0]=3 4071 B7R0.3 CNC(=O)CCCN MCULE-8992476653 [0,2,0,0,0,0|1,0,0]=3 4072 B7R0.3 CNC(=O)CCCO MCULE-2592655912 [0,2,0,0,0,0|0,0,0]=2 4073 B7R0.3 CNC(=O)CCOC MCULE-1263122933 [0,2,0,0,0,0|0,0,0]=2 4074 B7R0.3 CNC(=O)CN=N#N MCULE-3027813188 [0,2,0,0,0,0|2,0,0]=4 4075 B7R0.3 CNC(=O)NCCN MCULE-4075769099 [0,2,0,0,0,0|1,0,0]=3 4076 B7R0.3 CNC(=O)NCCN MCULE-9668937902 [0,2,0,0,0,0|1,0,0]=3 4077 B7R0.3 CNC(=O)NCCO MCULE-7936045962 [0,2,0,0,0,0|0,0,0]=2 4078 B7R0.3 CNC(=O)OCCCl MCULE-9946450406 [0,2,0,0,0,0|1,0,0]=3 4079 B7R0.3 CNC(=O)OCCO MCULE-7181085118 [0,2,0,0,0,0|0,0,0]=2 4080 B7R0.3 CNCCC(=O)NC MCULE-1793457920 [0,2,0,0,0,0|1,0,0]=3 4081 B7R0.3 CNCCC(=O)NC MCULE-7089073664 [0,2,0,0,0,0|1,0,0]=3 4082 B7R0.3 CNCCC(=O)OC MCULE-5657949377 [0,2,0,0,0,0|1,0,0]=3 4083 B7R0.3 CNCCC(=O)OC MCULE-9145127599 [0,2,0,0,0,0|1,0,0]=3 4084 B7R0.3 CNOCC(=O)OC MCULE-1491246414 [0,2,0,0,0,0|2,0,0]=4 4085 B7R0.3 CNOCC(=O)OC MCULE-2119135006 [0,2,0,0,0,0|2,0,0]=4 4086 B7R0.3 CO/C=C/C(=O)OC MCULE-8858181328 [0,2,0,0,0,0|0,0,2]=4 4087 B7R0.3 COC(=N)CCCCl MCULE-3704020642 [0,2,0,0,0,0|2,0,0]=4 4088 B7R0.3 COC(=N)CCCCl MCULE-6282500757 [0,2,0,0,0,0|2,0,0]=4 4089 B7R0.3 COC(=O)/C=C/CBr MCULE-5511432414 [0,2,0,0,0,0|1,0,1]=4 4090 B7R0.3 COC(=O)/C=C/CN MCULE-6249542756 [0,2,0,0,0,0|1,0,1]=4 4091 B7R0.3 COC(=O)/C=C/CN MCULE-7014993899 [0,2,0,0,0,0|1,0,1]=4 4092 B7R0.3 COC(=O)/C=C\CBr MCULE-5925439397 [0,2,0,0,0,0|1,0,1]=4 4093 B7R0.3 COC(=O)C#CCN MCULE-5567960811 [0,2,0,0,0,0|1,0,1]=4 4094 B7R0.3 COC(=O)C#CCN MCULE-9518684465 [0,2,0,0,0,0|1,0,1]=4 4095 B7R0.3 COC(=O)C#CCO MCULE-5683806193 [0,2,0,0,0,0|0,0,1]=3 4096 B7R0.3 COC(=O)C=CCBr MCULE-1558782396 [0,2,0,0,0,0|1,0,1]=4 4097 B7R0.3 COC(=O)C=CCN MCULE-4573398613 [0,2,0,0,0,0|1,0,1]=4 4098 B7R0.3 COC(=O)C=CCN MCULE-4807348004 [0,2,0,0,0,0|1,0,1]=4 4099 B7R0.3 COC(=O)C=CCN MCULE-7751483147 [0,2,0,0,0,0|1,0,1]=4 4100 B7R0.3 COC(=O)CCC#N MCULE-3476013569 [0,2,0,0,0,0|1,0,0]=3 4101 B7R0.3 COC(=O)CCC=O MCULE-2572188002 [0,2,0,0,0,0|0,0,1]=3 4102 B7R0.3 COC(=O)CCCBr MCULE-3856139347 [0,2,0,0,0,0|1,0,0]=3 4103 B7R0.3 COC(=O)CCCCl MCULE-9725150748 [0,2,0,0,0,0|1,0,0]=3 4104 B7R0.3 COC(=O)CCCI MCULE-6607823615 [0,2,0,0,0,0|1,0,0]=3 4105 B7R0.3 COC(=O)CCCN MCULE-2399653885 [0,2,0,0,0,0|1,0,0]=3 4106 B7R0.3 COC(=O)CCCN MCULE-7745643244 [0,2,0,0,0,0|1,0,0]=3 4107 B7R0.3 COC(=O)CCCO MCULE-6149839873 [0,2,0,0,0,0|0,0,0]=2 4108 B7R0.3 COC(=O)CCCS MCULE-6897052882 [0,2,0,0,0,0|0,1,0]=3 4109 B7R0.3 COC(=O)CCSC MCULE-8525618169 [0,2,0,0,0,0|0,1,0]=3 4110 B7R0.3 COC(=O)CN=C=O MCULE-4495056254 [0,2,0,0,0,0|0,0,2]=4 4111 B7R0.3 COC(=O)CN=C=S MCULE-6944178765 [0,2,0,0,0,0|0,1,1]=4 4112 B7R0.3 COC(=O)CN=N#N MCULE-8257278223 [0,2,0,0,0,0|2,0,0]=4 4113 B7R0.3 COC(=O)CNC=O MCULE-1485317532 [0,2,0,0,0,0|0,0,2]=4 4114 B7R0.3 COC(=O)NCCN MCULE-4816806580 [0,2,0,0,0,0|1,0,0]=3 4115 B7R0.3 COC(=O)NCCN MCULE-9765640123 [0,2,0,0,0,0|1,0,0]=3 4116 B7R0.3 COC(=O)NCCO MCULE-7141835204 [0,2,0,0,0,0|0,0,0]=2 4117 B7R0.3 COC=CC(=O)OC MCULE-3167643214 [0,2,0,0,0,0|0,0,2]=4 4118 B7R0.3 COCC/C(=N\O)/N MCULE-3175892655 [0,2,0,0,0,0|1,0,1]=4 4119 B7R0.3 COCC/C(=N\O)/N MCULE-8002911611 [0,2,0,0,0,0|1,0,1]=4 4120 B7R0.3 COCCC(=O)CCl MCULE-2918704994 [0,2,0,0,0,0|0,0,0]=2 4121 B7R0.3 COCCC(=O)NN MCULE-6895114863 [0,2,0,0,0,0|1,0,0]=3 4122 B7R0.3 COCCC(=O)OC MCULE-5918489580 [0,2,0,0,0,0|0,0,0]=2 4123 B7R0.3 COCCC(C)CN MCULE-7288397543 [0,2,0,0,0,0|1,0,1]=4 4124 B7R0.3 COCCC(N)CO MCULE-9758817920 [0,2,0,0,0,0|1,0,1]=4 4125 B7R0.3 C[C@@H](CN)CCCO MCULE-2859776250 [0,2,0,0,0,0|1,0,1]=4 4126 B7R0.3 C[C@@H](CN)CCCO MCULE-3245433953 [0,2,0,0,0,0|1,0,1]=4 4127 B7R0.3 C[C@@H](CN)CCCO MCULE-7698870351 [0,2,0,0,0,0|1,0,1]=4 4128 B7R0.3 C[C@@H](CN)CCCO MCULE-9900676606 [0,2,0,0,0,0|1,0,1]=4 4129 B7R0.3 N#CCNC(=O)CCl MCULE-3245517796 [0,2,0,0,0,0|1,0,1]=4 4130 B7R0.3 N#CCNC(=O)CN MCULE-1672566609 [0,2,0,0,0,0|1,0,1]=4 4131 B7R0.3 N#CCNC(=O)CN MCULE-7737504322 [0,2,0,0,0,0|1,0,1]=4 4132 B7R0.3 NCC(=O)NCCF MCULE-1969796129 [0,2,0,0,0,0|1,0,0]=3 4133 B7R0.3 NCC(=O)NCCF MCULE-9924478230 [0,2,0,0,0,0|1,0,0]=3 4134 B7R0.3 NCC(=O)NCCO MCULE-3809178129 [0,2,0,0,0,0|0,0,0]=2 4135 B7R0.3 NCC(=O)NCCO MCULE-7057019123 [0,2,0,0,0,0|0,0,0]=2 4136 B7R0.3 NCC(=O)OCCCl MCULE-7924059164 [0,2,0,0,0,0|1,0,0]=3 4137 B7R0.3 NCC(=O)OCCCl MCULE-9260214783 [0,2,0,0,0,0|1,0,0]=3 4138 B7R0.3 NCCNC(=O)CCl MCULE-6059411085 [0,2,0,0,0,0|1,0,0]=3 4139 B7R0.3 NCCNC(=O)CCl MCULE-7545329795 [0,2,0,0,0,0|1,0,0]=3 4140 B7R0.3 NNC(=O)CCCCl MCULE-9370062145 [0,2,0,0,0,0|2,0,0]=4 4141 B7R0.3 NNC(=O)CCCO MCULE-4131007358 [0,2,0,0,0,0|1,0,0]=3 4142 B7R0.3 NNC(=O)OCCCl MCULE-1796161427 [0,2,0,0,0,0|2,0,0]=4 4143 B7R0.3 NNC(=O)OCCCl MCULE-3977269565 [0,2,0,0,0,0|2,0,0]=4 4144 B7R0.3 NNC(=O)OCCO MCULE-9375766063 [0,2,0,0,0,0|1,0,0]=3 4145 B7R0.3 O=C(CCl)/N=C/NO MCULE-8588086105 [0,2,0,0,0,0|1,0,1]=4 4146 B7R0.3 O=C(CCl)CCCCl MCULE-2362491395 [0,2,0,0,0,0|1,0,0]=3 4147 B7R0.3 O=C(CCl)NCCCl MCULE-2029189763 [0,2,0,0,0,0|1,0,0]=3 4148 B7R0.3 O=C(CCl)NCCO MCULE-2803332455 [0,2,0,0,0,0|0,0,0]=2 4149 B7R0.3 O=C(CCl)OCCCl MCULE-7706105725 [0,2,0,0,0,0|1,0,0]=3 4150 B7R0.3 O=C(CO)NCCO MCULE-8933511918 [0,2,0,0,0,0|0,0,0]=2 4151 B7R0.3 OCCCC(O)CO MCULE-3529953491 [0,2,0,0,0,0|0,0,2]=4 4152 B7R0.5 C#CCC(C)C(=O)O MCULE-4819055703 [0,2,0,0,0,0|2,0,0]=4 4153 B7R0.5 C#CCC(F)C(=O)O MCULE-1070671235 [0,2,0,0,0,0|2,0,0]=4 4154 B7R0.5 C#CCC(N)C(=O)O MCULE-2022398365 [0,2,0,0,0,0|2,0,0]=4 4155 B7R0.5 C#CCC(N)C(=O)O MCULE-2451098139 [0,2,0,0,0,0|2,0,0]=4 4156 B7R0.5 C#CCC(N)C(=O)O MCULE-4330300997 [0,2,0,0,0,0|2,0,0]=4 4157 B7R0.5 C#CCC(N)C(=O)O MCULE-5100293043 [0,2,0,0,0,0|2,0,0]=4 4158 B7R0.5 C#CCC(O)C(=O)O MCULE-4988425198 [0,2,0,0,0,0|2,0,0]=4 4159 B7R0.5 C#CCN(C)C(=O)C MCULE-6473061855 [0,2,0,0,0,0|1,0,1]=4 4160 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-1266511504 [0,2,0,0,0,0|2,0,0]=4 4161 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-2589808316 [0,2,0,0,0,0|2,0,0]=4 4162 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-4703021434 [0,2,0,0,0,0|2,0,0]=4 4163 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-5616417783 [0,2,0,0,0,0|2,0,0]=4 4164 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-1593368546 [0,2,0,0,0,0|2,0,0]=4 4165 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-5683421535 [0,2,0,0,0,0|2,0,0]=4 4166 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-7302855511 [0,2,0,0,0,0|2,0,0]=4 4167 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-9256626051 [0,2,0,0,0,0|2,0,0]=4 4168 B7R0.5 C=C(C)C(=O)NCO MCULE-2758821094 [0,2,0,0,0,0|1,0,0]=3 4169 B7R0.5 C=C(C)C(=O)OCC MCULE-9496497565 [0,2,0,0,0,0|2,0,0]=4 4170 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [0,2,0,0,0,0|1,0,1]=4 4171 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [0,2,0,0,0,0|0,0,1]=3 4172 B7R0.5 C=C(COC)C(=O)O MCULE-8964616960 [0,2,0,0,0,0|1,0,1]=4 4173 B7R0.5 C=CCC(C)C(=O)C MCULE-4395269639 [0,2,0,0,0,0|1,0,0]=3 4174 B7R0.5 C=CCC(C)C(=O)O MCULE-2912410432 [0,2,0,0,0,0|2,0,0]=4 4175 B7R0.5 C=CCC(N)C(=O)O MCULE-1550468430 [0,2,0,0,0,0|2,0,0]=4 4176 B7R0.5 C=CCC(N)C(=O)O MCULE-1783682768 [0,2,0,0,0,0|2,0,0]=4 4177 B7R0.5 C=CCC(N)C(=O)O MCULE-8721864064 [0,2,0,0,0,0|2,0,0]=4 4178 B7R0.5 C=CCC(N)C(=O)O MCULE-9091562338 [0,2,0,0,0,0|2,0,0]=4 4179 B7R0.5 C=CCC(O)C(=O)O MCULE-6418899544 [0,2,0,0,0,0|2,0,0]=4 4180 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-3817126030 [0,2,0,0,0,0|2,0,0]=4 4181 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-5479618260 [0,2,0,0,0,0|2,0,0]=4 4182 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-6719393730 [0,2,0,0,0,0|2,0,0]=4 4183 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-7577627870 [0,2,0,0,0,0|2,0,0]=4 4184 B7R0.5 C=CC[C@@H](O)C(=O)O MCULE-4103471826 [0,2,0,0,0,0|2,0,0]=4 4185 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-2073484196 [0,2,0,0,0,0|2,0,0]=4 4186 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-3267648941 [0,2,0,0,0,0|2,0,0]=4 4187 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-4183531139 [0,2,0,0,0,0|2,0,0]=4 4188 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-8225762047 [0,2,0,0,0,0|2,0,0]=4 4189 B7R0.5 C=CC[C@H](O)C(=O)O MCULE-8230827617 [0,2,0,0,0,0|2,0,0]=4 4190 B7R0.5 CC(=O)C(C)CCBr MCULE-4705039689 [0,2,0,0,0,0|1,0,0]=3 4191 B7R0.5 CC(=O)C(C)CCCl MCULE-2960091698 [0,2,0,0,0,0|1,0,0]=3 4192 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [0,2,0,0,0,0|0,0,0]=2 4193 B7R0.5 CC(=O)C(Cl)CCCl MCULE-4634341484 [0,2,0,0,0,0|1,0,0]=3 4194 B7R0.5 CC(=O)C(Cl)CCO MCULE-1606704903 [0,2,0,0,0,0|0,0,0]=2 4195 B7R0.5 CC(=O)N(C)CCN MCULE-3153405152 [0,2,0,0,0,0|1,0,0]=3 4196 B7R0.5 CC(=O)N(C)CCN MCULE-4043248689 [0,2,0,0,0,0|1,0,0]=3 4197 B7R0.5 CC(=O)N(C)CCO MCULE-4135818139 [0,2,0,0,0,0|0,0,0]=2 4198 B7R0.5 CC(C)C(=O)CC#N MCULE-1573579728 [0,2,0,0,0,0|1,0,1]=4 4199 B7R0.5 CC(C)C(=O)CCN MCULE-1638964690 [0,2,0,0,0,0|1,0,0]=3 4200 B7R0.5 CC(C)C(=O)CCN MCULE-5188027669 [0,2,0,0,0,0|1,0,0]=3 4201 B7R0.5 CC(C)C(=O)NCO MCULE-4279406951 [0,2,0,0,0,0|1,0,0]=3 4202 B7R0.5 CC(C)C(=O)OCBr MCULE-3276711258 [0,2,0,0,0,0|2,0,0]=4 4203 B7R0.5 CC(C)C(=O)OCCl MCULE-2226037128 [0,2,0,0,0,0|2,0,0]=4 4204 B7R0.5 CC(C)C(C)CCO MCULE-9837449555 [0,2,0,0,0,0|1,0,1]=4 4205 B7R0.5 CC(C)C(N)CCO MCULE-4571836019 [0,2,0,0,0,0|1,0,1]=4 4206 B7R0.5 CC(C)C(O)CCO MCULE-8819967893 [0,2,0,0,0,0|0,0,2]=4 4207 B7R0.5 CC(C)N(C)CCO MCULE-5948661117 [0,2,0,0,0,0|1,0,1]=4 4208 B7R0.5 CC(C)[C@H](N)CCO MCULE-5628923252 [0,2,0,0,0,0|1,0,1]=4 4209 B7R0.5 CC(CCCl)C(=O)Cl MCULE-4844969943 [0,2,0,0,0,0|1,0,1]=4 4210 B7R0.5 CC(CCN)C(=O)O MCULE-8098419324 [0,2,0,0,0,0|1,0,1]=4 4211 B7R0.5 CC(CCN)C(=O)O MCULE-8509861009 [0,2,0,0,0,0|1,0,1]=4 4212 B7R0.5 CC(CCN)S(=O)C MCULE-4983155747 [0,2,0,0,0,0|1,0,1]=4 4213 B7R0.5 CC(CCO)C(=O)N MCULE-3037868887 [0,2,0,0,0,0|0,0,1]=3 4214 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [0,2,0,0,0,0|0,0,1]=3 4215 B7R0.5 CC(CCO)C(=O)[O-] MCULE-2278638513 [0,2,0,0,0,0|0,0,1]=3 4216 B7R0.5 CC(CCO)N(C)C MCULE-4175956173 [0,2,0,0,0,0|1,0,1]=4 4217 B7R0.5 CC/C=C(\C)/C(=O)O MCULE-1290613859 [0,2,0,0,0,0|1,0,1]=4 4218 B7R0.5 CCC=C(C)C(=O)O MCULE-5045441145 [0,2,0,0,0,0|1,0,1]=4 4219 B7R0.5 CCCC(=O)C(=O)C MCULE-8267463586 [0,2,0,0,0,0|1,0,0]=3 4220 B7R0.5 CCCC(=O)C(=O)N MCULE-6625605588 [0,2,0,0,0,0|1,0,1]=4 4221 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [0,2,0,0,0,0|1,0,1]=4 4222 B7R0.5 CCCC(=O)C(C)Br MCULE-8743472868 [0,2,0,0,0,0|1,0,0]=3 4223 B7R0.5 CCCC(=O)C(C)C MCULE-7690543374 [0,2,0,0,0,0|1,0,0]=3 4224 B7R0.5 CCCC(=O)N(C)C MCULE-8154537620 [0,2,0,0,0,0|1,0,0]=3 4225 B7R0.5 CCCC(Br)C(=O)C MCULE-2062903416 [0,2,0,0,0,0|1,0,0]=3 4226 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [0,2,0,0,0,0|2,0,0]=4 4227 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [0,2,0,0,0,0|1,0,0]=3 4228 B7R0.5 CCCC(C)C(=O)Cl MCULE-4855016209 [0,2,0,0,0,0|1,0,1]=4 4229 B7R0.5 CCCC(C)C(=O)N MCULE-1948746391 [0,2,0,0,0,0|1,0,1]=4 4230 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [0,2,0,0,0,0|1,0,1]=4 4231 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [0,2,0,0,0,0|2,0,0]=4 4232 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [0,2,0,0,0,0|2,0,0]=4 4233 B7R0.5 CCCC(N)C(=O)N MCULE-5159221123 [0,2,0,0,0,0|2,0,0]=4 4234 B7R0.5 CCCC(N)C(=O)N MCULE-5742773956 [0,2,0,0,0,0|2,0,0]=4 4235 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [0,2,0,0,0,0|2,0,0]=4 4236 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [0,2,0,0,0,0|2,0,0]=4 4237 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [0,2,0,0,0,0|2,0,0]=4 4238 B7R0.5 CCCC(O)C(=O)N MCULE-3143432132 [0,2,0,0,0,0|2,0,0]=4 4239 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [0,2,0,0,0,0|2,0,0]=4 4240 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [0,2,0,0,0,0|2,0,0]=4 4241 B7R0.5 CCCN(C)C(=O)Cl MCULE-2930764127 [0,2,0,0,0,0|2,0,0]=4 4242 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [0,2,0,0,0,0|2,0,0]=4 4243 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [0,2,0,0,0,0|2,0,0]=4 4244 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [0,2,0,0,0,0|2,0,0]=4 4245 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [0,2,0,0,0,0|2,0,0]=4 4246 B7R0.5 CCC[C@H](N)C(=O)N MCULE-2163059771 [0,2,0,0,0,0|2,0,0]=4 4247 B7R0.5 CCC[C@H](N)C(=O)N MCULE-4687172013 [0,2,0,0,0,0|2,0,0]=4 4248 B7R0.5 CCC[C@H](N)C(=O)N MCULE-7482592029 [0,2,0,0,0,0|2,0,0]=4 4249 B7R0.5 CCC[C@H](N)C(=O)N MCULE-9639796243 [0,2,0,0,0,0|2,0,0]=4 4250 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [0,2,0,0,0,0|2,0,0]=4 4251 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [0,2,0,0,0,0|2,0,0]=4 4252 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [0,2,0,0,0,0|2,0,0]=4 4253 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [0,2,0,0,0,0|2,0,0]=4 4254 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [0,2,0,0,0,0|2,0,0]=4 4255 B7R0.5 CCNC(=O)C(C)Br MCULE-4342500989 [0,2,0,0,0,0|2,0,0]=4 4256 B7R0.5 CCNC(=O)C(C)Cl MCULE-2094375104 [0,2,0,0,0,0|2,0,0]=4 4257 B7R0.5 CCNC(=O)C(C)N MCULE-7767946644 [0,2,0,0,0,0|2,0,0]=4 4258 B7R0.5 CCNC(=O)C(C)N MCULE-8324775088 [0,2,0,0,0,0|2,0,0]=4 4259 B7R0.5 CCNC(=O)C(C)N MCULE-9028977052 [0,2,0,0,0,0|2,0,0]=4 4260 B7R0.5 CCNC(=O)N(C)N MCULE-4378383472 [0,2,0,0,0,0|2,0,0]=4 4261 B7R0.5 CCNC(=O)[C@H](C)N MCULE-1043080386 [0,2,0,0,0,0|2,0,0]=4 4262 B7R0.5 CCNC(=O)[C@H](C)O MCULE-9098995292 [0,2,0,0,0,0|2,0,0]=4 4263 B7R0.5 CCNC(C)C(=O)N MCULE-2861818493 [0,2,0,0,0,0|2,0,0]=4 4264 B7R0.5 CCNC(C)C(=O)N MCULE-6110291237 [0,2,0,0,0,0|2,0,0]=4 4265 B7R0.5 CCNC(C)C(=O)O MCULE-5445574810 [0,2,0,0,0,0|2,0,0]=4 4266 B7R0.5 CCNC(C)C(=O)O MCULE-5666785247 [0,2,0,0,0,0|2,0,0]=4 4267 B7R0.5 CCN[C@H](C)C(=O)O MCULE-9676358201 [0,2,0,0,0,0|2,0,0]=4 4268 B7R0.5 CCOC(=O)C(=O)C MCULE-5817261721 [0,2,0,0,0,0|1,0,1]=4 4269 B7R0.5 CCOC(=O)C(Br)Br MCULE-8701615311 [0,2,0,0,0,0|2,0,0]=4 4270 B7R0.5 CCOC(=O)C(C)Br MCULE-3184697988 [0,2,0,0,0,0|2,0,0]=4 4271 B7R0.5 CCOC(=O)C(C)C MCULE-7190269066 [0,2,0,0,0,0|2,0,0]=4 4272 B7R0.5 CCOC(=O)C(C)Cl MCULE-8192833024 [0,2,0,0,0,0|2,0,0]=4 4273 B7R0.5 CCOC(=O)C(C)F MCULE-5743308430 [0,2,0,0,0,0|2,0,0]=4 4274 B7R0.5 CCOC(=O)C(C)I MCULE-5895787216 [0,2,0,0,0,0|2,0,0]=4 4275 B7R0.5 CCOC(=O)C(C)N MCULE-1694144423 [0,2,0,0,0,0|2,0,0]=4 4276 B7R0.5 CCOC(=O)C(C)N MCULE-4073874506 [0,2,0,0,0,0|2,0,0]=4 4277 B7R0.5 CCOC(=O)C(C)N MCULE-4082731166 [0,2,0,0,0,0|2,0,0]=4 4278 B7R0.5 CCOC(=O)C(C)N MCULE-5175870607 [0,2,0,0,0,0|2,0,0]=4 4279 B7R0.5 CCOC(=O)C(C)O MCULE-8057202883 [0,2,0,0,0,0|2,0,0]=4 4280 B7R0.5 CCOC(=O)C(C)O MCULE-9679398205 [0,2,0,0,0,0|2,0,0]=4 4281 B7R0.5 CCOC(=O)C(C)S MCULE-7890942953 [0,2,0,0,0,0|2,0,0]=4 4282 B7R0.5 CCOC(=O)C(Cl)Cl MCULE-3838429635 [0,2,0,0,0,0|2,0,0]=4 4283 B7R0.5 CCOC(=O)C(F)Br MCULE-5661791694 [0,2,0,0,0,0|2,0,0]=4 4284 B7R0.5 CCOC(=O)C(F)Cl MCULE-4260692293 [0,2,0,0,0,0|2,0,0]=4 4285 B7R0.5 CCOC(=O)C(F)F MCULE-6388513707 [0,2,0,0,0,0|2,0,0]=4 4286 B7R0.5 CCOC(=O)C(F)I MCULE-4681224874 [0,2,0,0,0,0|2,0,0]=4 4287 B7R0.5 CCOC(=O)N(C)C MCULE-8344568471 [0,2,0,0,0,0|2,0,0]=4 4288 B7R0.5 CCOC(=O)N(C)N MCULE-3043289486 [0,2,0,0,0,0|2,0,0]=4 4289 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1032359164 [0,2,0,0,0,0|2,0,0]=4 4290 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1087923626 [0,2,0,0,0,0|2,0,0]=4 4291 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-1553164105 [0,2,0,0,0,0|2,0,0]=4 4292 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-2294196196 [0,2,0,0,0,0|2,0,0]=4 4293 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-4613491627 [0,2,0,0,0,0|2,0,0]=4 4294 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-8190900780 [0,2,0,0,0,0|2,0,0]=4 4295 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-3372948910 [0,2,0,0,0,0|2,0,0]=4 4296 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-5795033916 [0,2,0,0,0,0|2,0,0]=4 4297 B7R0.5 CCOC(=O)[C@H](C)F MCULE-3258014155 [0,2,0,0,0,0|2,0,0]=4 4298 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4397919899 [0,2,0,0,0,0|2,0,0]=4 4299 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4404274511 [0,2,0,0,0,0|2,0,0]=4 4300 B7R0.5 CCOC(=O)[C@H](C)N MCULE-7626045082 [0,2,0,0,0,0|2,0,0]=4 4301 B7R0.5 CCOC(=O)[C@H](C)N MCULE-8333235087 [0,2,0,0,0,0|2,0,0]=4 4302 B7R0.5 CCOC(=O)[C@H](C)O MCULE-4333545760 [0,2,0,0,0,0|2,0,0]=4 4303 B7R0.5 CCOC(=O)[C@H](C)O MCULE-8787861948 [0,2,0,0,0,0|2,0,0]=4 4304 B7R0.5 CCOC(C)C(=O)O MCULE-2185795311 [0,2,0,0,0,0|2,0,0]=4 4305 B7R0.5 CCSC(=O)C(C)N MCULE-3205133332 [0,2,0,0,0,0|2,0,0]=4 4306 B7R0.5 CCSC(=O)C(C)N MCULE-4228316337 [0,2,0,0,0,0|2,0,0]=4 4307 B7R0.5 CCSC(=O)[C@H](C)N MCULE-3136283874 [0,2,0,0,0,0|2,0,0]=4 4308 B7R0.5 CCSC(=O)[C@H](C)N MCULE-7218618193 [0,2,0,0,0,0|2,0,0]=4 4309 B7R0.5 CCSC(=O)[C@H](C)N MCULE-8421179745 [0,2,0,0,0,0|2,0,0]=4 4310 B7R0.5 CCSC(=O)[C@H](C)N MCULE-9872171069 [0,2,0,0,0,0|2,0,0]=4 4311 B7R0.5 CCSC(C)C(=O)O MCULE-9817243573 [0,2,0,0,0,0|2,0,0]=4 4312 B7R0.5 CN(C)C(=O)CC#N MCULE-2778522530 [0,2,0,0,0,0|1,0,1]=4 4313 B7R0.5 CN(C)C(=O)CCBr MCULE-5913033830 [0,2,0,0,0,0|1,0,0]=3 4314 B7R0.5 CN(C)C(=O)CCCl MCULE-3291912562 [0,2,0,0,0,0|1,0,0]=3 4315 B7R0.5 CN(C)C(=O)CCN MCULE-1852673058 [0,2,0,0,0,0|1,0,0]=3 4316 B7R0.5 CN(C)C(=O)CCN MCULE-6281328637 [0,2,0,0,0,0|1,0,0]=3 4317 B7R0.5 CN(C)C(=O)CCO MCULE-8849440937 [0,2,0,0,0,0|0,0,0]=2 4318 B7R0.5 CN(C)C(=O)CON MCULE-4400747484 [0,2,0,0,0,0|2,0,0]=4 4319 B7R0.5 CN(C)C(=O)OCCl MCULE-5918090090 [0,2,0,0,0,0|2,0,0]=4 4320 B7R0.5 CNCC(=O)N(C)C MCULE-2332172341 [0,2,0,0,0,0|2,0,0]=4 4321 B7R0.5 CNCC(=O)N(C)C MCULE-6934800093 [0,2,0,0,0,0|2,0,0]=4 4322 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [0,2,0,0,0,0|2,0,0]=4 4323 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [0,2,0,0,0,0|2,0,0]=4 4324 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [0,2,0,0,0,0|2,0,0]=4 4325 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [0,2,0,0,0,0|2,0,0]=4 4326 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [0,2,0,0,0,0|2,0,0]=4 4327 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [0,2,0,0,0,0|2,0,0]=4 4328 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [0,2,0,0,0,0|2,0,0]=4 4329 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [0,2,0,0,0,0|2,0,0]=4 4330 B7R0.5 COCC(=O)C(C)C MCULE-8251961368 [0,2,0,0,0,0|2,0,0]=4 4331 B7R0.5 COCC(=O)N(C)C MCULE-4175778673 [0,2,0,0,0,0|2,0,0]=4 4332 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [0,2,0,0,0,0|1,0,0]=3 4333 B7R0.5 COCC(C)C(=O)C MCULE-5328927786 [0,2,0,0,0,0|0,0,0]=2 4334 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [0,2,0,0,0,0|1,0,0]=3 4335 B7R0.5 COCC(C)C(=S)N MCULE-6392999047 [0,2,0,0,0,0|1,1,0]=4 4336 B7R0.5 COCC(C)C(C)N MCULE-6465669754 [0,2,0,0,0,0|1,0,1]=4 4337 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [0,2,0,0,0,0|1,0,0]=3 4338 B7R0.5 COCC(N)C(=O)N MCULE-2465830538 [0,2,0,0,0,0|1,0,0]=3 4339 B7R0.5 COCC(N)C(=O)N MCULE-6194410780 [0,2,0,0,0,0|1,0,0]=3 4340 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [0,2,0,0,0,0|1,0,0]=3 4341 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [0,2,0,0,0,0|1,0,0]=3 4342 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [0,2,0,0,0,0|1,0,0]=3 4343 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [0,2,0,0,0,0|1,0,0]=3 4344 B7R0.5 COCC(N)C(C)C MCULE-4185259512 [0,2,0,0,0,0|1,0,1]=4 4345 B7R0.5 COCC(N)C(C)C MCULE-6424539237 [0,2,0,0,0,0|1,0,1]=4 4346 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [0,2,0,0,0,0|1,0,0]=3 4347 B7R0.5 COCC(O)C(C)C MCULE-3818851772 [0,2,0,0,0,0|1,0,1]=4 4348 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [0,2,0,0,0,0|1,0,0]=3 4349 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [0,2,0,0,0,0|1,0,0]=3 4350 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [0,2,0,0,0,0|1,0,0]=3 4351 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [0,2,0,0,0,0|1,0,0]=3 4352 B7R0.5 COC[C@@H](N)C(C)C MCULE-2081062888 [0,2,0,0,0,0|1,0,1]=4 4353 B7R0.5 COC[C@@H](N)C(C)C MCULE-3286077946 [0,2,0,0,0,0|1,0,1]=4 4354 B7R0.5 COC[C@@H](N)C(C)C MCULE-3882144478 [0,2,0,0,0,0|1,0,1]=4 4355 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [0,2,0,0,0,0|1,0,0]=3 4356 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [0,2,0,0,0,0|1,0,0]=3 4357 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [0,2,0,0,0,0|1,0,0]=3 4358 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [0,2,0,0,0,0|1,0,0]=3 4359 B7R0.5 COC[C@H](N)C(C)C MCULE-3191900867 [0,2,0,0,0,0|1,0,1]=4 4360 B7R0.5 COC[C@H](N)C(C)C MCULE-3410691563 [0,2,0,0,0,0|1,0,1]=4 4361 B7R0.5 CSCC(C)C(=O)O MCULE-7112130175 [0,2,0,0,0,0|1,1,0]=4 4362 B7R0.5 CSCC(N)C(=O)O MCULE-7668628251 [0,2,0,0,0,0|1,1,0]=4 4363 B7R0.5 CSC[C@H](N)C(=O)O MCULE-1178337776 [0,2,0,0,0,0|1,1,0]=4 4364 B7R0.5 CSC[C@H](N)C(=O)O MCULE-2769761337 [0,2,0,0,0,0|1,1,0]=4 4365 B7R0.5 C[C@@H](CCS)C(=O)O MCULE-2918304262 [0,2,0,0,0,0|0,1,1]=4 4366 B7R0.5 C[Se]CC(N)C(=O)O MCULE-3357465269 [0,2,0,0,0,0|1,1,0]=4 4367 B7R0.5 C[Se]CC(N)C(=O)O MCULE-7671606756 [0,2,0,0,0,0|1,1,0]=4 4368 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-5208306365 [0,2,0,0,0,0|1,1,0]=4 4369 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6734478742 [0,2,0,0,0,0|1,1,0]=4 4370 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6760615750 [0,2,0,0,0,0|1,1,0]=4 4371 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-7512025617 [0,2,0,0,0,0|1,1,0]=4 4372 B7R0.5 N#CCC(=O)C(F)F MCULE-2655907742 [0,2,0,0,0,0|1,0,1]=4 4373 B7R0.5 N#CCC(N)C(=O)O MCULE-4929926467 [0,2,0,0,0,0|2,0,0]=4 4374 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6294926701 [0,2,0,0,0,0|2,0,0]=4 4375 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6432920316 [0,2,0,0,0,0|2,0,0]=4 4376 B7R0.5 NC(=O)C(Br)CCBr MCULE-5008510444 [0,2,0,0,0,0|2,0,0]=4 4377 B7R0.5 NC(CCBr)C(=O)O MCULE-1900559475 [0,2,0,0,0,0|2,0,0]=4 4378 B7R0.5 NC(CCBr)C(=O)O MCULE-7293320576 [0,2,0,0,0,0|2,0,0]=4 4379 B7R0.5 NC(CCF)C(=O)O MCULE-5519595590 [0,2,0,0,0,0|2,0,0]=4 4380 B7R0.5 NC(CCF)C(=O)O MCULE-7293194855 [0,2,0,0,0,0|2,0,0]=4 4381 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [0,2,0,0,0,0|1,0,0]=3 4382 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [0,2,0,0,0,0|1,0,0]=3 4383 B7R0.5 NC(CCO)C(F)F MCULE-1854847569 [0,2,0,0,0,0|1,0,1]=4 4384 B7R0.5 NC(CCS)C(=O)O MCULE-8057550187 [0,2,0,0,0,0|1,1,0]=4 4385 B7R0.5 NC(CCS)C(=O)O MCULE-8117596001 [0,2,0,0,0,0|1,1,0]=4 4386 B7R0.5 NC(CNO)C(=O)O MCULE-2332662988 [0,2,0,0,0,0|1,0,0]=3 4387 B7R0.5 NCCC(F)C(=O)O MCULE-5068755002 [0,2,0,0,0,0|2,0,0]=4 4388 B7R0.5 NCCC(F)C(=O)O MCULE-9196695600 [0,2,0,0,0,0|2,0,0]=4 4389 B7R0.5 NCCC(N)C(=O)O MCULE-1239764966 [0,2,0,0,0,0|2,0,0]=4 4390 B7R0.5 NCCC(N)C(=O)O MCULE-2441123923 [0,2,0,0,0,0|2,0,0]=4 4391 B7R0.5 NCCC(N)C(=O)O MCULE-3966593369 [0,2,0,0,0,0|2,0,0]=4 4392 B7R0.5 NCCC(N)C(=O)O MCULE-4212078130 [0,2,0,0,0,0|2,0,0]=4 4393 B7R0.5 NCCC(N)C(=O)O MCULE-7713366571 [0,2,0,0,0,0|2,0,0]=4 4394 B7R0.5 NCCC(N)C(=O)O MCULE-8402131049 [0,2,0,0,0,0|2,0,0]=4 4395 B7R0.5 NCCC(N)C(=O)O MCULE-9198187552 [0,2,0,0,0,0|2,0,0]=4 4396 B7R0.5 NCCC(O)C(=O)O MCULE-3670080484 [0,2,0,0,0,0|2,0,0]=4 4397 B7R0.5 NCCC(O)C(=O)O MCULE-6540935279 [0,2,0,0,0,0|2,0,0]=4 4398 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-4000770618 [0,2,0,0,0,0|2,0,0]=4 4399 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-5775312784 [0,2,0,0,0,0|2,0,0]=4 4400 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-6259961704 [0,2,0,0,0,0|2,0,0]=4 4401 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-9871958374 [0,2,0,0,0,0|2,0,0]=4 4402 B7R0.5 NCC[C@@H](O)C(=O)O MCULE-9726912888 [0,2,0,0,0,0|2,0,0]=4 4403 B7R0.5 NCC[C@H](N)C(=O)O MCULE-1745978456 [0,2,0,0,0,0|2,0,0]=4 4404 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3856066353 [0,2,0,0,0,0|2,0,0]=4 4405 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3919721317 [0,2,0,0,0,0|2,0,0]=4 4406 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5434373726 [0,2,0,0,0,0|2,0,0]=4 4407 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5992578597 [0,2,0,0,0,0|2,0,0]=4 4408 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6536533546 [0,2,0,0,0,0|2,0,0]=4 4409 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6978035806 [0,2,0,0,0,0|2,0,0]=4 4410 B7R0.5 NCC[C@H](N)C(=O)O MCULE-8762011291 [0,2,0,0,0,0|2,0,0]=4 4411 B7R0.5 NCC[C@H](N)C(=O)O MCULE-9645608127 [0,2,0,0,0,0|2,0,0]=4 4412 B7R0.5 NCC[C@H](O)C(=O)O MCULE-3296998083 [0,2,0,0,0,0|2,0,0]=4 4413 B7R0.5 NCC[C@H](O)C(=O)O MCULE-7901866019 [0,2,0,0,0,0|2,0,0]=4 4414 B7R0.5 NOC[C@H](N)C(=O)O MCULE-1050292176 [0,2,0,0,0,0|1,0,0]=3 4415 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2388269464 [0,2,0,0,0,0|2,0,0]=4 4416 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2456796412 [0,2,0,0,0,0|2,0,0]=4 4417 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-6229782603 [0,2,0,0,0,0|2,0,0]=4 4418 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-8123446168 [0,2,0,0,0,0|2,0,0]=4 4419 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [0,2,0,0,0,0|1,0,0]=3 4420 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [0,2,0,0,0,0|1,0,0]=3 4421 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-4021115723 [0,2,0,0,0,0|1,1,0]=4 4422 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-7661321953 [0,2,0,0,0,0|1,1,0]=4 4423 B7R0.5 N[C@@H](CSS)C(=O)O MCULE-3029500977 [0,2,0,0,0,0|1,1,0]=4 4424 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-1975650690 [0,2,0,0,0,0|2,0,0]=4 4425 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-7245104465 [0,2,0,0,0,0|2,0,0]=4 4426 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [0,2,0,0,0,0|1,0,0]=3 4427 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [0,2,0,0,0,0|1,0,0]=3 4428 B7R0.5 N[C@H](CCS)C(=O)O MCULE-1110046008 [0,2,0,0,0,0|1,1,0]=4 4429 B7R0.5 N[C@H](CCS)C(=O)O MCULE-7556963357 [0,2,0,0,0,0|1,1,0]=4 4430 B7R0.5 O=C(Br)C(Br)CCBr MCULE-1496301616 [0,2,0,0,0,0|2,0,0]=4 4431 B7R0.5 O=C(Cl)C(Br)CCBr MCULE-9787639147 [0,2,0,0,0,0|2,0,0]=4 4432 B7R0.5 O=C(Cl)C(Br)CCCl MCULE-6400872582 [0,2,0,0,0,0|2,0,0]=4 4433 B7R0.5 O=C(O)C(Br)CCBr MCULE-3091819269 [0,2,0,0,0,0|2,0,0]=4 4434 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [0,2,0,0,0,0|1,0,0]=3 4435 B7R0.5 OCCC(=C(F)F)F MCULE-7760707196 [0,2,0,0,0,0|1,0,1]=4 4436 B7R0.5 [C@H](N)(CC#C)C(=O)O MCULE-7308061694 [0,2,0,0,0,0|2,0,0]=4 4437 B7R0.7 C#CCC(=O)OCC MCULE-2012473321 [0,2,0,0,0,0|1,0,1]=4 4438 B7R0.7 C#CCN(C)CCO MCULE-8096383167 [0,2,0,0,0,0|2,0,0]=4 4439 B7R0.7 C/C=C/C(=O)OCC MCULE-8433823264 [0,2,0,0,0,0|2,0,0]=4 4440 B7R0.7 C=C(CCBr)CCBr MCULE-2280580612 [0,2,0,0,0,0|2,0,0]=4 4441 B7R0.7 C=C(CCC)CCO MCULE-1774943854 [0,2,0,0,0,0|1,0,0]=3 4442 B7R0.7 C=CCC(=O)OCC MCULE-2006542536 [0,2,0,0,0,0|1,0,1]=4 4443 B7R0.7 C=CCN(C)CCO MCULE-5364416545 [0,2,0,0,0,0|2,0,0]=4 4444 B7R0.7 C=COC(=O)CCC MCULE-2764567967 [0,2,0,0,0,0|1,0,1]=4 4445 B7R0.7 CC#CC(=O)OCC MCULE-3358315498 [0,2,0,0,0,0|2,0,0]=4 4446 B7R0.7 CC(CCN)CCO MCULE-7864092529 [0,2,0,0,0,0|1,0,1]=4 4447 B7R0.7 CC(CCO)CCO MCULE-5426211201 [0,2,0,0,0,0|0,0,2]=4 4448 B7R0.7 CC=CC(=O)OCC MCULE-1904771513 [0,2,0,0,0,0|2,0,0]=4 4449 B7R0.7 CCCC(=N)OCC MCULE-5551107242 [0,2,0,0,0,0|2,0,0]=4 4450 B7R0.7 CCCC(=N)OCC MCULE-7790310067 [0,2,0,0,0,0|2,0,0]=4 4451 B7R0.7 CCCC(=O)CC#N MCULE-7580308812 [0,2,0,0,0,0|1,0,0]=3 4452 B7R0.7 CCCC(=O)CCC MCULE-1621649928 [0,2,0,0,0,0|1,0,0]=3 4453 B7R0.7 CCCC(=O)OCC MCULE-9977024136 [0,2,0,0,0,0|1,0,0]=3 4454 B7R0.7 CCCC(=O)OCCl MCULE-5186069317 [0,2,0,0,0,0|1,0,0]=3 4455 B7R0.7 CCCC(C)CCO MCULE-6887128167 [0,2,0,0,0,0|1,0,1]=4 4456 B7R0.7 CCCC(C)N=C=O MCULE-9843542105 [0,2,0,0,0,0|1,0,1]=4 4457 B7R0.7 CCCC(N)CCO MCULE-3641094890 [0,2,0,0,0,0|1,0,1]=4 4458 B7R0.7 CCCC(N)CCO MCULE-5323991138 [0,2,0,0,0,0|1,0,1]=4 4459 B7R0.7 CCCC(N)CCO MCULE-6597027417 [0,2,0,0,0,0|1,0,1]=4 4460 B7R0.7 CCCC(N)CCO MCULE-8093709628 [0,2,0,0,0,0|1,0,1]=4 4461 B7R0.7 CCCC(O)CCO MCULE-6957178966 [0,2,0,0,0,0|0,0,2]=4 4462 B7R0.7 CCCC(S)CCO MCULE-7972451905 [0,2,0,0,0,0|0,1,1]=4 4463 B7R0.7 CCC[C@@H](N)CCO MCULE-1862127512 [0,2,0,0,0,0|1,0,1]=4 4464 B7R0.7 CCC[C@@H](N)CCO MCULE-3031366486 [0,2,0,0,0,0|1,0,1]=4 4465 B7R0.7 CCC[C@@H](N)CCO MCULE-4433535200 [0,2,0,0,0,0|1,0,1]=4 4466 B7R0.7 CCC[C@@H](N)CCO MCULE-8325506694 [0,2,0,0,0,0|1,0,1]=4 4467 B7R0.7 CCC[C@H](N)CCO MCULE-3164100995 [0,2,0,0,0,0|1,0,1]=4 4468 B7R0.7 CCC[C@H](N)CCO MCULE-3262978007 [0,2,0,0,0,0|1,0,1]=4 4469 B7R0.7 CCC[C@H](N)CCO MCULE-3382311889 [0,2,0,0,0,0|1,0,1]=4 4470 B7R0.7 CCC[C@H](N)CCO MCULE-4865013919 [0,2,0,0,0,0|1,0,1]=4 4471 B7R0.7 CCNC(=O)CC#N MCULE-4756290560 [0,2,0,0,0,0|1,0,1]=4 4472 B7R0.7 CCNC(=O)CCCl MCULE-3246776319 [0,2,0,0,0,0|1,0,0]=3 4473 B7R0.7 CCNC(=O)CCN MCULE-2856252531 [0,2,0,0,0,0|1,0,0]=3 4474 B7R0.7 CCNC(=O)CCN MCULE-3929666209 [0,2,0,0,0,0|1,0,0]=3 4475 B7R0.7 CCNC(=O)CCO MCULE-3624072697 [0,2,0,0,0,0|0,0,0]=2 4476 B7R0.7 CCNC(=O)CNC MCULE-1939824251 [0,2,0,0,0,0|2,0,0]=4 4477 B7R0.7 CCNC(=O)CNC MCULE-2815515396 [0,2,0,0,0,0|2,0,0]=4 4478 B7R0.7 CCNC(=O)NCC MCULE-2253571388 [0,2,0,0,0,0|2,0,0]=4 4479 B7R0.7 CCNC(=O)OCC MCULE-3910060770 [0,2,0,0,0,0|2,0,0]=4 4480 B7R0.7 CCNC(C)CCO MCULE-5904294074 [0,2,0,0,0,0|1,0,1]=4 4481 B7R0.7 CCOC(=N)CCCl MCULE-3462649487 [0,2,0,0,0,0|2,0,0]=4 4482 B7R0.7 CCOC(=N)CCCl MCULE-7130199135 [0,2,0,0,0,0|2,0,0]=4 4483 B7R0.7 CCOC(=N)CCO MCULE-8135932013 [0,2,0,0,0,0|1,0,0]=3 4484 B7R0.7 CCOC(=N)CCO MCULE-9125708150 [0,2,0,0,0,0|1,0,0]=3 4485 B7R0.7 CCOC(=O)/C=C/O MCULE-1984925411 [0,2,0,0,0,0|0,0,2]=4 4486 B7R0.7 CCOC(=O)C=CO MCULE-2570791221 [0,2,0,0,0,0|0,0,2]=4 4487 B7R0.7 CCOC(=O)C=NO MCULE-8888029932 [0,2,0,0,0,0|1,0,1]=4 4488 B7R0.7 CCOC(=O)CC#N MCULE-3161671261 [0,2,0,0,0,0|1,0,1]=4 4489 B7R0.7 CCOC(=O)CC=O MCULE-5042552247 [0,2,0,0,0,0|0,0,2]=4 4490 B7R0.7 CCOC(=O)CCBr MCULE-1898467026 [0,2,0,0,0,0|1,0,0]=3 4491 B7R0.7 CCOC(=O)CCCl MCULE-2623656770 [0,2,0,0,0,0|1,0,0]=3 4492 B7R0.7 CCOC(=O)CCI MCULE-9651397551 [0,2,0,0,0,0|1,0,0]=3 4493 B7R0.7 CCOC(=O)CCN MCULE-4383008445 [0,2,0,0,0,0|1,0,0]=3 4494 B7R0.7 CCOC(=O)CCN MCULE-6873709061 [0,2,0,0,0,0|1,0,0]=3 4495 B7R0.7 CCOC(=O)CCO MCULE-3972081033 [0,2,0,0,0,0|0,0,0]=2 4496 B7R0.7 CCOC(=O)CCS MCULE-3955367746 [0,2,0,0,0,0|0,1,0]=3 4497 B7R0.7 CCOC(=O)CNC MCULE-3219895330 [0,2,0,0,0,0|2,0,0]=4 4498 B7R0.7 CCOC(=O)CNC MCULE-6164649520 [0,2,0,0,0,0|2,0,0]=4 4499 B7R0.7 CCOC(=O)CNN MCULE-2832319636 [0,2,0,0,0,0|2,0,0]=4 4500 B7R0.7 CCOC(=O)CNN MCULE-3479623348 [0,2,0,0,0,0|2,0,0]=4 4501 B7R0.7 CCOC(=O)CNN MCULE-5066106273 [0,2,0,0,0,0|2,0,0]=4 4502 B7R0.7 CCOC(=O)COC MCULE-7739678079 [0,2,0,0,0,0|2,0,0]=4 4503 B7R0.7 CCOC(=O)CON MCULE-4924818206 [0,2,0,0,0,0|2,0,0]=4 4504 B7R0.7 CCOC(=O)CSC MCULE-5199209389 [0,2,0,0,0,0|2,0,0]=4 4505 B7R0.7 CCOC(=O)NCCl MCULE-9646468987 [0,2,0,0,0,0|2,0,0]=4 4506 B7R0.7 CCOC(=O)NCO MCULE-1265242244 [0,2,0,0,0,0|1,0,0]=3 4507 B7R0.7 CCOC(=O)NNC MCULE-8689837834 [0,2,0,0,0,0|2,0,0]=4 4508 B7R0.7 CCOC(=O)NOC MCULE-2256963329 [0,2,0,0,0,0|2,0,0]=4 4509 B7R0.7 CCOC(=O)OCC MCULE-1394890550 [0,2,0,0,0,0|2,0,0]=4 4510 B7R0.7 CCOC(=O)OCCl MCULE-9723292956 [0,2,0,0,0,0|2,0,0]=4 4511 B7R0.7 CCOC(=O)OCI MCULE-7994621582 [0,2,0,0,0,0|2,0,0]=4 4512 B7R0.7 CCSC(=O)SCC MCULE-7783165279 [0,2,0,0,0,0|2,0,0]=4 4513 B7R0.7 CN(CCN)CCO MCULE-2960427748 [0,2,0,0,0,0|2,0,0]=4 4514 B7R0.7 CN(CCO)CCO MCULE-3967840948 [0,2,0,0,0,0|1,0,1]=4 4515 B7R0.7 CN(CCO)CCO MCULE-6878116085 [0,2,0,0,0,0|1,0,1]=4 4516 B7R0.7 COCC(=O)CC#N MCULE-7023614757 [0,2,0,0,0,0|1,0,1]=4 4517 B7R0.7 COCC(=O)COC MCULE-5119511792 [0,2,0,0,0,0|2,0,0]=4 4518 B7R0.7 COCC(C)CCO MCULE-6812981556 [0,2,0,0,0,0|0,0,2]=4 4519 B7R0.7 COCC(N)CCO MCULE-2569422233 [0,2,0,0,0,0|1,0,1]=4 4520 B7R0.7 CSCC(N)CCO MCULE-2899374338 [0,2,0,0,0,0|1,0,1]=4 4521 B7R0.7 O=C(CCBr)CCBr MCULE-4794296091 [0,2,0,0,0,0|1,0,0]=3 4522 B7R0.7 O=C(CCCl)CCCl MCULE-1408529874 [0,2,0,0,0,0|1,0,0]=3 4523 B7R0.7 O=C(CCO)CCO MCULE-8765223516 [0,2,0,0,0,0|0,0,0]=2 4524 B7R0.7 O=C(NCO)NCO MCULE-8625819432 [0,2,0,0,0,0|1,0,0]=3 4525 B7R0.7 O=S(CCO)CCO MCULE-3068452870 [0,2,0,0,0,0|1,0,0]=3 4526 B7R0.7 OCCC(O)CCO MCULE-1162803524 [0,2,0,0,0,0|0,0,2]=4 4527 B7R0.7 OCNC(=S)NCO MCULE-4551702004 [0,2,0,0,0,0|1,1,0]=4 4528 B7R0.10 C=C(CBr)C(=O)OC MCULE-7991860093 [0,2,0,0,0,0|1,0,1]=4 4529 B7R0.10 C=C(CC)C(=O)OC MCULE-2064145693 [0,2,0,0,0,0|1,0,1]=4 4530 B7R0.10 C=C(CCl)C(=O)OC MCULE-8356509776 [0,2,0,0,0,0|1,0,1]=4 4531 B7R0.10 C=C(CO)C(=O)OC MCULE-8888105984 [0,2,0,0,0,0|0,0,1]=3 4532 B7R0.10 C=CC(Cl)C(=O)OC MCULE-8371197919 [0,2,0,0,0,0|1,0,1]=4 4533 B7R0.10 C=CC(N)C(=O)OC MCULE-6449924585 [0,2,0,0,0,0|1,0,1]=4 4534 B7R0.10 C=CC(N)C(=O)OC MCULE-8138684326 [0,2,0,0,0,0|1,0,1]=4 4535 B7R0.10 C=CC(O)C(=O)OC MCULE-8475572887 [0,2,0,0,0,0|1,0,1]=4 4536 B7R0.10 CC(CN)C(N)CO MCULE-1520376315 [0,2,0,0,0,0|1,0,1]=4 4537 B7R0.10 CC(CN)[C@H](N)CO MCULE-9250442888 [0,2,0,0,0,0|1,0,1]=4 4538 B7R0.10 CCC(=O)C(=NO)C MCULE-5669219787 [0,2,0,0,0,0|1,0,1]=4 4539 B7R0.10 CCC(=O)C(=O)CC MCULE-4346857339 [0,2,0,0,0,0|1,0,1]=4 4540 B7R0.10 CCC(=O)C(=O)OC MCULE-6526576267 [0,2,0,0,0,0|1,0,1]=4 4541 B7R0.10 CCC(=O)C(C)C#N MCULE-5937845036 [0,2,0,0,0,0|1,0,1]=4 4542 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [0,2,0,0,0,0|1,0,0]=3 4543 B7R0.10 CCC(=O)N(C)CC MCULE-1764457516 [0,2,0,0,0,0|2,0,0]=4 4544 B7R0.10 CCC(Br)C(=O)NC MCULE-5335067622 [0,2,0,0,0,0|1,0,0]=3 4545 B7R0.10 CCC(Br)C(=O)OC MCULE-2335527491 [0,2,0,0,0,0|1,0,0]=3 4546 B7R0.10 CCC(C)C(=O)CBr MCULE-7022126762 [0,2,0,0,0,0|1,0,0]=3 4547 B7R0.10 CCC(C)C(=O)CCl MCULE-6800466655 [0,2,0,0,0,0|1,0,0]=3 4548 B7R0.10 CCC(C)C(=O)NC MCULE-5599095900 [0,2,0,0,0,0|1,0,0]=3 4549 B7R0.10 CCC(C)C(=O)NN MCULE-4144584435 [0,2,0,0,0,0|2,0,0]=4 4550 B7R0.10 CCC(C)C(=O)OC MCULE-9845747952 [0,2,0,0,0,0|1,0,0]=3 4551 B7R0.10 CCC(C)C(N)CO MCULE-3990781918 [0,2,0,0,0,0|1,0,1]=4 4552 B7R0.10 CCC(C)C(N)CO MCULE-9261445768 [0,2,0,0,0,0|1,0,1]=4 4553 B7R0.10 CCC(C)C(O)CO MCULE-9999862073 [0,2,0,0,0,0|1,0,1]=4 4554 B7R0.10 CCC(Cl)C(=O)OC MCULE-4773486285 [0,2,0,0,0,0|1,0,0]=3 4555 B7R0.10 CCC(N)C(=O)NC MCULE-7274856339 [0,2,0,0,0,0|1,0,0]=3 4556 B7R0.10 CCC(N)C(=O)NC MCULE-9912780545 [0,2,0,0,0,0|1,0,0]=3 4557 B7R0.10 CCC(N)C(=O)NO MCULE-9162328479 [0,2,0,0,0,0|2,0,0]=4 4558 B7R0.10 CCC(N)C(=O)OC MCULE-1569242271 [0,2,0,0,0,0|1,0,0]=3 4559 B7R0.10 CCC(N)C(=O)OC MCULE-3183954116 [0,2,0,0,0,0|1,0,0]=3 4560 B7R0.10 CCC(N)C(=O)OC MCULE-4045754117 [0,2,0,0,0,0|1,0,0]=3 4561 B7R0.10 CCC(N)C(=O)OC MCULE-5328984047 [0,2,0,0,0,0|1,0,0]=3 4562 B7R0.10 CCC(O)C(=O)OC MCULE-8768500574 [0,2,0,0,0,0|1,0,0]=3 4563 B7R0.10 CCC(O)C(C)CO MCULE-3930931405 [0,2,0,0,0,0|0,0,2]=4 4564 B7R0.10 CCC(O)C(C)CO MCULE-4472852672 [0,2,0,0,0,0|0,0,2]=4 4565 B7R0.10 CCC(S)C(C)CO MCULE-1500370684 [0,2,0,0,0,0|0,1,1]=4 4566 B7R0.10 CCN(C)C(=O)CBr MCULE-4444194334 [0,2,0,0,0,0|2,0,0]=4 4567 B7R0.10 CCN(C)C(=O)CCl MCULE-7762522604 [0,2,0,0,0,0|2,0,0]=4 4568 B7R0.10 CCN(C)C(C)CO MCULE-3647031998 [0,2,0,0,0,0|2,0,0]=4 4569 B7R0.10 CC[C@@H](Br)C(=O)OC MCULE-2676798410 [0,2,0,0,0,0|1,0,0]=3 4570 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-2122638055 [0,2,0,0,0,0|1,0,1]=4 4571 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-7964651759 [0,2,0,0,0,0|1,0,1]=4 4572 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-8482653298 [0,2,0,0,0,0|1,0,1]=4 4573 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6794991435 [0,2,0,0,0,0|1,0,0]=3 4574 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6825672331 [0,2,0,0,0,0|1,0,0]=3 4575 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-7307663817 [0,2,0,0,0,0|1,0,0]=3 4576 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-8717527808 [0,2,0,0,0,0|1,0,0]=3 4577 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-6916010003 [0,2,0,0,0,0|1,0,0]=3 4578 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-9376722018 [0,2,0,0,0,0|1,0,0]=3 4579 B7R0.10 CC[C@H](Br)C(=O)OC MCULE-5490793206 [0,2,0,0,0,0|1,0,0]=3 4580 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-3647332227 [0,2,0,0,0,0|1,0,1]=4 4581 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-5774547825 [0,2,0,0,0,0|1,0,1]=4 4582 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8401203397 [0,2,0,0,0,0|1,0,1]=4 4583 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8452836661 [0,2,0,0,0,0|1,0,1]=4 4584 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-9307589673 [0,2,0,0,0,0|1,0,1]=4 4585 B7R0.10 CC[C@H](N)C(=O)OC MCULE-2336816190 [0,2,0,0,0,0|1,0,0]=3 4586 B7R0.10 CC[C@H](N)C(=O)OC MCULE-3480066740 [0,2,0,0,0,0|1,0,0]=3 4587 B7R0.10 CC[C@H](N)C(=O)OC MCULE-4883083558 [0,2,0,0,0,0|1,0,0]=3 4588 B7R0.10 CC[C@H](N)C(=O)OC MCULE-6241184216 [0,2,0,0,0,0|1,0,0]=3 4589 B7R0.10 CC[C@H](O)C(=O)OC MCULE-5873092635 [0,2,0,0,0,0|1,0,0]=3 4590 B7R0.10 CC[C@H](O)C(=O)OC MCULE-8209874812 [0,2,0,0,0,0|1,0,0]=3 4591 B7R0.10 CNC(=O)/C(=N/O)/N MCULE-4165941405 [0,2,0,0,0,0|1,0,1]=4 4592 B7R0.10 CNC(=O)C(=NO)C MCULE-5419636892 [0,2,0,0,0,0|1,0,1]=4 4593 B7R0.10 CNC(=O)C(C)CN MCULE-6853199259 [0,2,0,0,0,0|1,0,0]=3 4594 B7R0.10 CNC(=O)C(C)CN MCULE-9315732080 [0,2,0,0,0,0|1,0,0]=3 4595 B7R0.10 CNC(=O)C(C)NC MCULE-5788965533 [0,2,0,0,0,0|2,0,0]=4 4596 B7R0.10 CNC(=O)C(N)CO MCULE-1507161216 [0,2,0,0,0,0|0,0,0]=2 4597 B7R0.10 CNC(=O)C(O)CN MCULE-4650373222 [0,2,0,0,0,0|1,0,0]=3 4598 B7R0.10 CNC(=O)C(O)CN MCULE-8978952332 [0,2,0,0,0,0|1,0,0]=3 4599 B7R0.10 CNC(=O)[C@H](C)NC MCULE-4236618966 [0,2,0,0,0,0|2,0,0]=4 4600 B7R0.10 CNC(=O)[C@H](C)NC MCULE-9974564724 [0,2,0,0,0,0|2,0,0]=4 4601 B7R0.10 CNC(C)C(=O)OC MCULE-1524259113 [0,2,0,0,0,0|2,0,0]=4 4602 B7R0.10 CNC(C)C(=O)OC MCULE-2414146201 [0,2,0,0,0,0|2,0,0]=4 4603 B7R0.10 CNC(C)C(=O)OC MCULE-3192973771 [0,2,0,0,0,0|2,0,0]=4 4604 B7R0.10 CNC(C)C(=O)OC MCULE-9929257431 [0,2,0,0,0,0|2,0,0]=4 4605 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-1271745038 [0,2,0,0,0,0|2,0,0]=4 4606 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-3018199319 [0,2,0,0,0,0|2,0,0]=4 4607 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3420184809 [0,2,0,0,0,0|2,0,0]=4 4608 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3818454089 [0,2,0,0,0,0|2,0,0]=4 4609 B7R0.10 CN[C@H](C)C(=O)OC MCULE-8297775033 [0,2,0,0,0,0|2,0,0]=4 4610 B7R0.10 CN[C@H](C)C(=O)OC MCULE-9637759835 [0,2,0,0,0,0|2,0,0]=4 4611 B7R0.10 COC(=O)/C(=N/O)/N MCULE-6279341489 [0,2,0,0,0,0|1,0,1]=4 4612 B7R0.10 COC(=O)C(=O)CBr MCULE-7596502094 [0,2,0,0,0,0|1,0,1]=4 4613 B7R0.10 COC(=O)C(Br)CBr MCULE-7056048789 [0,2,0,0,0,0|1,0,0]=3 4614 B7R0.10 COC(=O)C(Br)CF MCULE-4013908914 [0,2,0,0,0,0|1,0,0]=3 4615 B7R0.10 COC(=O)C(Br)CO MCULE-1678765423 [0,2,0,0,0,0|0,0,0]=2 4616 B7R0.10 COC(=O)C(Br)CO MCULE-8437488397 [0,2,0,0,0,0|0,0,0]=2 4617 B7R0.10 COC(=O)C(Br)OC MCULE-5672396067 [0,2,0,0,0,0|2,0,0]=4 4618 B7R0.10 COC(=O)C(C)C#N MCULE-3764857061 [0,2,0,0,0,0|1,0,1]=4 4619 B7R0.10 COC(=O)C(C)C=O MCULE-8461987901 [0,2,0,0,0,0|0,0,2]=4 4620 B7R0.10 COC(=O)C(C)CBr MCULE-5887558960 [0,2,0,0,0,0|1,0,0]=3 4621 B7R0.10 COC(=O)C(C)CBr MCULE-9291707503 [0,2,0,0,0,0|1,0,0]=3 4622 B7R0.10 COC(=O)C(C)CN MCULE-8139628698 [0,2,0,0,0,0|1,0,0]=3 4623 B7R0.10 COC(=O)C(C)CN MCULE-8839292519 [0,2,0,0,0,0|1,0,0]=3 4624 B7R0.10 COC(=O)C(C)CO MCULE-1168600238 [0,2,0,0,0,0|0,0,0]=2 4625 B7R0.10 COC(=O)C(C)CO MCULE-9207150786 [0,2,0,0,0,0|0,0,0]=2 4626 B7R0.10 COC(=O)C(C)CS MCULE-2870797526 [0,2,0,0,0,0|0,1,0]=3 4627 B7R0.10 COC(=O)C(C)OC MCULE-3274761391 [0,2,0,0,0,0|2,0,0]=4 4628 B7R0.10 COC(=O)C(C)ON MCULE-1829014190 [0,2,0,0,0,0|2,0,0]=4 4629 B7R0.10 COC(=O)C(C)ON MCULE-4104938309 [0,2,0,0,0,0|2,0,0]=4 4630 B7R0.10 COC(=O)C(C)SC MCULE-6914204626 [0,2,0,0,0,0|2,0,0]=4 4631 B7R0.10 COC(=O)C(Cl)C=O MCULE-1767241035 [0,2,0,0,0,0|0,0,2]=4 4632 B7R0.10 COC(=O)C(Cl)CCl MCULE-3086208783 [0,2,0,0,0,0|1,0,0]=3 4633 B7R0.10 COC(=O)C(Cl)CO MCULE-9496750776 [0,2,0,0,0,0|0,0,0]=2 4634 B7R0.10 COC(=O)C(Cl)OC MCULE-8296320773 [0,2,0,0,0,0|2,0,0]=4 4635 B7R0.10 COC(=O)C(F)CN MCULE-3089053107 [0,2,0,0,0,0|1,0,0]=3 4636 B7R0.10 COC(=O)C(F)CN MCULE-5618581260 [0,2,0,0,0,0|1,0,0]=3 4637 B7R0.10 COC(=O)C(F)CO MCULE-2188518229 [0,2,0,0,0,0|0,0,0]=2 4638 B7R0.10 COC(=O)C(N)C#N MCULE-9016686741 [0,2,0,0,0,0|1,0,1]=4 4639 B7R0.10 COC(=O)C(N)CCl MCULE-2253564316 [0,2,0,0,0,0|1,0,0]=3 4640 B7R0.10 COC(=O)C(N)CCl MCULE-3851909822 [0,2,0,0,0,0|1,0,0]=3 4641 B7R0.10 COC(=O)C(N)CCl MCULE-4649966066 [0,2,0,0,0,0|1,0,0]=3 4642 B7R0.10 COC(=O)C(N)CCl MCULE-9193407415 [0,2,0,0,0,0|1,0,0]=3 4643 B7R0.10 COC(=O)C(N)CF MCULE-2617218019 [0,2,0,0,0,0|1,0,0]=3 4644 B7R0.10 COC(=O)C(N)CF MCULE-3926207531 [0,2,0,0,0,0|1,0,0]=3 4645 B7R0.10 COC(=O)C(N)CN MCULE-7949926265 [0,2,0,0,0,0|1,0,0]=3 4646 B7R0.10 COC(=O)C(N)CN MCULE-9215212479 [0,2,0,0,0,0|1,0,0]=3 4647 B7R0.10 COC(=O)C(N)CO MCULE-1874204534 [0,2,0,0,0,0|0,0,0]=2 4648 B7R0.10 COC(=O)C(N)CO MCULE-1907797317 [0,2,0,0,0,0|0,0,0]=2 4649 B7R0.10 COC(=O)C(N)CO MCULE-3851022091 [0,2,0,0,0,0|0,0,0]=2 4650 B7R0.10 COC(=O)C(N)CO MCULE-9875856930 [0,2,0,0,0,0|0,0,0]=2 4651 B7R0.10 COC(=O)C(N)CS MCULE-5131519605 [0,2,0,0,0,0|0,1,0]=3 4652 B7R0.10 COC(=O)C(N)CS MCULE-5561205392 [0,2,0,0,0,0|0,1,0]=3 4653 B7R0.10 COC(=O)C(N)CS MCULE-9291008448 [0,2,0,0,0,0|0,1,0]=3 4654 B7R0.10 COC(=O)C(N)CS MCULE-9963292576 [0,2,0,0,0,0|0,1,0]=3 4655 B7R0.10 COC(=O)C(O)C#N MCULE-2296440580 [0,2,0,0,0,0|1,0,1]=4 4656 B7R0.10 COC(=O)C(O)CCl MCULE-1480405341 [0,2,0,0,0,0|1,0,0]=3 4657 B7R0.10 COC(=O)C(O)CN MCULE-1003241246 [0,2,0,0,0,0|1,0,0]=3 4658 B7R0.10 COC(=O)C(O)CN MCULE-9006804473 [0,2,0,0,0,0|1,0,0]=3 4659 B7R0.10 COC(=O)C(O)CO MCULE-1234820163 [0,2,0,0,0,0|0,0,0]=2 4660 B7R0.10 COC(=O)C(O)CO MCULE-2142801284 [0,2,0,0,0,0|0,0,0]=2 4661 B7R0.10 COC(=O)C(O)OC MCULE-5465190164 [0,2,0,0,0,0|2,0,0]=4 4662 B7R0.10 COC(=O)N(C)CCl MCULE-8717315487 [0,2,0,0,0,0|2,0,0]=4 4663 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8075978888 [0,2,0,0,0,0|0,0,0]=2 4664 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8903256620 [0,2,0,0,0,0|0,0,0]=2 4665 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-5530851181 [0,2,0,0,0,0|1,0,0]=3 4666 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-8885621324 [0,2,0,0,0,0|1,0,0]=3 4667 B7R0.10 COC(=O)[C@@H](C)CN MCULE-7205157481 [0,2,0,0,0,0|1,0,0]=3 4668 B7R0.10 COC(=O)[C@@H](C)CN MCULE-9885299909 [0,2,0,0,0,0|1,0,0]=3 4669 B7R0.10 COC(=O)[C@@H](C)CO MCULE-6738074317 [0,2,0,0,0,0|0,0,0]=2 4670 B7R0.10 COC(=O)[C@@H](C)CO MCULE-9697255968 [0,2,0,0,0,0|0,0,0]=2 4671 B7R0.10 COC(=O)[C@@H](F)CN MCULE-2209395189 [0,2,0,0,0,0|1,0,0]=3 4672 B7R0.10 COC(=O)[C@@H](F)CN MCULE-2951378763 [0,2,0,0,0,0|1,0,0]=3 4673 B7R0.10 COC(=O)[C@@H](F)CN MCULE-4599856185 [0,2,0,0,0,0|1,0,0]=3 4674 B7R0.10 COC(=O)[C@@H](F)CN MCULE-5571914049 [0,2,0,0,0,0|1,0,0]=3 4675 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-1649684135 [0,2,0,0,0,0|1,0,0]=3 4676 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-4803192908 [0,2,0,0,0,0|1,0,0]=3 4677 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-6514033613 [0,2,0,0,0,0|1,0,0]=3 4678 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-7997387565 [0,2,0,0,0,0|1,0,0]=3 4679 B7R0.10 COC(=O)[C@@H](N)CN MCULE-4407014418 [0,2,0,0,0,0|1,0,0]=3 4680 B7R0.10 COC(=O)[C@@H](N)CN MCULE-4854066134 [0,2,0,0,0,0|1,0,0]=3 4681 B7R0.10 COC(=O)[C@@H](N)CN MCULE-5060962890 [0,2,0,0,0,0|1,0,0]=3 4682 B7R0.10 COC(=O)[C@@H](N)CN MCULE-8572432694 [0,2,0,0,0,0|1,0,0]=3 4683 B7R0.10 COC(=O)[C@@H](N)CO MCULE-2171593224 [0,2,0,0,0,0|0,0,0]=2 4684 B7R0.10 COC(=O)[C@@H](N)CO MCULE-3393088985 [0,2,0,0,0,0|0,0,0]=2 4685 B7R0.10 COC(=O)[C@@H](N)CO MCULE-5476910845 [0,2,0,0,0,0|0,0,0]=2 4686 B7R0.10 COC(=O)[C@@H](N)CO MCULE-9984439264 [0,2,0,0,0,0|0,0,0]=2 4687 B7R0.10 COC(=O)[C@@H](N)CS MCULE-2560943261 [0,2,0,0,0,0|0,1,0]=3 4688 B7R0.10 COC(=O)[C@@H](N)CS MCULE-3682774490 [0,2,0,0,0,0|0,1,0]=3 4689 B7R0.10 COC(=O)[C@@H](N)CS MCULE-6613123984 [0,2,0,0,0,0|0,1,0]=3 4690 B7R0.10 COC(=O)[C@@H](N)CS MCULE-7354291938 [0,2,0,0,0,0|0,1,0]=3 4691 B7R0.10 COC(=O)[C@@H](O)CN MCULE-1265508864 [0,2,0,0,0,0|1,0,0]=3 4692 B7R0.10 COC(=O)[C@@H](O)CN MCULE-2334791448 [0,2,0,0,0,0|1,0,0]=3 4693 B7R0.10 COC(=O)[C@@H](O)CN MCULE-6207278824 [0,2,0,0,0,0|1,0,0]=3 4694 B7R0.10 COC(=O)[C@@H](O)CN MCULE-6634004594 [0,2,0,0,0,0|1,0,0]=3 4695 B7R0.10 COC(=O)[C@@H](O)CO MCULE-3655137528 [0,2,0,0,0,0|0,0,0]=2 4696 B7R0.10 COC(=O)[C@@H](O)CO MCULE-5801355812 [0,2,0,0,0,0|0,0,0]=2 4697 B7R0.10 COC(=O)[C@H](Br)CO MCULE-8230787734 [0,2,0,0,0,0|0,0,0]=2 4698 B7R0.10 COC(=O)[C@H](C)C=O MCULE-9841785503 [0,2,0,0,0,0|0,0,2]=4 4699 B7R0.10 COC(=O)[C@H](C)CBr MCULE-3829202918 [0,2,0,0,0,0|1,0,0]=3 4700 B7R0.10 COC(=O)[C@H](C)CBr MCULE-4931737781 [0,2,0,0,0,0|1,0,0]=3 4701 B7R0.10 COC(=O)[C@H](C)CN MCULE-4694019206 [0,2,0,0,0,0|1,0,0]=3 4702 B7R0.10 COC(=O)[C@H](C)CN MCULE-9113866081 [0,2,0,0,0,0|1,0,0]=3 4703 B7R0.10 COC(=O)[C@H](C)CO MCULE-5719676432 [0,2,0,0,0,0|0,0,0]=2 4704 B7R0.10 COC(=O)[C@H](C)CO MCULE-8479546806 [0,2,0,0,0,0|0,0,0]=2 4705 B7R0.10 COC(=O)[C@H](C)OC MCULE-3095326114 [0,2,0,0,0,0|2,0,0]=4 4706 B7R0.10 COC(=O)[C@H](N)CCl MCULE-1199425954 [0,2,0,0,0,0|1,0,0]=3 4707 B7R0.10 COC(=O)[C@H](N)CCl MCULE-2611523756 [0,2,0,0,0,0|1,0,0]=3 4708 B7R0.10 COC(=O)[C@H](N)CCl MCULE-6503487325 [0,2,0,0,0,0|1,0,0]=3 4709 B7R0.10 COC(=O)[C@H](N)CCl MCULE-8714444412 [0,2,0,0,0,0|1,0,0]=3 4710 B7R0.10 COC(=O)[C@H](N)CO MCULE-4463451892 [0,2,0,0,0,0|0,0,0]=2 4711 B7R0.10 COC(=O)[C@H](N)CO MCULE-5622938569 [0,2,0,0,0,0|0,0,0]=2 4712 B7R0.10 COC(=O)[C@H](N)CO MCULE-6021580541 [0,2,0,0,0,0|0,0,0]=2 4713 B7R0.10 COC(=O)[C@H](N)CO MCULE-8237708167 [0,2,0,0,0,0|0,0,0]=2 4714 B7R0.10 COC(=O)[C@H](N)CS MCULE-1845308816 [0,2,0,0,0,0|0,1,0]=3 4715 B7R0.10 COC(=O)[C@H](N)CS MCULE-3480554390 [0,2,0,0,0,0|0,1,0]=3 4716 B7R0.10 COC(=O)[C@H](N)CS MCULE-4432617084 [0,2,0,0,0,0|0,1,0]=3 4717 B7R0.10 COC(=O)[C@H](N)CS MCULE-5747217193 [0,2,0,0,0,0|0,1,0]=3 4718 B7R0.10 COC(=O)[C@H](O)CN MCULE-5902729244 [0,2,0,0,0,0|1,0,0]=3 4719 B7R0.10 COC(=O)[C@H](O)CN MCULE-9252373981 [0,2,0,0,0,0|1,0,0]=3 4720 B7R0.10 COC(=O)[C@H](O)CO MCULE-4219956218 [0,2,0,0,0,0|0,0,0]=2 4721 B7R0.10 COC(=O)[C@H](O)CO MCULE-8891571940 [0,2,0,0,0,0|0,0,0]=2 4722 B7R0.10 NC(CCl)C(=O)NO MCULE-8256545065 [0,2,0,0,0,0|2,0,0]=4 4723 B7R0.10 NNC(=O)C(N)CO MCULE-3324075598 [0,2,0,0,0,0|1,0,0]=3 4724 B7R0.10 NNC(=O)C(N)CO MCULE-6651241883 [0,2,0,0,0,0|1,0,0]=3 4725 B7R0.10 NNC(=O)[C@@H](N)CS MCULE-9375468264 [0,2,0,0,0,0|1,1,0]=4 4726 B7R0.10 N[C@@H](CO)[C@@H](N)CO MCULE-2394488011 [0,2,0,0,0,0|1,0,1]=4 4727 B7R0.10 O=C(CBr)C(=O)CBr MCULE-2533799421 [0,2,0,0,0,0|1,0,1]=4 4728 B7R0.10 O=C(CO)C(O)CO MCULE-9818197491 [0,2,0,0,0,0|0,0,0]=2 4729 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8306776225 [0,2,0,0,0,0|0,0,0]=2 4730 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8666498937 [0,2,0,0,0,0|0,0,0]=2 4731 B7R0.10 O=C(CO)[C@H](O)CO MCULE-7828531161 [0,2,0,0,0,0|0,0,0]=2 4732 B7R0.10 O=CC(O)C(O)CO MCULE-9564469242 [0,2,0,0,0,0|1,0,1]=4 4733 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-3532911413 [0,2,0,0,0,0|1,0,1]=4 4734 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-5707669784 [0,2,0,0,0,0|1,0,1]=4 4735 B7R0.10 O=C[C@@H](O)[C@H](O)CO MCULE-4902023669 [0,2,0,0,0,0|1,0,1]=4 4736 B7R0.10 O=C[C@H](O)[C@@H](O)CO MCULE-5975565699 [0,2,0,0,0,0|1,0,1]=4 4737 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-3036594515 [0,2,0,0,0,0|1,0,1]=4 4738 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-5412566780 [0,2,0,0,0,0|1,0,1]=4 4739 B7R0.10 OC/C(=C(\Br)/CO)/Br MCULE-4124313752 [0,2,0,0,0,0|1,0,1]=4 4740 B7R0.10 OC/C(=C(\I)/CO)/I MCULE-1498396594 [0,2,0,0,0,0|1,0,1]=4 4741 B7R0.10 OCC(=C(Br)CO)Br MCULE-5802887340 [0,2,0,0,0,0|1,0,1]=4 4742 B7R0.10 OCC(=C(F)CBr)F MCULE-8689735335 [0,2,0,0,0,0|1,0,1]=4 4743 B7R0.10 OCC(=C(I)CO)I MCULE-4534512400 [0,2,0,0,0,0|1,0,1]=4 4744 B7R0.10 OCC(Br)C(Br)CO MCULE-4593943249 [0,2,0,0,0,0|1,0,1]=4 4745 B7R0.10 OCC(O)C(O)CO MCULE-9009953851 [0,2,0,0,0,0|0,0,2]=4 4746 B7R0.10 OC[C@@H](Br)[C@H](Br)CO MCULE-7293448690 [0,2,0,0,0,0|1,0,1]=4 4747 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-1593828237 [0,2,0,0,0,0|0,0,2]=4 4748 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-7577661973 [0,2,0,0,0,0|0,0,2]=4 4749 B7R0.10 OC[C@@H](O)[C@H](S)CS MCULE-1423721945 [0,2,0,0,0,0|0,1,1]=4 4750 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-7306394407 [0,2,0,0,0,0|0,0,2]=4 4751 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-8013265935 [0,2,0,0,0,0|0,0,2]=4 4752 B7R0.10 OC[C@H](O)[C@H](O)CO MCULE-6886999157 [0,2,0,0,0,0|0,0,2]=4 4753 B7R0.10 [C@@H](C)(CC)[C@@H](N)CO MCULE-4423825378 [0,2,0,0,0,0|1,0,1]=4 4754 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-1799930850 [0,2,0,0,0,0|2,0,0]=4 4755 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-5931188957 [0,2,0,0,0,0|2,0,0]=4 4756 B7R0.11 C=CC(C)(C)CCO MCULE-8304657692 [0,2,0,0,0,0|1,0,1]=4 4757 B7R0.11 C=CS(=O)(=O)CCO MCULE-3885863033 [0,2,0,0,0,0|1,0,1]=4 4758 B7R0.11 CC(C)(C#N)CCO MCULE-3558208026 [0,2,0,0,0,0|1,0,1]=4 4759 B7R0.11 CC(C)(CCO)NN MCULE-1046472199 [0,2,0,0,0,0|1,0,1]=4 4760 B7R0.11 CC(C)(CCO)NN MCULE-7858562799 [0,2,0,0,0,0|1,0,1]=4 4761 B7R0.11 CC(C)(CN)CCO MCULE-8453542373 [0,2,0,0,0,0|1,0,1]=4 4762 B7R0.11 CC(C)(CO)CCO MCULE-1756560398 [0,2,0,0,0,0|0,0,2]=4 4763 B7R0.11 CC(O)(CO)CCO MCULE-4148316300 [0,2,0,0,0,0|0,0,2]=4 4764 B7R0.11 CCC(C)(C)CCO MCULE-5248034600 [0,2,0,0,0,0|1,0,1]=4 4765 B7R0.11 CCC(C)(N)CCO MCULE-7673513204 [0,2,0,0,0,0|1,0,1]=4 4766 B7R0.11 CCC(C)(O)CCO MCULE-6173398477 [0,2,0,0,0,0|0,0,2]=4 4767 B7R0.11 CCCC(C)(C)C=O MCULE-1675435662 [0,2,0,0,0,0|1,0,1]=4 4768 B7R0.11 CCS(=O)(=O)CCBr MCULE-3576808746 [0,2,0,0,0,0|2,0,0]=4 4769 B7R0.11 CCS(=O)(=O)CCCl MCULE-4470053655 [0,2,0,0,0,0|2,0,0]=4 4770 B7R0.11 CCS(=O)(=O)CCN MCULE-6944259667 [0,2,0,0,0,0|2,0,0]=4 4771 B7R0.11 CCS(=O)(=O)CCN MCULE-8804123313 [0,2,0,0,0,0|2,0,0]=4 4772 B7R0.11 CCS(=O)(=O)CCO MCULE-1810929722 [0,2,0,0,0,0|1,0,0]=3 4773 B7R0.11 CN=S(=O)(C)CCN MCULE-5404036517 [0,2,0,0,0,0|2,0,0]=4 4774 B7R0.11 CN=S(=O)(C)CCN MCULE-5743557868 [0,2,0,0,0,0|2,0,0]=4 4775 B7R0.11 CNC(C)(C)CCO MCULE-4689746373 [0,2,0,0,0,0|1,0,1]=4 4776 B7R0.11 CNS(=O)(=O)CCBr MCULE-5061010018 [0,2,0,0,0,0|2,0,0]=4 4777 B7R0.11 CNS(=O)(=O)CCN MCULE-1982465814 [0,2,0,0,0,0|2,0,0]=4 4778 B7R0.11 CNS(=O)(=O)CCN MCULE-4756669449 [0,2,0,0,0,0|2,0,0]=4 4779 B7R0.11 COC(C)(C)CCO MCULE-4448949329 [0,2,0,0,0,0|0,0,2]=4 4780 B7R0.11 C[N+](C)(CF)CCO MCULE-7470515657 [0,2,0,0,0,0|2,0,0]=4 4781 B7R0.11 C[N+](C)(CF)CCO MCULE-8037348431 [0,2,0,0,0,0|2,0,0]=4 4782 B7R0.11 C[N+](C)(CI)CCO MCULE-1028701878 [0,2,0,0,0,0|2,0,0]=4 4783 B7R0.11 C[N+](C)(CI)CCO MCULE-6877151655 [0,2,0,0,0,0|2,0,0]=4 4784 B7R0.11 OCCC(F)(F)CO MCULE-9524877710 [0,2,0,0,0,0|1,0,1]=4 4785 B7R0.12 CCC(CC)CCO MCULE-1684491793 [0,2,0,0,0,0|1,0,1]=4 4786 B7R0.12 CCC(CN)CCO MCULE-4612619767 [0,2,0,0,0,0|1,0,1]=4 4787 B7R0.12 CCN(CC)CCO MCULE-6638681325 [0,2,0,0,0,0|2,0,0]=4 4788 B7R0.12 CCN(CC)CCO MCULE-8115329454 [0,2,0,0,0,0|2,0,0]=4 4789 B7R0.12 CCN(CCO)N=O MCULE-3100234015 [0,2,0,0,0,0|1,0,0]=3 4790 B7R0.12 OCC=C(CCl)CCl MCULE-4216885258 [0,2,0,0,0,0|1,0,1]=4 4791 B7R0.12 OCCC(CO)CO MCULE-7198799967 [0,2,0,0,0,0|0,0,2]=4 4792 B7R0.9 C=C(C)CC(C)(C)C MCULE-2888894392 [0,2,0,0,0,0|2,0,0]=4 4793 B7R0.9 C=C(C)CS(=O)(=O)O MCULE-9682032193 [0,2,0,0,0,0|2,0,0]=4 4794 B7R0.9 CC(=O)CC(C)(C)C MCULE-5477546626 [0,2,0,0,0,0|1,0,0]=3 4795 B7R0.9 CC(=O)CC(C)(C)Cl MCULE-5981575591 [0,2,0,0,0,0|1,0,0]=3 4796 B7R0.9 CC(=O)CC(C)(C)N MCULE-1511988439 [0,2,0,0,0,0|1,0,0]=3 4797 B7R0.9 CC(=O)CC(C)(C)N MCULE-7807079460 [0,2,0,0,0,0|1,0,0]=3 4798 B7R0.9 CC(=O)CC(C)(C)N MCULE-8677016157 [0,2,0,0,0,0|1,0,0]=3 4799 B7R0.9 CC(=O)CC(C)(C)O MCULE-2623560163 [0,2,0,0,0,0|0,0,0]=2 4800 B7R0.9 CC(=O)CC(C)(C)S MCULE-8901285593 [0,2,0,0,0,0|0,1,0]=3 4801 B7R0.9 CC(=O)CC(F)(F)F MCULE-6552958941 [0,2,0,0,0,0|1,0,0]=3 4802 B7R0.9 CC(=O)CS(=O)(=O)C MCULE-5686426572 [0,2,0,0,0,0|1,0,1]=4 4803 B7R0.9 CC(=O)CS(=O)(=O)F MCULE-1649143366 [0,2,0,0,0,0|1,0,1]=4 4804 B7R0.9 CC(=O)CS(=O)(=O)N MCULE-1632563820 [0,2,0,0,0,0|1,0,1]=4 4805 B7R0.9 CC(=O)NC(C)(C)C MCULE-7590749185 [0,2,0,0,0,0|2,0,0]=4 4806 B7R0.9 CC(=O)OC(C)(C)C MCULE-4713236745 [0,2,0,0,0,0|2,0,0]=4 4807 B7R0.9 CC(=O)OP(=O)(O)O MCULE-3093243474 [0,2,0,0,0,0|2,0,0]=4 4808 B7R0.9 CC(=O)SC(C)(C)C MCULE-7111846167 [0,2,0,0,0,0|2,0,0]=4 4809 B7R0.9 CC(C)(Br)CC(=O)O MCULE-2452885576 [0,2,0,0,0,0|2,0,0]=4 4810 B7R0.9 CC(C)(C)CC(=O)Cl MCULE-6018997465 [0,2,0,0,0,0|2,0,0]=4 4811 B7R0.9 CC(C)(C)CC(=O)N MCULE-5884141657 [0,2,0,0,0,0|2,0,0]=4 4812 B7R0.9 CC(C)(C)CC(=O)O MCULE-8746589287 [0,2,0,0,0,0|2,0,0]=4 4813 B7R0.9 CC(C)(N)CC(=O)N MCULE-8203649114 [0,2,0,0,0,0|2,0,0]=4 4814 B7R0.9 CC(C)(N)CC(=O)N MCULE-9031143786 [0,2,0,0,0,0|2,0,0]=4 4815 B7R0.9 CC(C)(N)CC(=O)O MCULE-1798345695 [0,2,0,0,0,0|2,0,0]=4 4816 B7R0.9 CC(C)(N)CC(=O)O MCULE-4385513857 [0,2,0,0,0,0|2,0,0]=4 4817 B7R0.9 CC(C)(N)CC(=O)O MCULE-7160776320 [0,2,0,0,0,0|2,0,0]=4 4818 B7R0.9 CC(C)(O)CC(=O)O MCULE-3649642958 [0,2,0,0,0,0|1,0,0]=3 4819 B7R0.9 CC(C)(O)CN(=O)=O MCULE-5099028458 [0,2,0,0,0,0|2,0,0]=4 4820 B7R0.9 CC(C)(S)CC(=O)O MCULE-6501202267 [0,2,0,0,0,0|1,1,0]=4 4821 B7R0.9 CC(C)CC(C)(C)O MCULE-3204875128 [0,2,0,0,0,0|1,0,1]=4 4822 B7R0.9 CC(F)(F)CC(=O)O MCULE-2075069695 [0,2,0,0,0,0|2,0,0]=4 4823 B7R0.9 CC(N)CC(C)(C)O MCULE-6122866768 [0,2,0,0,0,0|1,0,1]=4 4824 B7R0.9 CC(N)CC(C)(C)O MCULE-6808889940 [0,2,0,0,0,0|1,0,1]=4 4825 B7R0.9 CC(N)CS(=O)(=O)C MCULE-8822552419 [0,2,0,0,0,0|2,0,0]=4 4826 B7R0.9 CC(N)CS(=O)(=O)C MCULE-9216622378 [0,2,0,0,0,0|2,0,0]=4 4827 B7R0.9 CC(O)CC(C)(C)C MCULE-3536219229 [0,2,0,0,0,0|1,0,1]=4 4828 B7R0.9 CC(O)CC(C)(C)N MCULE-2860111904 [0,2,0,0,0,0|1,0,1]=4 4829 B7R0.9 CC(O)CC(C)(C)O MCULE-5281049691 [0,2,0,0,0,0|0,0,2]=4 4830 B7R0.9 CC(O)CC(C)(C)O MCULE-8163963858 [0,2,0,0,0,0|0,0,2]=4 4831 B7R0.9 CC(O)CS(=O)(=O)C MCULE-9821477194 [0,2,0,0,0,0|1,0,0]=3 4832 B7R0.9 CC(O)C[N+](C)(C)C MCULE-1986992067 [0,2,0,0,0,0|2,0,0]=4 4833 B7R0.9 CC(O)C[N+](C)(C)C MCULE-5969734680 [0,2,0,0,0,0|2,0,0]=4 4834 B7R0.9 CC(O)C[N+](C)(C)C MCULE-8120725010 [0,2,0,0,0,0|2,0,0]=4 4835 B7R0.9 CN(C)CC(C)(C)O MCULE-1150912998 [0,2,0,0,0,0|2,0,0]=4 4836 B7R0.9 CS(=O)(=O)CC(=O)O MCULE-1982886035 [0,2,0,0,0,0|1,0,1]=4 4837 B7R0.9 C[C@@H](N)CS(=O)(=O)C MCULE-6974339925 [0,2,0,0,0,0|2,0,0]=4 4838 B7R0.9 C[C@@H](N)CS(=O)(=O)C MCULE-8870434495 [0,2,0,0,0,0|2,0,0]=4 4839 B7R0.9 C[C@@H](O)CC(C)(C)O MCULE-5779966658 [0,2,0,0,0,0|0,0,2]=4 4840 B7R0.9 C[C@H](N)CS(=O)(=O)C MCULE-6266741758 [0,2,0,0,0,0|2,0,0]=4 4841 B7R0.9 C[C@H](N)CS(=O)(=O)C MCULE-9558997808 [0,2,0,0,0,0|2,0,0]=4 4842 B7R0.9 C[C@H](O)CC(C)(C)O MCULE-6903579241 [0,2,0,0,0,0|0,0,2]=4 4843 B7R0.9 NC(=O)CC(F)(F)F MCULE-5914894419 [0,2,0,0,0,0|2,0,0]=4 4844 B7R0.9 O=C(Cl)CC(F)(F)F MCULE-1648565999 [0,2,0,0,0,0|2,0,0]=4 4845 B7R0.9 O=C(O)CC(F)(F)F MCULE-5328586639 [0,2,0,0,0,0|2,0,0]=4 4846 B7R0.9 O=C(O)CP(=O)(O)O MCULE-7055994360 [0,2,0,0,0,0|2,0,0]=4 4847 B7R0.9 O=C(O)CS(=O)(=O)O MCULE-4846153382 [0,2,0,0,0,0|2,0,0]=4 4848 B7R0.16 C=C(C)C(C)C(=O)C MCULE-2480790812 [0,2,0,0,0,0|1,0,1]=4 4849 B7R0.16 C=C(C)C(N)C(=O)O MCULE-1815568719 [0,2,0,0,0,0|1,0,1]=4 4850 B7R0.16 C=C(C)C(N)C(=O)O MCULE-2839869274 [0,2,0,0,0,0|1,0,1]=4 4851 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5015326828 [0,2,0,0,0,0|1,0,1]=4 4852 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5043630144 [0,2,0,0,0,0|1,0,1]=4 4853 B7R0.16 C=C(C)[C@@H](N)C(=C)O MCULE-5278584348 [0,2,0,0,0,0|1,0,1]=4 4854 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-2007035571 [0,2,0,0,0,0|1,0,1]=4 4855 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-6240689602 [0,2,0,0,0,0|1,0,1]=4 4856 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-8025014656 [0,2,0,0,0,0|1,0,1]=4 4857 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-9704891439 [0,2,0,0,0,0|1,0,1]=4 4858 B7R0.16 CC(=O)C(=O)C(C)Br MCULE-8153095418 [0,2,0,0,0,0|1,0,1]=4 4859 B7R0.16 CC(=O)C(Br)C(=O)C MCULE-2980550700 [0,2,0,0,0,0|0,0,2]=4 4860 B7R0.16 CC(=O)C(Br)C(C)C MCULE-2864707278 [0,2,0,0,0,0|1,0,0]=3 4861 B7R0.16 CC(=O)C(C)C(=O)C MCULE-9607259412 [0,2,0,0,0,0|0,0,2]=4 4862 B7R0.16 CC(=O)C(Cl)C(=O)C MCULE-4716617423 [0,2,0,0,0,0|0,0,2]=4 4863 B7R0.16 CC(=O)C(Cl)C(C)C MCULE-2825069638 [0,2,0,0,0,0|1,0,0]=3 4864 B7R0.16 CC(=O)C(F)C(=O)C MCULE-4665621902 [0,2,0,0,0,0|0,0,2]=4 4865 B7R0.16 CC(=O)C(N)C(=O)C MCULE-6440496769 [0,2,0,0,0,0|0,0,2]=4 4866 B7R0.16 CC(=O)C(N)C(=O)C MCULE-8525737264 [0,2,0,0,0,0|0,0,2]=4 4867 B7R0.16 CC(Br)C(Br)C(=O)O MCULE-8605068480 [0,2,0,0,0,0|2,0,0]=4 4868 B7R0.16 CC(Br)C(O)C(=O)O MCULE-8231714451 [0,2,0,0,0,0|2,0,0]=4 4869 B7R0.16 CC(C(=O)O)C(=O)O MCULE-7232226851 [0,2,0,0,0,0|1,0,1]=4 4870 B7R0.16 CC(C)C(Br)C(=O)Br MCULE-7135511419 [0,2,0,0,0,0|2,0,0]=4 4871 B7R0.16 CC(C)C(Br)C(=O)Cl MCULE-7468132927 [0,2,0,0,0,0|2,0,0]=4 4872 B7R0.16 CC(C)C(Br)C(=O)N MCULE-8059032804 [0,2,0,0,0,0|2,0,0]=4 4873 B7R0.16 CC(C)C(Br)C(=O)O MCULE-7284929535 [0,2,0,0,0,0|2,0,0]=4 4874 B7R0.16 CC(C)C(Br)C(=O)O MCULE-8100016953 [0,2,0,0,0,0|2,0,0]=4 4875 B7R0.16 CC(C)C(C)C(=O)Cl MCULE-4466867108 [0,2,0,0,0,0|2,0,0]=4 4876 B7R0.16 CC(C)C(C)C(=O)O MCULE-4998524686 [0,2,0,0,0,0|2,0,0]=4 4877 B7R0.16 CC(C)C(Cl)C(=O)Cl MCULE-8764699774 [0,2,0,0,0,0|2,0,0]=4 4878 B7R0.16 CC(C)C(Cl)C(=O)O MCULE-8634615546 [0,2,0,0,0,0|2,0,0]=4 4879 B7R0.16 CC(C)C(F)C(=O)O MCULE-5644342535 [0,2,0,0,0,0|2,0,0]=4 4880 B7R0.16 CC(C)C(N)C(=O)N MCULE-5793065876 [0,2,0,0,0,0|2,0,0]=4 4881 B7R0.16 CC(C)C(N)C(=O)N MCULE-6836215171 [0,2,0,0,0,0|2,0,0]=4 4882 B7R0.16 CC(C)C(N)C(=O)O MCULE-8140660263 [0,2,0,0,0,0|2,0,0]=4 4883 B7R0.16 CC(C)C(N)C(=O)O MCULE-9199801639 [0,2,0,0,0,0|2,0,0]=4 4884 B7R0.16 CC(C)C(O)C(=O)O MCULE-6517225229 [0,2,0,0,0,0|2,0,0]=4 4885 B7R0.16 CC(C)C(O)C(=O)O MCULE-7748605101 [0,2,0,0,0,0|2,0,0]=4 4886 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-2705531785 [0,2,0,0,0,0|2,0,0]=4 4887 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-7570119486 [0,2,0,0,0,0|2,0,0]=4 4888 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2330575489 [0,2,0,0,0,0|2,0,0]=4 4889 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2653474443 [0,2,0,0,0,0|2,0,0]=4 4890 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-3449326352 [0,2,0,0,0,0|2,0,0]=4 4891 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-7409435805 [0,2,0,0,0,0|2,0,0]=4 4892 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-1338052740 [0,2,0,0,0,0|2,0,0]=4 4893 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-2459930572 [0,2,0,0,0,0|2,0,0]=4 4894 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-7719048521 [0,2,0,0,0,0|2,0,0]=4 4895 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-9864796653 [0,2,0,0,0,0|2,0,0]=4 4896 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-4863317096 [0,2,0,0,0,0|2,0,0]=4 4897 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-8695526864 [0,2,0,0,0,0|2,0,0]=4 4898 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-4413397700 [0,2,0,0,0,0|2,0,0]=4 4899 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-6269612306 [0,2,0,0,0,0|2,0,0]=4 4900 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8084934210 [0,2,0,0,0,0|2,0,0]=4 4901 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8307595659 [0,2,0,0,0,0|2,0,0]=4 4902 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-1415573194 [0,2,0,0,0,0|2,0,0]=4 4903 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-2742126302 [0,2,0,0,0,0|2,0,0]=4 4904 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-3124084676 [0,2,0,0,0,0|2,0,0]=4 4905 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-4854272542 [0,2,0,0,0,0|2,0,0]=4 4906 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-7430998836 [0,2,0,0,0,0|2,0,0]=4 4907 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-9899853579 [0,2,0,0,0,0|2,0,0]=4 4908 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-2507309072 [0,2,0,0,0,0|2,0,0]=4 4909 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-9143825935 [0,2,0,0,0,0|2,0,0]=4 4910 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-1975771806 [0,2,0,0,0,0|2,0,0]=4 4911 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-4070611738 [0,2,0,0,0,0|2,0,0]=4 4912 B7R0.16 CC(F)C(N)C(=O)O MCULE-8810968604 [0,2,0,0,0,0|2,0,0]=4 4913 B7R0.16 CC(N)C(C)C(=O)O MCULE-2921617741 [0,2,0,0,0,0|2,0,0]=4 4914 B7R0.16 CC(N)C(C)C(=O)O MCULE-8511267926 [0,2,0,0,0,0|2,0,0]=4 4915 B7R0.16 CC(N)C(O)C(=O)O MCULE-1086139043 [0,2,0,0,0,0|2,0,0]=4 4916 B7R0.16 CC(N)C(O)C(=O)O MCULE-6405300346 [0,2,0,0,0,0|2,0,0]=4 4917 B7R0.16 CC(O)C(C)C(=O)O MCULE-2499360516 [0,2,0,0,0,0|1,0,0]=3 4918 B7R0.16 CC(O)C(C)N(=O)=O MCULE-8190257217 [0,2,0,0,0,0|2,0,0]=4 4919 B7R0.16 CC(O)C(N)C(=O)N MCULE-1234785834 [0,2,0,0,0,0|1,0,0]=3 4920 B7R0.16 CC(O)C(N)C(=O)N MCULE-5867306342 [0,2,0,0,0,0|1,0,0]=3 4921 B7R0.16 CC(O)C(N)C(=O)O MCULE-1563595722 [0,2,0,0,0,0|1,0,0]=3 4922 B7R0.16 CC(O)C(N)C(=O)O MCULE-5581920538 [0,2,0,0,0,0|1,0,0]=3 4923 B7R0.16 C[C@@H](N)[C@@H](N)C(=O)O MCULE-5302456851 [0,2,0,0,0,0|2,0,0]=4 4924 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-1663687439 [0,2,0,0,0,0|1,0,0]=3 4925 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-3863591433 [0,2,0,0,0,0|1,0,0]=3 4926 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-8080019797 [0,2,0,0,0,0|1,0,0]=3 4927 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-9284411012 [0,2,0,0,0,0|1,0,0]=3 4928 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-1969228933 [0,2,0,0,0,0|1,0,0]=3 4929 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-3285041526 [0,2,0,0,0,0|1,0,0]=3 4930 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-5018319528 [0,2,0,0,0,0|1,0,0]=3 4931 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-6080625355 [0,2,0,0,0,0|1,0,0]=3 4932 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9393787536 [0,2,0,0,0,0|1,0,0]=3 4933 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9925689829 [0,2,0,0,0,0|1,0,0]=3 4934 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2430667007 [0,2,0,0,0,0|1,0,0]=3 4935 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2676185993 [0,2,0,0,0,0|1,0,0]=3 4936 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5254477364 [0,2,0,0,0,0|1,0,0]=3 4937 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5505393195 [0,2,0,0,0,0|1,0,0]=3 4938 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-7379719940 [0,2,0,0,0,0|1,0,0]=3 4939 B7R0.16 C[C@@H](O)[C@H](O)C(=O)O MCULE-9383777855 [0,2,0,0,0,0|1,0,0]=3 4940 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2245171795 [0,2,0,0,0,0|2,0,0]=4 4941 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2727261050 [0,2,0,0,0,0|2,0,0]=4 4942 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O MCULE-8875933839 [0,2,0,0,0,0|1,0,0]=3 4943 B7R0.16 C[C@H](N)[C@@H](N)C(=O)O MCULE-9507122128 [0,2,0,0,0,0|2,0,0]=4 4944 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-2574349608 [0,2,0,0,0,0|2,0,0]=4 4945 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-6297204649 [0,2,0,0,0,0|2,0,0]=4 4946 B7R0.16 C[C@H](N)[C@H](N)C(=O)O MCULE-3178389621 [0,2,0,0,0,0|2,0,0]=4 4947 B7R0.16 C[C@H](O)C(N)C(=O)O MCULE-6661175670 [0,2,0,0,0,0|1,0,0]=3 4948 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-6288272506 [0,2,0,0,0,0|1,0,0]=3 4949 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-7203096302 [0,2,0,0,0,0|1,0,0]=3 4950 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-9531951265 [0,2,0,0,0,0|1,0,0]=3 4951 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-2246314901 [0,2,0,0,0,0|1,0,0]=3 4952 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-9478987169 [0,2,0,0,0,0|1,0,0]=3 4953 B7R0.16 NC(C(=O)O)C(=O)O MCULE-6118746267 [0,2,0,0,0,0|1,0,1]=4 4954 B7R0.16 O=C(O)C(Cl)C(=O)O MCULE-9776364495 [0,2,0,0,0,0|1,0,1]=4 4955 B7R0.16 O=C(O)C(F)C(=O)O MCULE-9969055570 [0,2,0,0,0,0|1,0,1]=4 4956 B7R0.16 O=C(O)C(O)C(=O)O MCULE-4232935518 [0,2,0,0,0,0|1,0,1]=4 4957 B7R0.16 O=C(O)C(O)C(F)F MCULE-6750020534 [0,2,0,0,0,0|2,0,0]=4 4958 B7R0.13 CC(=O)C(C)(C)C#N MCULE-1850672063 [0,2,0,0,0,0|1,0,1]=4 4959 B7R0.13 CC(=O)C(C)(C)CO MCULE-7885820738 [0,2,0,0,0,0|0,0,0]=2 4960 B7R0.13 CC(=O)C(F)(F)CBr MCULE-6144124710 [0,2,0,0,0,0|1,0,0]=3 4961 B7R0.13 CC(Br)(CBr)C(=O)O MCULE-1859698457 [0,2,0,0,0,0|2,0,0]=4 4962 B7R0.13 CC(Br)(CO)N(=O)=O MCULE-7018173037 [0,2,0,0,0,0|2,0,0]=4 4963 B7R0.13 CC(C)(CBr)C(=O)Cl MCULE-2173837084 [0,2,0,0,0,0|2,0,0]=4 4964 B7R0.13 CC(C)(CBr)C(=O)F MCULE-3596602192 [0,2,0,0,0,0|2,0,0]=4 4965 B7R0.13 CC(C)(CBr)C(=O)N MCULE-5685972374 [0,2,0,0,0,0|2,0,0]=4 4966 B7R0.13 CC(C)(CBr)C(=O)O MCULE-2715950010 [0,2,0,0,0,0|2,0,0]=4 4967 B7R0.13 CC(C)(CCl)C(=O)O MCULE-2346120215 [0,2,0,0,0,0|2,0,0]=4 4968 B7R0.13 CC(C)(CF)C(=O)O MCULE-5866229087 [0,2,0,0,0,0|2,0,0]=4 4969 B7R0.13 CC(C)(CN)C(=O)N MCULE-6885361465 [0,2,0,0,0,0|2,0,0]=4 4970 B7R0.13 CC(C)(CN)C(=O)O MCULE-1750685187 [0,2,0,0,0,0|2,0,0]=4 4971 B7R0.13 CC(C)(CN)C(=O)O MCULE-7138204669 [0,2,0,0,0,0|2,0,0]=4 4972 B7R0.13 CC(C)(CO)C(=O)O MCULE-8700273400 [0,2,0,0,0,0|1,0,0]=3 4973 B7R0.13 CC(C)(CO)N(=O)=O MCULE-6787663159 [0,2,0,0,0,0|2,0,0]=4 4974 B7R0.13 CC(C)C(C)(C)CO MCULE-1206498909 [0,2,0,0,0,0|1,0,1]=4 4975 B7R0.13 CC(C)C(C)(O)CO MCULE-7640109698 [0,2,0,0,0,0|1,0,1]=4 4976 B7R0.13 CC(Cl)(CCl)C(=O)O MCULE-9297172670 [0,2,0,0,0,0|2,0,0]=4 4977 B7R0.13 CC(N)(CO)C(=O)O MCULE-5973815630 [0,2,0,0,0,0|1,0,0]=3 4978 B7R0.13 CC(N)(CO)C(=O)O MCULE-6877149014 [0,2,0,0,0,0|1,0,0]=3 4979 B7R0.13 CC(N)(CS)C(=O)O MCULE-4669241619 [0,2,0,0,0,0|1,1,0]=4 4980 B7R0.13 CC(N)(CS)C(=O)O MCULE-8539612367 [0,2,0,0,0,0|1,1,0]=4 4981 B7R0.13 CC(O)(CBr)C(=O)O MCULE-4224343890 [0,2,0,0,0,0|2,0,0]=4 4982 B7R0.13 CC(O)(CBr)C(=O)O MCULE-5597565903 [0,2,0,0,0,0|2,0,0]=4 4983 B7R0.13 CC(O)(CO)C(=O)O MCULE-5566145169 [0,2,0,0,0,0|1,0,0]=3 4984 B7R0.13 CC(O)C(C)(C)CO MCULE-1064066796 [0,2,0,0,0,0|0,0,2]=4 4985 B7R0.13 CCC(C)(Br)C(=O)Br MCULE-8711399189 [0,2,0,0,0,0|2,0,0]=4 4986 B7R0.13 CCC(C)(Br)C(=O)O MCULE-2564629085 [0,2,0,0,0,0|2,0,0]=4 4987 B7R0.13 CCC(C)(C)C(=O)C MCULE-3647111938 [0,2,0,0,0,0|1,0,0]=3 4988 B7R0.13 CCC(C)(C)C(=O)Cl MCULE-7950206740 [0,2,0,0,0,0|2,0,0]=4 4989 B7R0.13 CCC(C)(C)C(=O)O MCULE-2539552186 [0,2,0,0,0,0|2,0,0]=4 4990 B7R0.13 CCC(C)(N)C(=O)N MCULE-6399521661 [0,2,0,0,0,0|2,0,0]=4 4991 B7R0.13 CCC(C)(N)C(=O)O MCULE-4944905519 [0,2,0,0,0,0|2,0,0]=4 4992 B7R0.13 CCC(C)(N)C(=O)O MCULE-8684474701 [0,2,0,0,0,0|2,0,0]=4 4993 B7R0.13 CCC(C)(N)C(=O)O MCULE-9925925283 [0,2,0,0,0,0|2,0,0]=4 4994 B7R0.13 CCC(C)(O)C(=O)C MCULE-5532598723 [0,2,0,0,0,0|1,0,0]=3 4995 B7R0.13 CCC(C)(O)C(=O)Cl MCULE-2893490565 [0,2,0,0,0,0|2,0,0]=4 4996 B7R0.13 CCC(C)(O)C(=O)N MCULE-7082405574 [0,2,0,0,0,0|2,0,0]=4 4997 B7R0.13 CCC(C)(O)C(=O)O MCULE-1193062860 [0,2,0,0,0,0|2,0,0]=4 4998 B7R0.13 CCC(F)(Br)C(=O)O MCULE-8280947459 [0,2,0,0,0,0|2,0,0]=4 4999 B7R0.13 CCC(F)(F)C(=O)O MCULE-3712601150 [0,2,0,0,0,0|2,0,0]=4 5000 B7R0.13 CCC(F)(F)C(=O)[O-] MCULE-3572838764 [0,2,0,0,0,0|2,0,0]=4 5001 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-4076270773 [0,2,0,0,0,0|2,0,0]=4 5002 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-4696366287 [0,2,0,0,0,0|2,0,0]=4 5003 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-7243626223 [0,2,0,0,0,0|2,0,0]=4 5004 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-8928070809 [0,2,0,0,0,0|2,0,0]=4 5005 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-1912860688 [0,2,0,0,0,0|2,0,0]=4 5006 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-3601494140 [0,2,0,0,0,0|2,0,0]=4 5007 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-4886902354 [0,2,0,0,0,0|2,0,0]=4 5008 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-8271138085 [0,2,0,0,0,0|2,0,0]=4 5009 B7R0.13 CC[C@](C)(O)C(=O)O MCULE-3871181536 [0,2,0,0,0,0|2,0,0]=4 5010 B7R0.13 CN(C)C(C)(C)CO MCULE-8067899319 [0,2,0,0,0,0|2,0,0]=4 5011 B7R0.13 COC(C)(C)C(=O)C MCULE-2989232242 [0,2,0,0,0,0|2,0,0]=4 5012 B7R0.13 C[C@@](N)(CO)C(=O)O MCULE-2146963065 [0,2,0,0,0,0|1,0,0]=3 5013 B7R0.13 C[C@@](N)(CO)C(=O)O MCULE-7622447669 [0,2,0,0,0,0|1,0,0]=3 5014 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-2627761655 [0,2,0,0,0,0|1,1,0]=4 5015 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-2887268414 [0,2,0,0,0,0|1,1,0]=4 5016 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-6190318443 [0,2,0,0,0,0|1,1,0]=4 5017 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-8033021501 [0,2,0,0,0,0|1,1,0]=4 5018 B7R0.13 C[C@@](O)(CBr)C(=O)O MCULE-2382162129 [0,2,0,0,0,0|2,0,0]=4 5019 B7R0.13 C[C@@](O)(CBr)C(=O)O MCULE-7944927738 [0,2,0,0,0,0|2,0,0]=4 5020 B7R0.13 C[C@](N)(CO)C(=O)O MCULE-2760852916 [0,2,0,0,0,0|1,0,0]=3 5021 B7R0.13 C[C@](N)(CO)C(=O)O MCULE-4734633152 [0,2,0,0,0,0|1,0,0]=3 5022 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-1527310768 [0,2,0,0,0,0|1,1,0]=4 5023 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-4351926054 [0,2,0,0,0,0|1,1,0]=4 5024 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-6261566257 [0,2,0,0,0,0|1,1,0]=4 5025 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-9035242130 [0,2,0,0,0,0|1,1,0]=4 5026 B7R0.13 C[C@](O)(CBr)C(=O)O MCULE-1143505996 [0,2,0,0,0,0|2,0,0]=4 5027 B7R0.13 C[C@](O)(CBr)C(=O)O MCULE-7898456152 [0,2,0,0,0,0|2,0,0]=4 5028 B7R0.13 NCC(F)(F)C(=O)N MCULE-1522301920 [0,2,0,0,0,0|2,0,0]=4 5029 B7R0.13 NCC(F)(F)C(=O)N MCULE-2239490291 [0,2,0,0,0,0|2,0,0]=4 5030 B7R0.13 NCC(F)(F)C(=O)O MCULE-3688560337 [0,2,0,0,0,0|2,0,0]=4 5031 B7R0.13 NCC(F)(F)C(=O)O MCULE-9077054646 [0,2,0,0,0,0|2,0,0]=4 5032 B7R0.13 O=C(Cl)C(F)(Cl)CCl MCULE-8770305626 [0,2,0,0,0,0|2,0,0]=4 5033 B7R0.13 O=C(O)C(Cl)(Cl)CCl MCULE-4394770604 [0,2,0,0,0,0|2,0,0]=4 5034 B7R0.13 O=C(O)C(F)(F)CO MCULE-4913704401 [0,2,0,0,0,0|1,0,0]=3 5035 B7R0.13 O=N(=O)C(Br)(Br)CO MCULE-5004074369 [0,2,0,0,0,0|2,0,0]=4 5036 B7R0.14 CC(C)(C)C(N)CO MCULE-7753244981 [0,2,0,0,0,0|1,0,1]=4 5037 B7R0.14 CC(C)(C)C(N)CO MCULE-8719256669 [0,2,0,0,0,0|1,0,1]=4 5038 B7R0.14 CC(C)(C)C(O)CO MCULE-2952507658 [0,2,0,0,0,0|1,0,1]=4 5039 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-3982110596 [0,2,0,0,0,0|1,0,1]=4 5040 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-5537283120 [0,2,0,0,0,0|1,0,1]=4 5041 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-9278147798 [0,2,0,0,0,0|1,0,1]=4 5042 B7R0.14 CC(C)(C)[C@H](N)CO MCULE-2023958874 [0,2,0,0,0,0|1,0,1]=4 5043 B7R0.14 CC(C)(C)[C@H](N)CO MCULE-6480065609 [0,2,0,0,0,0|1,0,1]=4 5044 B7R0.14 CC(CN)S(=O)(=O)C MCULE-1204117800 [0,2,0,0,0,0|2,0,0]=4 5045 B7R0.14 CC(CN)S(=O)(=O)C MCULE-9235747472 [0,2,0,0,0,0|2,0,0]=4 5046 B7R0.14 CC(CO)C(C)(C)C MCULE-7343676375 [0,2,0,0,0,0|1,0,1]=4 5047 B7R0.14 CC(CO)C(C)(C)O MCULE-8073024148 [0,2,0,0,0,0|0,0,2]=4 5048 B7R0.14 CC(CO)C(C)(F)F MCULE-3224311448 [0,2,0,0,0,0|1,0,1]=4 5049 B7R0.14 CCC(C)S(=N)(=O)C MCULE-7078981450 [0,2,0,0,0,0|2,0,0]=4 5050 B7R0.14 C[C@@H](CO)C(C)(C)O MCULE-1478332547 [0,2,0,0,0,0|0,0,2]=4 5051 B7R0.14 C[C@@H](CO)C(C)(C)O MCULE-2286439441 [0,2,0,0,0,0|0,0,2]=4 5052 B7R0.14 [NH3+]C(CO)C(C)(C)C MCULE-6310162573 [0,2,0,0,0,0|1,0,1]=4 5053 B7R0.15 C=C(C)C(CC)CC MCULE-2424136176 [0,2,0,0,0,0|2,0,0]=4 5054 B7R0.15 CC(=O)C(=NO)C#N MCULE-7581545205 [0,2,0,0,0,0|1,0,1]=4 5055 B7R0.15 CC(=O)C(C#N)C#N MCULE-7244981854 [0,2,0,0,0,0|1,0,1]=4 5056 B7R0.15 CC(=O)C(CO)CO MCULE-6408384667 [0,2,0,0,0,0|0,0,0]=2 5057 B7R0.15 CC(C)C(CN)CO MCULE-2517509906 [0,2,0,0,0,0|1,0,1]=4 5058 B7R0.15 CC(C)C(CO)CO MCULE-8569465631 [0,2,0,0,0,0|1,0,1]=4 5059 B7R0.15 CC(C)C(CO)ON MCULE-7037439016 [0,2,0,0,0,0|1,0,1]=4 5060 B7R0.15 CC(C)C(CO)ON MCULE-9325437885 [0,2,0,0,0,0|1,0,1]=4 5061 B7R0.15 CC(O)C(CO)CO MCULE-9986430379 [0,2,0,0,0,0|0,0,2]=4 5062 B7R0.15 CCC(C#N)C(=O)O MCULE-4808497444 [0,2,0,0,0,0|2,0,0]=4 5063 B7R0.15 CCC(CC)C(=O)C MCULE-5291760485 [0,2,0,0,0,0|1,0,0]=3 5064 B7R0.15 CCC(CC)C(=O)Cl MCULE-1027070009 [0,2,0,0,0,0|2,0,0]=4 5065 B7R0.15 CCC(CC)C(=O)N MCULE-7337294425 [0,2,0,0,0,0|2,0,0]=4 5066 B7R0.15 CCC(CC)C(=O)O MCULE-5236890306 [0,2,0,0,0,0|2,0,0]=4 5067 B7R0.15 CCC(CN)C(=O)O MCULE-3795207054 [0,2,0,0,0,0|2,0,0]=4 5068 B7R0.15 CCC(CN)C(=O)O MCULE-3929048283 [0,2,0,0,0,0|2,0,0]=4 5069 B7R0.15 CCC(CO)C(=O)O MCULE-9435802738 [0,2,0,0,0,0|1,0,0]=3 5070 B7R0.15 CCC(CO)C(=O)[O-] MCULE-4277685135 [0,2,0,0,0,0|1,0,0]=3 5071 B7R0.15 CCC(CO)C(C)C MCULE-5089280337 [0,2,0,0,0,0|1,0,1]=4 5072 B7R0.15 CCC(CO)N(C)C MCULE-2812328375 [0,2,0,0,0,0|2,0,0]=4 5073 B7R0.15 CCC(NC)C(=O)N MCULE-1925914686 [0,2,0,0,0,0|2,0,0]=4 5074 B7R0.15 CCC(NC)C(=O)N MCULE-3283265693 [0,2,0,0,0,0|2,0,0]=4 5075 B7R0.15 CCC(NC)C(=O)O MCULE-4101988968 [0,2,0,0,0,0|2,0,0]=4 5076 B7R0.15 CCC(NC)C(=O)O MCULE-4491873969 [0,2,0,0,0,0|2,0,0]=4 5077 B7R0.15 CCC(NN)C(=O)O MCULE-8823684595 [0,2,0,0,0,0|2,0,0]=4 5078 B7R0.15 CCC(NO)C(=O)O MCULE-1962461048 [0,2,0,0,0,0|2,0,0]=4 5079 B7R0.15 CCC(OC)C(=O)N MCULE-4022181907 [0,2,0,0,0,0|2,0,0]=4 5080 B7R0.15 CCC(OC)C(=O)O MCULE-2475290794 [0,2,0,0,0,0|2,0,0]=4 5081 B7R0.15 CCC(SC)C(=O)O MCULE-3373016779 [0,2,0,0,0,0|2,0,0]=4 5082 B7R0.15 CCN(CC)C(=O)C MCULE-6584128098 [0,2,0,0,0,0|2,0,0]=4 5083 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-3190659348 [0,2,0,0,0,0|2,0,0]=4 5084 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-5613487575 [0,2,0,0,0,0|2,0,0]=4 5085 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-6726398435 [0,2,0,0,0,0|2,0,0]=4 5086 B7R0.15 CC[C@H](CN)C(=O)O MCULE-2222410753 [0,2,0,0,0,0|2,0,0]=4 5087 B7R0.15 CC[C@H](CN)C(=O)O MCULE-3153536523 [0,2,0,0,0,0|2,0,0]=4 5088 B7R0.15 CC[C@H](CO)C(=O)O MCULE-3017159819 [0,2,0,0,0,0|1,0,0]=3 5089 B7R0.15 CC[C@H](NC)C(=O)N MCULE-6927041915 [0,2,0,0,0,0|2,0,0]=4 5090 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8566282898 [0,2,0,0,0,0|2,0,0]=4 5091 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8659413445 [0,2,0,0,0,0|2,0,0]=4 5092 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8863599251 [0,2,0,0,0,0|2,0,0]=4 5093 B7R0.15 CN(C)C(CN)CO MCULE-6987208473 [0,2,0,0,0,0|2,0,0]=4 5094 B7R0.15 CN(C)C(CO)CO MCULE-6589056011 [0,2,0,0,0,0|2,0,0]=4 5095 B7R0.15 CNC(CN)C(=O)N MCULE-4431940195 [0,2,0,0,0,0|2,0,0]=4 5096 B7R0.15 CNC(CO)C(=O)O MCULE-1439435474 [0,2,0,0,0,0|1,0,0]=3 5097 B7R0.15 CNC(CO)C(=O)O MCULE-7611211207 [0,2,0,0,0,0|1,0,0]=3 5098 B7R0.15 CNC(CO)C(C)C MCULE-5445088789 [0,2,0,0,0,0|1,0,1]=4 5099 B7R0.15 CNC(CS)C(=O)O MCULE-4817727684 [0,2,0,0,0,0|1,1,0]=4 5100 B7R0.15 CNC(CS)C(=O)O MCULE-5741984055 [0,2,0,0,0,0|1,1,0]=4 5101 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3196852022 [0,2,0,0,0,0|2,0,0]=4 5102 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3690177999 [0,2,0,0,0,0|2,0,0]=4 5103 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-3320307572 [0,2,0,0,0,0|1,0,0]=3 5104 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-5844994620 [0,2,0,0,0,0|1,0,0]=3 5105 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6293854138 [0,2,0,0,0,0|1,0,0]=3 5106 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6463850730 [0,2,0,0,0,0|1,0,0]=3 5107 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-3043115433 [0,2,0,0,0,0|1,1,0]=4 5108 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-8814760080 [0,2,0,0,0,0|1,1,0]=4 5109 B7R0.15 CN[C@H](CO)C(=O)O MCULE-1791141182 [0,2,0,0,0,0|1,0,0]=3 5110 B7R0.15 CN[C@H](CO)C(=O)O MCULE-9346314213 [0,2,0,0,0,0|1,0,0]=3 5111 B7R0.15 COC(CBr)C(=O)O MCULE-5528365617 [0,2,0,0,0,0|2,0,0]=4 5112 B7R0.15 COC(CN)C(=O)N MCULE-3215392526 [0,2,0,0,0,0|2,0,0]=4 5113 B7R0.15 COC(CN)C(=O)O MCULE-1561937449 [0,2,0,0,0,0|2,0,0]=4 5114 B7R0.15 COC(CN)C(=O)O MCULE-7501291426 [0,2,0,0,0,0|2,0,0]=4 5115 B7R0.15 COC(CO)C(C)Br MCULE-6071239484 [0,2,0,0,0,0|1,0,1]=4 5116 B7R0.15 COC(CO)C(C)C MCULE-8695619177 [0,2,0,0,0,0|1,0,1]=4 5117 B7R0.15 COC(CO)C(C)N MCULE-9816044841 [0,2,0,0,0,0|1,0,1]=4 5118 B7R0.15 COC(OC)C(=O)C MCULE-9746788369 [0,2,0,0,0,0|2,0,0]=4 5119 B7R0.15 CO[C@@H](CN)C(=O)O MCULE-5536624827 [0,2,0,0,0,0|2,0,0]=4 5120 B7R0.15 CO[C@@H](CN)C(=O)O MCULE-6198841067 [0,2,0,0,0,0|2,0,0]=4 5121 B7R0.15 CO[C@@H](CO)C(C)C MCULE-3676351737 [0,2,0,0,0,0|1,0,1]=4 5122 B7R0.15 CO[C@H](CO)C(C)C MCULE-2189146072 [0,2,0,0,0,0|1,0,1]=4 5123 B7R0.15 CSC(CO)C(C)N MCULE-6491195363 [0,2,0,0,0,0|1,0,1]=4 5124 B7R0.15 N#CC(CN)C(=O)O MCULE-3513807694 [0,2,0,0,0,0|2,0,0]=4 5125 B7R0.15 NC(=O)N(CO)CO MCULE-8654518853 [0,2,0,0,0,0|2,0,0]=4 5126 B7R0.15 NCC(CO)C(=O)O MCULE-5510878508 [0,2,0,0,0,0|1,0,0]=3 5127 B7R0.15 NCC(CO)C(=O)O MCULE-9991285445 [0,2,0,0,0,0|1,0,0]=3 5128 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-4607648703 [0,2,0,0,0,0|1,0,0]=3 5129 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-8943978569 [0,2,0,0,0,0|1,0,0]=3 5130 B7R0.15 NC[C@H](CO)C(=O)O MCULE-8459713640 [0,2,0,0,0,0|1,0,0]=3 5131 B7R0.15 O=C(O)C(CBr)CBr MCULE-5180730979 [0,2,0,0,0,0|2,0,0]=4 5132 B7R0.15 O=C(O)C(CS)CS MCULE-3175815620 [0,2,0,0,0,0|1,1,0]=4 5133 B7R0.15 O=C(O)[C@H](CO)NP MCULE-8418001133 [0,2,0,0,0,0|1,0,0]=3 5134 B7R0.15 O=N(=O)C(CO)CO MCULE-8874921455 [0,2,0,0,0,0|2,0,0]=4 5135 B7R0.4 C#CCCCC(=O)C MCULE-9860822800 [0,2,0,0,0,0|1,0,0]=3 5136 B7R0.4 C#CCCCC(=O)Cl MCULE-8504740573 [0,2,0,0,0,0|2,0,0]=4 5137 B7R0.4 C#CCCCC(=O)N MCULE-3927386617 [0,2,0,0,0,0|2,0,0]=4 5138 B7R0.4 C#CCCCC(=O)O MCULE-7464892335 [0,2,0,0,0,0|2,0,0]=4 5139 B7R0.4 C#CCCNC(=O)C MCULE-2003551338 [0,2,0,0,0,0|1,0,0]=3 5140 B7R0.4 C#CCCNC(=O)N MCULE-3889590992 [0,2,0,0,0,0|2,0,0]=4 5141 B7R0.4 C#CCCOC(=O)Cl MCULE-5894719916 [0,2,0,0,0,0|2,0,0]=4 5142 B7R0.4 C#CCCOC(=O)N MCULE-4721276092 [0,2,0,0,0,0|2,0,0]=4 5143 B7R0.4 C#CCNCC(=O)O MCULE-3308171795 [0,2,0,0,0,0|2,0,0]=4 5144 B7R0.4 C#CCNCC(=O)O MCULE-7200045848 [0,2,0,0,0,0|2,0,0]=4 5145 B7R0.4 C#CCOCC(=O)O MCULE-7164718181 [0,2,0,0,0,0|2,0,0]=4 5146 B7R0.4 C#CCSCC(=O)O MCULE-4337210412 [0,2,0,0,0,0|2,0,0]=4 5147 B7R0.4 C(=C/C(=O)O)\CCC MCULE-7580507705 [0,2,0,0,0,0|2,0,0]=4 5148 B7R0.4 C(=C/CC(=O)O)\CC MCULE-2731794411 [0,2,0,0,0,0|2,0,0]=4 5149 B7R0.4 C/C=C/COC(=O)C MCULE-4948306153 [0,2,0,0,0,0|1,0,1]=4 5150 B7R0.4 C=C(C)CCC=CC MCULE-7970794651 [0,2,0,0,0,0|2,0,0]=4 5151 B7R0.4 C=C(C)CCCC#N MCULE-2408925107 [0,2,0,0,0,0|2,0,0]=4 5152 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [0,2,0,0,0,0|2,0,0]=4 5153 B7R0.4 C=C=CCCC(=O)O MCULE-4179366971 [0,2,0,0,0,0|2,0,0]=4 5154 B7R0.4 C=CCCCC(=O)Cl MCULE-9125909850 [0,2,0,0,0,0|2,0,0]=4 5155 B7R0.4 C=CCCCC(=O)O MCULE-6043142578 [0,2,0,0,0,0|2,0,0]=4 5156 B7R0.4 C=CCCOC(=O)C MCULE-4554969214 [0,2,0,0,0,0|1,0,0]=3 5157 B7R0.4 C=CCCOC(=O)Cl MCULE-1917342500 [0,2,0,0,0,0|2,0,0]=4 5158 B7R0.4 C=CCNCC(=O)O MCULE-2925626447 [0,2,0,0,0,0|2,0,0]=4 5159 B7R0.4 C=CCNCC(=O)O MCULE-6980667867 [0,2,0,0,0,0|2,0,0]=4 5160 B7R0.4 C=CCOCC(=O)O MCULE-1419435306 [0,2,0,0,0,0|2,0,0]=4 5161 B7R0.4 C=CCONC(=O)C MCULE-1401456265 [0,2,0,0,0,0|1,0,1]=4 5162 B7R0.4 C=CCSCC(=O)O MCULE-1950424629 [0,2,0,0,0,0|2,0,0]=4 5163 B7R0.4 C=COCCN(C)C MCULE-5557000118 [0,2,0,0,0,0|2,0,0]=4 5164 B7R0.4 CC#CCCC(=O)O MCULE-1415388780 [0,2,0,0,0,0|2,0,0]=4 5165 B7R0.4 CC(=C=CCCO)C MCULE-7603464206 [0,2,0,0,0,0|1,0,0]=3 5166 B7R0.4 CC(=CCCC=O)C MCULE-3815388926 [0,2,0,0,0,0|1,0,1]=4 5167 B7R0.4 CC(=CCCCO)C MCULE-5263952692 [0,2,0,0,0,0|1,0,0]=3 5168 B7R0.4 CC(=CCOC=O)C MCULE-1475053986 [0,2,0,0,0,0|1,0,1]=4 5169 B7R0.4 CC(=O)CCCC#N MCULE-5884370871 [0,2,0,0,0,0|1,0,0]=3 5170 B7R0.4 CC(=O)CCCCBr MCULE-8801446022 [0,2,0,0,0,0|1,0,0]=3 5171 B7R0.4 CC(=O)CCCCCl MCULE-2883443563 [0,2,0,0,0,0|1,0,0]=3 5172 B7R0.4 CC(=O)CCCCO MCULE-9846338144 [0,2,0,0,0,0|0,0,0]=2 5173 B7R0.4 CC(=O)CCN=N#N MCULE-3526103207 [0,2,0,0,0,0|1,0,0]=3 5174 B7R0.4 CC(=O)CSCCF MCULE-8129308816 [0,2,0,0,0,0|1,0,0]=3 5175 B7R0.4 CC(=O)NCCC#N MCULE-1781318297 [0,2,0,0,0,0|1,0,0]=3 5176 B7R0.4 CC(=O)NCCC=O MCULE-1907633123 [0,2,0,0,0,0|0,0,1]=3 5177 B7R0.4 CC(=O)NCCCBr MCULE-5421597540 [0,2,0,0,0,0|1,0,0]=3 5178 B7R0.4 CC(=O)NCCCCl MCULE-4056331581 [0,2,0,0,0,0|1,0,0]=3 5179 B7R0.4 CC(=O)NCCCN MCULE-6321543480 [0,2,0,0,0,0|1,0,0]=3 5180 B7R0.4 CC(=O)NCCCN MCULE-8441492497 [0,2,0,0,0,0|1,0,0]=3 5181 B7R0.4 CC(=O)NCCCO MCULE-5627003249 [0,2,0,0,0,0|0,0,0]=2 5182 B7R0.4 CC(=O)NCCON MCULE-3703048482 [0,2,0,0,0,0|0,0,0]=2 5183 B7R0.4 CC(=O)OCCCBr MCULE-4735159476 [0,2,0,0,0,0|1,0,0]=3 5184 B7R0.4 CC(=O)OCCCCl MCULE-4801419214 [0,2,0,0,0,0|1,0,0]=3 5185 B7R0.4 CC(=O)OCCCI MCULE-5830086336 [0,2,0,0,0,0|1,0,0]=3 5186 B7R0.4 CC(=O)OCCCO MCULE-1423430948 [0,2,0,0,0,0|0,0,0]=2 5187 B7R0.4 CC(=O)OCCCS MCULE-2576827025 [0,2,0,0,0,0|0,1,0]=3 5188 B7R0.4 CC(=O)SCCC#N MCULE-4159295037 [0,2,0,0,0,0|1,0,0]=3 5189 B7R0.4 CC(=O)SCCC=O MCULE-3054558493 [0,2,0,0,0,0|0,0,1]=3 5190 B7R0.4 CC(=O)SCCCBr MCULE-2716633608 [0,2,0,0,0,0|1,0,0]=3 5191 B7R0.4 CC(=O)SCCCCl MCULE-3875604518 [0,2,0,0,0,0|1,0,0]=3 5192 B7R0.4 CC(=O)SCCCO MCULE-9014625190 [0,2,0,0,0,0|0,0,0]=2 5193 B7R0.4 CC(Br)CCCCO MCULE-2106751856 [0,2,0,0,0,0|1,0,1]=4 5194 B7R0.4 CC(C)CCCCO MCULE-9053698607 [0,2,0,0,0,0|1,0,1]=4 5195 B7R0.4 CC(C)CCCON MCULE-5299845209 [0,2,0,0,0,0|1,0,1]=4 5196 B7R0.4 CC(C)CCCON MCULE-8643496539 [0,2,0,0,0,0|1,0,1]=4 5197 B7R0.4 CC(C)CCOC=O MCULE-3671444552 [0,2,0,0,0,0|1,0,1]=4 5198 B7R0.4 CC(C)CCON=O MCULE-5177168468 [0,2,0,0,0,0|1,0,1]=4 5199 B7R0.4 CC(C)CNCCO MCULE-3948234461 [0,2,0,0,0,0|1,0,1]=4 5200 B7R0.4 CC(C)CNCCO MCULE-6673201049 [0,2,0,0,0,0|1,0,1]=4 5201 B7R0.4 CC(C)COCCO MCULE-2997702641 [0,2,0,0,0,0|1,0,1]=4 5202 B7R0.4 CC(C)CSCCO MCULE-5481216581 [0,2,0,0,0,0|1,0,1]=4 5203 B7R0.4 CC(C)NCCCO MCULE-4556994899 [0,2,0,0,0,0|1,0,1]=4 5204 B7R0.4 CC(C)NCCCO MCULE-9550690390 [0,2,0,0,0,0|1,0,1]=4 5205 B7R0.4 CC(C)OCCCO MCULE-9280654202 [0,2,0,0,0,0|1,0,1]=4 5206 B7R0.4 CC(C)OCCON MCULE-8218216454 [0,2,0,0,0,0|1,0,1]=4 5207 B7R0.4 CC(C)SCCCO MCULE-4296249117 [0,2,0,0,0,0|1,0,1]=4 5208 B7R0.4 CC(N)CCCCO MCULE-7039935081 [0,2,0,0,0,0|1,0,1]=4 5209 B7R0.4 CC(N)CCCCO MCULE-8167834378 [0,2,0,0,0,0|1,0,1]=4 5210 B7R0.4 CC(O)CCCCO MCULE-3790969400 [0,2,0,0,0,0|0,0,2]=4 5211 B7R0.4 CC(O)CNCCO MCULE-4873845500 [0,2,0,0,0,0|0,0,2]=4 5212 B7R0.4 CC(O)CSCCO MCULE-8885458360 [0,2,0,0,0,0|0,0,2]=4 5213 B7R0.4 CC=CCCC(=O)O MCULE-4275247668 [0,2,0,0,0,0|2,0,0]=4 5214 B7R0.4 CCC/C=C/C(=O)C MCULE-2005171902 [0,2,0,0,0,0|1,0,0]=3 5215 B7R0.4 CCC=CCC(=O)O MCULE-5031939966 [0,2,0,0,0,0|2,0,0]=4 5216 B7R0.4 CCCC#CC(=O)O MCULE-1682387091 [0,2,0,0,0,0|2,0,0]=4 5217 B7R0.4 CCCC=CC(=O)C MCULE-5008490883 [0,2,0,0,0,0|1,0,0]=3 5218 B7R0.4 CCCC=CC(=O)Cl MCULE-6782906777 [0,2,0,0,0,0|2,0,0]=4 5219 B7R0.4 CCCC=CC(=O)O MCULE-6995077492 [0,2,0,0,0,0|2,0,0]=4 5220 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [0,2,0,0,0,0|1,0,0]=3 5221 B7R0.4 CCCCCC(=O)Cl MCULE-5446850478 [0,2,0,0,0,0|2,0,0]=4 5222 B7R0.4 CCCCCC(=O)N MCULE-3215992514 [0,2,0,0,0,0|2,0,0]=4 5223 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [0,2,0,0,0,0|2,0,0]=4 5224 B7R0.4 CCCCCC(=O)[O-] MCULE-5310584661 [0,2,0,0,0,0|2,0,0]=4 5225 B7R0.4 CCCCCC(=O)[O-] MCULE-9495078126 [0,2,0,0,0,0|2,0,0]=4 5226 B7R0.4 CCCCNC(=O)C MCULE-7266335096 [0,2,0,0,0,0|1,0,0]=3 5227 B7R0.4 CCCCNC(=O)Cl MCULE-2148016012 [0,2,0,0,0,0|2,0,0]=4 5228 B7R0.4 CCCCNC(=O)N MCULE-3263036294 [0,2,0,0,0,0|2,0,0]=4 5229 B7R0.4 CCCCOC(=O)C MCULE-2107021121 [0,2,0,0,0,0|1,0,0]=3 5230 B7R0.4 CCCCOC(=O)Cl MCULE-5750652482 [0,2,0,0,0,0|2,0,0]=4 5231 B7R0.4 CCCCOC(=O)N MCULE-7719579696 [0,2,0,0,0,0|2,0,0]=4 5232 B7R0.4 CCCCSC(=O)C MCULE-2653182488 [0,2,0,0,0,0|1,0,0]=3 5233 B7R0.4 CCCCSC(=O)Cl MCULE-8008254909 [0,2,0,0,0,0|2,0,0]=4 5234 B7R0.4 CCCNCC(=O)N MCULE-2330202708 [0,2,0,0,0,0|2,0,0]=4 5235 B7R0.4 CCCNCC(=O)N MCULE-3731054780 [0,2,0,0,0,0|2,0,0]=4 5236 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [0,2,0,0,0,0|2,0,0]=4 5237 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [0,2,0,0,0,0|2,0,0]=4 5238 B7R0.4 CCCOCC(=O)O MCULE-6841640058 [0,2,0,0,0,0|2,0,0]=4 5239 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [0,2,0,0,0,0|1,0,0]=3 5240 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [0,2,0,0,0,0|2,0,0]=4 5241 B7R0.4 CCNCCC(=O)N MCULE-4857735433 [0,2,0,0,0,0|2,0,0]=4 5242 B7R0.4 CCNCCC(=O)N MCULE-8238114591 [0,2,0,0,0,0|2,0,0]=4 5243 B7R0.4 CCNCCC(=O)O MCULE-4226597657 [0,2,0,0,0,0|2,0,0]=4 5244 B7R0.4 CCNCCC(=O)O MCULE-9183951914 [0,2,0,0,0,0|2,0,0]=4 5245 B7R0.4 CCOCCC(=N)N MCULE-4926091113 [0,2,0,0,0,0|2,0,0]=4 5246 B7R0.4 CCOCCC(=N)N MCULE-8590303415 [0,2,0,0,0,0|2,0,0]=4 5247 B7R0.4 CCOCCC(=O)C MCULE-8449201493 [0,2,0,0,0,0|0,0,0]=2 5248 B7R0.4 CCOCCC(=O)Cl MCULE-8299617790 [0,2,0,0,0,0|1,0,0]=3 5249 B7R0.4 CCOCCC(=O)O MCULE-3962084059 [0,2,0,0,0,0|1,0,0]=3 5250 B7R0.4 CCOCNC(=O)N MCULE-7680870721 [0,2,0,0,0,0|2,0,0]=4 5251 B7R0.4 CCSCCC(=O)O MCULE-9385724904 [0,2,0,0,0,0|1,1,0]=4 5252 B7R0.4 CN(C)CC#CCO MCULE-9910143603 [0,2,0,0,0,0|2,0,0]=4 5253 B7R0.4 CN(C)CCCCO MCULE-6973654872 [0,2,0,0,0,0|2,0,0]=4 5254 B7R0.4 CN(C)CCCON MCULE-1245472313 [0,2,0,0,0,0|2,0,0]=4 5255 B7R0.4 CN(C)CCCON MCULE-5946614062 [0,2,0,0,0,0|2,0,0]=4 5256 B7R0.4 CNCCCC(=O)N MCULE-8337447772 [0,2,0,0,0,0|2,0,0]=4 5257 B7R0.4 CNCCCC(=O)N MCULE-9037809827 [0,2,0,0,0,0|2,0,0]=4 5258 B7R0.4 CNCCCC(=O)O MCULE-7598762485 [0,2,0,0,0,0|2,0,0]=4 5259 B7R0.4 CNCCCC(=O)O MCULE-7877286915 [0,2,0,0,0,0|2,0,0]=4 5260 B7R0.4 CNCCNC(=O)C MCULE-5361712613 [0,2,0,0,0,0|1,0,0]=3 5261 B7R0.4 CNCCNC(=O)C MCULE-9798024696 [0,2,0,0,0,0|1,0,0]=3 5262 B7R0.4 CNCCOC(=O)C MCULE-1850077864 [0,2,0,0,0,0|1,0,0]=3 5263 B7R0.4 CNCCOC(=O)C MCULE-7023987942 [0,2,0,0,0,0|1,0,0]=3 5264 B7R0.4 COC/C=C/C(=O)O MCULE-7555080897 [0,2,0,0,0,0|1,0,1]=4 5265 B7R0.4 COCC#CC(=O)O MCULE-5896712747 [0,2,0,0,0,0|1,0,1]=4 5266 B7R0.4 COCC=CC(=O)O MCULE-5702384430 [0,2,0,0,0,0|1,0,1]=4 5267 B7R0.4 COCCCC(=O)C MCULE-3606369396 [0,2,0,0,0,0|0,0,0]=2 5268 B7R0.4 COCCCC(=O)O MCULE-3165881573 [0,2,0,0,0,0|1,0,0]=3 5269 B7R0.4 COCCCC(=S)N MCULE-5066867181 [0,2,0,0,0,0|1,1,0]=4 5270 B7R0.4 COCCCC(C)N MCULE-4298611846 [0,2,0,0,0,0|1,0,1]=4 5271 B7R0.4 COCCCC(C)N MCULE-8139434838 [0,2,0,0,0,0|1,0,1]=4 5272 B7R0.4 COCCCC(C)O MCULE-4190294636 [0,2,0,0,0,0|0,0,2]=4 5273 B7R0.4 COCCNC(=N)N MCULE-4122240317 [0,2,0,0,0,0|2,0,0]=4 5274 B7R0.4 COCCNC(=N)N MCULE-5184785677 [0,2,0,0,0,0|2,0,0]=4 5275 B7R0.4 COCCNC(=N)N MCULE-5799549903 [0,2,0,0,0,0|2,0,0]=4 5276 B7R0.4 COCCNC(=O)C MCULE-2794263612 [0,2,0,0,0,0|0,0,0]=2 5277 B7R0.4 COCCNC(=O)N MCULE-1380726553 [0,2,0,0,0,0|1,0,0]=3 5278 B7R0.4 COCCNC(=S)N MCULE-1285240117 [0,2,0,0,0,0|1,1,0]=4 5279 B7R0.4 COCCNC(C)C MCULE-2061720092 [0,2,0,0,0,0|1,0,1]=4 5280 B7R0.4 COCCOC(=O)C MCULE-3221264060 [0,2,0,0,0,0|0,0,0]=2 5281 B7R0.4 COCCOC(=O)Cl MCULE-7308809094 [0,2,0,0,0,0|1,0,0]=3 5282 B7R0.4 COCCOC(=O)N MCULE-3401505850 [0,2,0,0,0,0|1,0,0]=3 5283 B7R0.4 COCCSC(=N)N MCULE-2093405339 [0,2,0,0,0,0|2,0,0]=4 5284 B7R0.4 COCCSC(=N)N MCULE-7836023475 [0,2,0,0,0,0|2,0,0]=4 5285 B7R0.4 CS(=O)CCCC#N MCULE-9441417021 [0,2,0,0,0,0|2,0,0]=4 5286 B7R0.4 CSCCCC(=O)O MCULE-2126637794 [0,2,0,0,0,0|1,1,0]=4 5287 B7R0.4 CSCCNC(=O)C MCULE-2739431878 [0,2,0,0,0,0|0,1,0]=3 5288 B7R0.4 CSCCNC(=O)N MCULE-7254695938 [0,2,0,0,0,0|1,1,0]=4 5289 B7R0.4 CSCCOC(=O)C MCULE-3742242959 [0,2,0,0,0,0|0,1,0]=3 5290 B7R0.4 CSSCCC(=O)O MCULE-6571821309 [0,2,0,0,0,0|1,1,0]=4 5291 B7R0.4 N#CCCCC(=O)O MCULE-9921837071 [0,2,0,0,0,0|2,0,0]=4 5292 B7R0.4 N#CCSCC(=O)O MCULE-4687961137 [0,2,0,0,0,0|2,0,0]=4 5293 B7R0.4 N#CCSCC(=O)[O-] MCULE-2024793830 [0,2,0,0,0,0|2,0,0]=4 5294 B7R0.4 N#N=NCCC(=O)Cl MCULE-3373595758 [0,2,0,0,0,0|2,0,0]=4 5295 B7R0.4 N#N=NCCC(=O)O MCULE-2098979516 [0,2,0,0,0,0|2,0,0]=4 5296 B7R0.4 NC(=O)CCCCBr MCULE-4949681497 [0,2,0,0,0,0|2,0,0]=4 5297 B7R0.4 NC(=O)CCCCCl MCULE-7937142112 [0,2,0,0,0,0|2,0,0]=4 5298 B7R0.4 NC(=O)CCCCO MCULE-4820227146 [0,2,0,0,0,0|1,0,0]=3 5299 B7R0.4 NC(=O)COCCCl MCULE-1141300697 [0,2,0,0,0,0|2,0,0]=4 5300 B7R0.4 NC(=O)COCCO MCULE-3158372920 [0,2,0,0,0,0|1,0,0]=3 5301 B7R0.4 NC(=O)CSCCO MCULE-8225407259 [0,2,0,0,0,0|1,0,0]=3 5302 B7R0.4 NC(=O)NCCCO MCULE-3167491311 [0,2,0,0,0,0|1,0,0]=3 5303 B7R0.4 NCCCCC(=O)N MCULE-3198962228 [0,2,0,0,0,0|2,0,0]=4 5304 B7R0.4 NCCCCC(=O)N MCULE-7986221705 [0,2,0,0,0,0|2,0,0]=4 5305 B7R0.4 NCCCCC(=O)O MCULE-1155829905 [0,2,0,0,0,0|2,0,0]=4 5306 B7R0.4 NCCCCC(=O)O MCULE-3920398524 [0,2,0,0,0,0|2,0,0]=4 5307 B7R0.4 NCCCCC(=O)O MCULE-4404796498 [0,2,0,0,0,0|2,0,0]=4 5308 B7R0.4 NCCCCC(=O)O MCULE-4971679857 [0,2,0,0,0,0|2,0,0]=4 5309 B7R0.4 NCCCNC(=O)N MCULE-1109440921 [0,2,0,0,0,0|2,0,0]=4 5310 B7R0.4 NCCCNC(=O)N MCULE-3933221897 [0,2,0,0,0,0|2,0,0]=4 5311 B7R0.4 NCCNCC(=O)O MCULE-9689592343 [0,2,0,0,0,0|2,0,0]=4 5312 B7R0.4 NCCNCC(=O)O MCULE-9795251557 [0,2,0,0,0,0|2,0,0]=4 5313 B7R0.4 NCCOCC(=O)O MCULE-2375694645 [0,2,0,0,0,0|2,0,0]=4 5314 B7R0.4 NCCOCC(=O)O MCULE-5877065986 [0,2,0,0,0,0|2,0,0]=4 5315 B7R0.4 NCCSCC(=O)O MCULE-5565800206 [0,2,0,0,0,0|2,0,0]=4 5316 B7R0.4 NCCSCC(=O)O MCULE-8322098978 [0,2,0,0,0,0|2,0,0]=4 5317 B7R0.4 NOCCCC(=O)O MCULE-4102473285 [0,2,0,0,0,0|1,0,0]=3 5318 B7R0.4 NOCCCC(=O)O MCULE-7068985203 [0,2,0,0,0,0|1,0,0]=3 5319 B7R0.4 O=C(Cl)CCCCBr MCULE-5574450546 [0,2,0,0,0,0|2,0,0]=4 5320 B7R0.4 O=C(Cl)CCCCCl MCULE-9605707894 [0,2,0,0,0,0|2,0,0]=4 5321 B7R0.4 O=C(Cl)CCCCF MCULE-8110878511 [0,2,0,0,0,0|2,0,0]=4 5322 B7R0.4 O=C(Cl)COCCCl MCULE-9707252778 [0,2,0,0,0,0|2,0,0]=4 5323 B7R0.4 O=C(Cl)OCCCCl MCULE-2619287385 [0,2,0,0,0,0|2,0,0]=4 5324 B7R0.4 O=C(Cl)OCCCF MCULE-4930474319 [0,2,0,0,0,0|2,0,0]=4 5325 B7R0.4 O=C(O)C#CCCO MCULE-5211042941 [0,2,0,0,0,0|1,0,0]=3 5326 B7R0.4 O=C(O)CCC=CBr MCULE-1826887170 [0,2,0,0,0,0|2,0,0]=4 5327 B7R0.4 O=C(O)CCCCBr MCULE-2655919094 [0,2,0,0,0,0|2,0,0]=4 5328 B7R0.4 O=C(O)CCCCCl MCULE-4094641005 [0,2,0,0,0,0|2,0,0]=4 5329 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [0,2,0,0,0,0|1,0,0]=3 5330 B7R0.4 O=C(O)CCCCS MCULE-2427465795 [0,2,0,0,0,0|1,1,0]=4 5331 B7R0.4 O=C(O)CNCCO MCULE-7501311949 [0,2,0,0,0,0|1,0,0]=3 5332 B7R0.4 O=C(O)COCCBr MCULE-4593325557 [0,2,0,0,0,0|2,0,0]=4 5333 B7R0.4 O=C(O)COCCCl MCULE-2978816248 [0,2,0,0,0,0|2,0,0]=4 5334 B7R0.4 O=C(O)COCCF MCULE-9820799514 [0,2,0,0,0,0|2,0,0]=4 5335 B7R0.4 O=C(O)COCCO MCULE-8297137880 [0,2,0,0,0,0|1,0,0]=3 5336 B7R0.4 O=C(O)CSCCCl MCULE-5204967583 [0,2,0,0,0,0|2,0,0]=4 5337 B7R0.4 O=C(O)CSCCO MCULE-1062560307 [0,2,0,0,0,0|1,0,0]=3 5338 B7R0.4 O=C([O-])CCCCO MCULE-3836827182 [0,2,0,0,0,0|1,0,0]=3 5339 B7R0.4 O=C([O-])COCCO MCULE-7093344226 [0,2,0,0,0,0|1,0,0]=3 5340 B7R0.4 O=C=NCCC(=O)Cl MCULE-4830401558 [0,2,0,0,0,0|1,0,1]=4 5341 B7R0.4 O=CCCCC(=O)O MCULE-8389457571 [0,2,0,0,0,0|1,0,1]=4 5342 B7R0.4 O=N(=O)CCCCO MCULE-4639070341 [0,2,0,0,0,0|2,0,0]=4 5343 B7R0.4 O=N(=O)OCCCO MCULE-3030828224 [0,2,0,0,0,0|2,0,0]=4 5344 B7R0.6 C=C(Br)CCC(=O)O MCULE-5257916083 [0,2,0,0,0,0|1,0,1]=4 5345 B7R0.6 C=C(Br)CNC(=O)C MCULE-4123179812 [0,2,0,0,0,0|1,0,1]=4 5346 B7R0.6 C=C(C)CCC(=C)C MCULE-6018302318 [0,2,0,0,0,0|2,0,0]=4 5347 B7R0.6 C=C(C)CCC(=O)C MCULE-4201277876 [0,2,0,0,0,0|1,0,0]=3 5348 B7R0.6 C=C(C)CCC(=O)N MCULE-7602727888 [0,2,0,0,0,0|1,0,1]=4 5349 B7R0.6 C=C(C)CCC(=O)O MCULE-8738532812 [0,2,0,0,0,0|1,0,0]=3 5350 B7R0.6 C=C(C)CCC(C)Br MCULE-6437209576 [0,2,0,0,0,0|2,0,0]=4 5351 B7R0.6 C=C(C)CCC(C)C MCULE-2459654294 [0,2,0,0,0,0|2,0,0]=4 5352 B7R0.6 C=C(C)CCC(C)N MCULE-9861269774 [0,2,0,0,0,0|2,0,0]=4 5353 B7R0.6 C=C(C)CCC(C)O MCULE-5005514248 [0,2,0,0,0,0|1,0,0]=3 5354 B7R0.6 C=C(C)CCN(=O)=O MCULE-5685156382 [0,2,0,0,0,0|1,0,1]=4 5355 B7R0.6 C=C(C)COC(=O)C MCULE-7739945243 [0,2,0,0,0,0|1,0,1]=4 5356 B7R0.6 C=C(C)NCC(=O)O MCULE-6347105994 [0,2,0,0,0,0|1,0,1]=4 5357 B7R0.6 C=C(Cl)CCC(=O)O MCULE-8617886776 [0,2,0,0,0,0|1,0,1]=4 5358 B7R0.6 C=C(Cl)CSC(=O)C MCULE-4264447992 [0,2,0,0,0,0|1,0,1]=4 5359 B7R0.6 CC(=CCC(=O)O)C MCULE-2552993418 [0,2,0,0,0,0|1,0,1]=4 5360 B7R0.6 CC(=CCC(C)C)C MCULE-5578852998 [0,2,0,0,0,0|2,0,0]=4 5361 B7R0.6 CC(=O)/C=C/C(=O)O MCULE-8768861026 [0,2,0,0,0,0|0,0,2]=4 5362 B7R0.6 CC(=O)C=CC(=O)O MCULE-6867353277 [0,2,0,0,0,0|0,0,2]=4 5363 B7R0.6 CC(=O)C=CC(C)C MCULE-7908862390 [0,2,0,0,0,0|1,0,1]=4 5364 B7R0.6 CC(=O)CCC(=O)C MCULE-3166810473 [0,2,0,0,0,0|0,0,1]=3 5365 B7R0.6 CC(=O)CCC(=O)N MCULE-8943258659 [0,2,0,0,0,0|0,0,1]=3 5366 B7R0.6 CC(=O)CCC(=O)O MCULE-1392778065 [0,2,0,0,0,0|0,0,0]=2 5367 B7R0.6 CC(=O)CCC(=O)[O-] MCULE-4975344808 [0,2,0,0,0,0|0,0,1]=3 5368 B7R0.6 CC(=O)CCC(C)C MCULE-8518693213 [0,2,0,0,0,0|1,0,0]=3 5369 B7R0.6 CC(=O)CCC(F)F MCULE-3009814756 [0,2,0,0,0,0|1,0,0]=3 5370 B7R0.6 CC(=O)CCN(=O)=O MCULE-4726243654 [0,2,0,0,0,0|0,0,1]=3 5371 B7R0.6 CC(=O)CCN(C)C MCULE-1601022082 [0,2,0,0,0,0|1,0,0]=3 5372 B7R0.6 CC(=O)CCN(C)C MCULE-2933383790 [0,2,0,0,0,0|1,0,0]=3 5373 B7R0.6 CC(=O)CNC(=O)C MCULE-7941086302 [0,2,0,0,0,0|0,0,2]=4 5374 B7R0.6 CC(=O)CNC(=O)Cl MCULE-2043888982 [0,2,0,0,0,0|0,0,2]=4 5375 B7R0.6 CC(=O)CNC(C)C MCULE-2033555652 [0,2,0,0,0,0|1,0,0]=3 5376 B7R0.6 CC(=O)CNC(C)C MCULE-2990661777 [0,2,0,0,0,0|1,0,0]=3 5377 B7R0.6 CC(=O)COC(=O)C MCULE-2994552521 [0,2,0,0,0,0|0,0,2]=4 5378 B7R0.6 CC(=O)COC(C)C MCULE-4426769810 [0,2,0,0,0,0|1,0,0]=3 5379 B7R0.6 CC(=O)CSC(C)C MCULE-6486341454 [0,2,0,0,0,0|1,0,0]=3 5380 B7R0.6 CC(=O)NCC(=O)Cl MCULE-3900899057 [0,2,0,0,0,0|0,0,2]=4 5381 B7R0.6 CC(=O)NCC(=O)N MCULE-7934502236 [0,2,0,0,0,0|0,0,2]=4 5382 B7R0.6 CC(=O)NCC(=O)O MCULE-5811325186 [0,2,0,0,0,0|0,0,1]=3 5383 B7R0.6 CC(=O)NCC(C)O MCULE-2406798273 [0,2,0,0,0,0|0,0,0]=2 5384 B7R0.6 CC(=O)NNC(C)C MCULE-8896858149 [0,2,0,0,0,0|2,0,0]=4 5385 B7R0.6 CC(=O)OCC(=O)Cl MCULE-3086938222 [0,2,0,0,0,0|0,0,2]=4 5386 B7R0.6 CC(=O)OCC(=O)O MCULE-6837320824 [0,2,0,0,0,0|0,0,1]=3 5387 B7R0.6 CC(=O)OCC(=S)N MCULE-7893306089 [0,2,0,0,0,0|0,1,1]=4 5388 B7R0.6 CC(=O)OCC(C)C MCULE-4530584087 [0,2,0,0,0,0|1,0,0]=3 5389 B7R0.6 CC(=O)OCC(C)O MCULE-3660209140 [0,2,0,0,0,0|0,0,0]=2 5390 B7R0.6 CC(=O)OCC(F)F MCULE-9491615455 [0,2,0,0,0,0|1,0,0]=3 5391 B7R0.6 CC(=O)SCC(=O)O MCULE-1974657694 [0,2,0,0,0,0|0,0,1]=3 5392 B7R0.6 CC(=S)NCC(=O)O MCULE-9052571833 [0,2,0,0,0,0|0,1,1]=4 5393 B7R0.6 CC(C)CCB(O)O MCULE-7387060292 [0,2,0,0,0,0|1,0,1]=4 5394 B7R0.6 CC(C)CCC(=O)Cl MCULE-6874903195 [0,2,0,0,0,0|2,0,0]=4 5395 B7R0.6 CC(C)CCC(=O)N MCULE-3571818514 [0,2,0,0,0,0|2,0,0]=4 5396 B7R0.6 CC(C)CCC(=O)O MCULE-7691755837 [0,2,0,0,0,0|1,0,1]=4 5397 B7R0.6 CC(C)CCC(C)O MCULE-6292509345 [0,2,0,0,0,0|1,0,1]=4 5398 B7R0.6 CC(C)CNC(=O)N MCULE-8112905719 [0,2,0,0,0,0|2,0,0]=4 5399 B7R0.6 CC(C)COC(=O)Cl MCULE-4183178448 [0,2,0,0,0,0|2,0,0]=4 5400 B7R0.6 CC(C)COC(=O)N MCULE-3163620577 [0,2,0,0,0,0|2,0,0]=4 5401 B7R0.6 CC(C)NCC(=O)Cl MCULE-3841055671 [0,2,0,0,0,0|2,0,0]=4 5402 B7R0.6 CC(C)NCC(=O)N MCULE-3100213662 [0,2,0,0,0,0|2,0,0]=4 5403 B7R0.6 CC(C)NCC(=O)N MCULE-9178070179 [0,2,0,0,0,0|2,0,0]=4 5404 B7R0.6 CC(C)NCC(=O)O MCULE-4344882030 [0,2,0,0,0,0|2,0,0]=4 5405 B7R0.6 CC(C)NCC(=O)O MCULE-7052227156 [0,2,0,0,0,0|2,0,0]=4 5406 B7R0.6 CC(C)OCC(=O)Cl MCULE-5892054766 [0,2,0,0,0,0|2,0,0]=4 5407 B7R0.6 CC(C)OCC(=O)O MCULE-8295905061 [0,2,0,0,0,0|2,0,0]=4 5408 B7R0.6 CC(C)OC[C@H](C)O MCULE-2195035455 [0,2,0,0,0,0|1,0,1]=4 5409 B7R0.6 CC(C)SCC(=O)O MCULE-3990750464 [0,2,0,0,0,0|2,0,0]=4 5410 B7R0.6 CC(Cl)CCC(=O)Cl MCULE-3066199297 [0,2,0,0,0,0|2,0,0]=4 5411 B7R0.6 CC(N)CCC(=O)O MCULE-3711689460 [0,2,0,0,0,0|1,0,1]=4 5412 B7R0.6 CC(N)CCC(=O)O MCULE-5008572656 [0,2,0,0,0,0|1,0,1]=4 5413 B7R0.6 CC(N)CCS(=O)C MCULE-2870651099 [0,2,0,0,0,0|2,0,0]=4 5414 B7R0.6 CC(N)CCS(=O)C MCULE-7863963703 [0,2,0,0,0,0|2,0,0]=4 5415 B7R0.6 CC(O)CCC(=O)O MCULE-6352217997 [0,2,0,0,0,0|1,0,0]=3 5416 B7R0.6 CC(O)CCC(=O)[O-] MCULE-5872581098 [0,2,0,0,0,0|1,0,0]=3 5417 B7R0.6 CC(O)CCC(C)O MCULE-6170497684 [0,2,0,0,0,0|0,0,2]=4 5418 B7R0.6 CC(O)CCN(C)C MCULE-7246080230 [0,2,0,0,0,0|2,0,0]=4 5419 B7R0.6 CC(O)CNC(C)C MCULE-9932831006 [0,2,0,0,0,0|1,0,1]=4 5420 B7R0.6 CC(O)COC(C)C MCULE-3357280817 [0,2,0,0,0,0|1,0,1]=4 5421 B7R0.6 CC(S)CCC(=O)O MCULE-9612173883 [0,2,0,0,0,0|0,1,1]=4 5422 B7R0.6 CN(C)CCC(=O)O MCULE-5553815845 [0,2,0,0,0,0|2,0,0]=4 5423 B7R0.6 CN(C)CCC(=O)O MCULE-7454823322 [0,2,0,0,0,0|2,0,0]=4 5424 B7R0.6 CS(=O)CCC(=O)O MCULE-8243349779 [0,2,0,0,0,0|1,0,0]=3 5425 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-3295260637 [0,2,0,0,0,0|1,0,1]=4 5426 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-5409083898 [0,2,0,0,0,0|1,0,1]=4 5427 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-6530230723 [0,2,0,0,0,0|1,0,1]=4 5428 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-7530095699 [0,2,0,0,0,0|1,0,1]=4 5429 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-3982464496 [0,2,0,0,0,0|0,0,2]=4 5430 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-6083261012 [0,2,0,0,0,0|0,0,2]=4 5431 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-8142548171 [0,2,0,0,0,0|0,0,2]=4 5432 B7R0.6 C[C@@H](O)COC(=O)O MCULE-3794886346 [0,2,0,0,0,0|1,0,0]=3 5433 B7R0.6 C[C@H](N)CCC(=O)O MCULE-3621527632 [0,2,0,0,0,0|1,0,1]=4 5434 B7R0.6 C[C@H](N)CCC(=O)O MCULE-7670557122 [0,2,0,0,0,0|1,0,1]=4 5435 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-5867971604 [0,2,0,0,0,0|0,0,2]=4 5436 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-7024859164 [0,2,0,0,0,0|0,0,2]=4 5437 B7R0.6 C[S+](C)CCC(=O)O MCULE-8115187503 [0,2,0,0,0,0|1,1,0]=4 5438 B7R0.6 C[S+](C)CCC(=O)O MCULE-9668037011 [0,2,0,0,0,0|1,1,0]=4 5439 B7R0.6 C[S+](C)CCC(=O)[O-] MCULE-4039981521 [0,2,0,0,0,0|1,1,0]=4 5440 B7R0.6 NC(=O)CCC(=O)N MCULE-2107382817 [0,2,0,0,0,0|1,0,1]=4 5441 B7R0.6 NC(=O)CCC(=O)O MCULE-5813999826 [0,2,0,0,0,0|1,0,0]=3 5442 B7R0.6 NC(=O)NCC(=O)O MCULE-7640310218 [0,2,0,0,0,0|1,0,1]=4 5443 B7R0.6 NC(=O)SCC(=O)O MCULE-2409074226 [0,2,0,0,0,0|1,0,1]=4 5444 B7R0.6 O=C(Cl)CCC(=O)Cl MCULE-6220065982 [0,2,0,0,0,0|1,0,1]=4 5445 B7R0.6 O=C(Cl)OCC(F)F MCULE-4977819635 [0,2,0,0,0,0|2,0,0]=4 5446 B7R0.6 O=C(O)CCB(O)O MCULE-9351023222 [0,2,0,0,0,0|1,0,0]=3 5447 B7R0.6 O=C(O)CCC(=O)O MCULE-1233211613 [0,2,0,0,0,0|1,0,0]=3 5448 B7R0.6 O=C(O)CCC(=O)O MCULE-5889111640 [0,2,0,0,0,0|1,0,0]=3 5449 B7R0.6 O=C(O)CCC(F)F MCULE-6002651269 [0,2,0,0,0,0|2,0,0]=4 5450 B7R0.6 O=C(O)CCN(=O)=O MCULE-1879231817 [0,2,0,0,0,0|1,0,1]=4 5451 B7R0.6 O=C(O)COC(F)F MCULE-1418551422 [0,2,0,0,0,0|2,0,0]=4 5452 B7R0.6 O=C(O)CSC(F)F MCULE-6609650116 [0,2,0,0,0,0|2,0,0]=4 5453 B7R0.6 O=C([O-])C=CC([O-])O MCULE-6492820393 [0,2,0,0,0,0|1,0,1]=4 5454 B7R0.6 O=C([O-])CCC(=O)O MCULE-9149947862 [0,2,0,0,0,0|1,0,0]=3 5455 B7R0.6 O=C([O-])CCC(=O)[O-] MCULE-6304944077 [0,2,0,0,0,0|1,0,1]=4 5456 B7R0.6 O=C([O-])CSC(F)F MCULE-1738110888 [0,2,0,0,0,0|2,0,0]=4 5457 B7R0.8 C#CCCS(=O)(=O)C MCULE-8412539396 [0,2,0,0,0,0|2,0,0]=4 5458 B7R0.8 CC(C)(C)CCCO MCULE-6612017649 [0,2,0,0,0,0|1,0,1]=4 5459 B7R0.8 CC(C)(C)CCON MCULE-2291447993 [0,2,0,0,0,0|1,0,1]=4 5460 B7R0.8 CC(C)(C)NCCO MCULE-4847202538 [0,2,0,0,0,0|1,0,1]=4 5461 B7R0.8 CC(C)(C)OCCO MCULE-7079168773 [0,2,0,0,0,0|1,0,1]=4 5462 B7R0.8 CC(C)(C)SCCO MCULE-5098402639 [0,2,0,0,0,0|1,0,1]=4 5463 B7R0.8 CC(C)(N)CCCO MCULE-7933621714 [0,2,0,0,0,0|1,0,1]=4 5464 B7R0.8 CC(C)(O)CCCO MCULE-1879136086 [0,2,0,0,0,0|0,0,2]=4 5465 B7R0.8 CC(F)(F)CCCO MCULE-1590790031 [0,2,0,0,0,0|1,0,1]=4 5466 B7R0.8 CCCOP(=O)(C)O MCULE-3556230581 [0,2,0,0,0,0|2,0,0]=4 5467 B7R0.8 CCCOS(=O)(=O)C MCULE-8443601449 [0,2,0,0,0,0|2,0,0]=4 5468 B7R0.8 CNCCS(=O)(=O)C MCULE-5880210307 [0,2,0,0,0,0|2,0,0]=4 5469 B7R0.8 CNCCS(=O)(=O)C MCULE-6808272578 [0,2,0,0,0,0|2,0,0]=4 5470 B7R0.8 COCCC(C)(C)N MCULE-7159634596 [0,2,0,0,0,0|1,0,1]=4 5471 B7R0.8 COCCS(=O)(=O)Cl MCULE-2673896601 [0,2,0,0,0,0|2,0,0]=4 5472 B7R0.8 COCCS(=O)(=O)F MCULE-2622271041 [0,2,0,0,0,0|2,0,0]=4 5473 B7R0.8 COCCS(=O)(=O)N MCULE-4498428516 [0,2,0,0,0,0|2,0,0]=4 5474 B7R0.8 COCCS(=O)(=O)[O-] MCULE-1587742211 [0,2,0,0,0,0|2,0,0]=4 5475 B7R0.8 COCCS(=O)(=O)[O-] MCULE-3001985511 [0,2,0,0,0,0|2,0,0]=4 5476 B7R0.8 CP(=O)(C)CCC#N MCULE-3151693100 [0,2,0,0,0,0|2,0,0]=4 5477 B7R0.8 CP(=O)(O)CCCN MCULE-1158131505 [0,2,0,0,0,0|2,0,0]=4 5478 B7R0.8 CP(=O)(O)CCCN MCULE-8748054523 [0,2,0,0,0,0|2,0,0]=4 5479 B7R0.8 CS(=O)(=NCCN)C MCULE-3558710314 [0,2,0,0,0,0|2,0,0]=4 5480 B7R0.8 CS(=O)(=NCCN)C MCULE-4394646642 [0,2,0,0,0,0|2,0,0]=4 5481 B7R0.8 CS(=O)(=NCCN)C MCULE-4787241983 [0,2,0,0,0,0|2,0,0]=4 5482 B7R0.8 CS(=O)(=O)CCC#N MCULE-8533596798 [0,2,0,0,0,0|2,0,0]=4 5483 B7R0.8 CS(=O)(=O)CCC=O MCULE-1821843669 [0,2,0,0,0,0|1,0,1]=4 5484 B7R0.8 CS(=O)(=O)CCCBr MCULE-2086749914 [0,2,0,0,0,0|2,0,0]=4 5485 B7R0.8 CS(=O)(=O)CCCCl MCULE-6105041795 [0,2,0,0,0,0|2,0,0]=4 5486 B7R0.8 CS(=O)(=O)CCCI MCULE-8038229906 [0,2,0,0,0,0|2,0,0]=4 5487 B7R0.8 CS(=O)(=O)CCCN MCULE-2348963019 [0,2,0,0,0,0|2,0,0]=4 5488 B7R0.8 CS(=O)(=O)CCCN MCULE-8313734317 [0,2,0,0,0,0|2,0,0]=4 5489 B7R0.8 CS(=O)(=O)CCCO MCULE-6816358475 [0,2,0,0,0,0|1,0,0]=3 5490 B7R0.8 CS(=O)(=O)CCNN MCULE-4785942183 [0,2,0,0,0,0|2,0,0]=4 5491 B7R0.8 CS(=O)(=O)CCNN MCULE-5010570563 [0,2,0,0,0,0|2,0,0]=4 5492 B7R0.8 CS(=O)(=O)NCCBr MCULE-1824456277 [0,2,0,0,0,0|2,0,0]=4 5493 B7R0.8 CS(=O)(=O)NCCCl MCULE-8530695984 [0,2,0,0,0,0|2,0,0]=4 5494 B7R0.8 CS(=O)(=O)NCCI MCULE-8659941425 [0,2,0,0,0,0|2,0,0]=4 5495 B7R0.8 CS(=O)(=O)NCCN MCULE-4856835139 [0,2,0,0,0,0|2,0,0]=4 5496 B7R0.8 CS(=O)(=O)NCCN MCULE-5265059473 [0,2,0,0,0,0|2,0,0]=4 5497 B7R0.8 CS(=O)(=O)NCCO MCULE-2565384564 [0,2,0,0,0,0|1,0,0]=3 5498 B7R0.8 CS(=O)(=O)OCCCl MCULE-8198079010 [0,2,0,0,0,0|2,0,0]=4 5499 B7R0.8 CS(=O)(=O)OCCF MCULE-7277769013 [0,2,0,0,0,0|2,0,0]=4 5500 B7R0.8 CS(=O)(=O)SCCN MCULE-5969057578 [0,2,0,0,0,0|2,0,0]=4 5501 B7R0.8 CS(=O)(=O)SCCN MCULE-7003127591 [0,2,0,0,0,0|2,0,0]=4 5502 B7R0.8 CS(=O)(=S)OCCBr MCULE-3017854867 [0,2,0,0,0,0|2,0,0]=4 5503 B7R0.8 CS(=O)(=S)OCCN MCULE-7727893446 [0,2,0,0,0,0|2,0,0]=4 5504 B7R0.8 CS(=O)(=S)OCCN MCULE-8197856093 [0,2,0,0,0,0|2,0,0]=4 5505 B7R0.8 C[Si](C)(C)CCCO MCULE-4140493646 [0,2,0,0,0,0|1,1,0]=4 5506 B7R0.8 C[Si](C)(C)CCON MCULE-1449766833 [0,2,0,0,0,0|1,1,0]=4 5507 B7R0.8 C[Si](C)(C)CCON MCULE-4125270419 [0,2,0,0,0,0|1,1,0]=4 5508 B7R0.8 C[Si](C)(C)OCCO MCULE-3523451816 [0,2,0,0,0,0|1,1,0]=4 5509 B7R0.8 O=S(=O)(O)CCCO MCULE-2005221071 [0,2,0,0,0,0|2,0,0]=4 5510 B7R0.8 O=S(=O)([O-])CCCO MCULE-8868858831 [0,2,0,0,0,0|2,0,0]=4 5511 B5R1.2 BrC1=CCC1 MCULE-7839710306 [1,0,0,1,0,0|1,0,1]=4 5512 B5R1.2 BrC1CCC1 MCULE-3713567804 [1,0,0,1,0,0|1,0,1]=4 5513 B5R1.2 BrC1COC1 MCULE-7527620035 [1,0,0,1,0,0|1,0,1]=4 5514 B5R1.2 C=C1CCC1 MCULE-8318650413 [1,0,0,1,0,0|1,0,0]=3 5515 B5R1.2 C=C1CNC1 MCULE-1391021267 [1,0,0,1,0,0|2,0,0]=4 5516 B5R1.2 C=C1CNC1 MCULE-7957953185 [1,0,0,1,0,0|2,0,0]=4 5517 B5R1.2 C=C1COC1 MCULE-1822645869 [1,0,0,1,0,0|1,0,0]=3 5518 B5R1.2 CC1CCN1 MCULE-7952714343 [1,0,0,1,0,0|1,0,1]=4 5519 B5R1.2 CC1CCN1 MCULE-9084374728 [1,0,0,1,0,0|1,0,1]=4 5520 B5R1.2 C[C@@H]1CCN1 MCULE-1326888606 [1,0,0,1,0,0|1,0,1]=4 5521 B5R1.2 C[C@@H]1CCN1 MCULE-4242598105 [1,0,0,1,0,0|1,0,1]=4 5522 B5R1.2 C[C@@H]1CCN1 MCULE-7982357684 [1,0,0,1,0,0|1,0,1]=4 5523 B5R1.2 C[C@@H]1CCN1 MCULE-9443505478 [1,0,0,1,0,0|1,0,1]=4 5524 B5R1.2 C[C@H]1CCN1 MCULE-3178162849 [1,0,0,1,0,0|1,0,1]=4 5525 B5R1.2 C[C@H]1CCN1 MCULE-4001397038 [1,0,0,1,0,0|1,0,1]=4 5526 B5R1.2 C[C@H]1CCN1 MCULE-4361200248 [1,0,0,1,0,0|1,0,1]=4 5527 B5R1.2 C[C@H]1CCN1 MCULE-6534579029 [1,0,0,1,0,0|1,0,1]=4 5528 B5R1.2 ClC1CCC1 MCULE-2602937313 [1,0,0,1,0,0|1,0,1]=4 5529 B5R1.2 ClC1COC1 MCULE-7266812470 [1,0,0,1,0,0|1,0,1]=4 5530 B5R1.2 FC1COC1 MCULE-7899811313 [1,0,0,1,0,0|1,0,1]=4 5531 B5R1.2 IC1CCC1 MCULE-3890796264 [1,0,0,1,0,0|1,0,1]=4 5532 B5R1.2 IC1COC1 MCULE-6736781201 [1,0,0,1,0,0|1,0,1]=4 5533 B5R1.2 NC1CCC1 MCULE-7511834789 [1,0,0,1,0,0|1,0,1]=4 5534 B5R1.2 NC1CCC1 MCULE-9118406840 [1,0,0,1,0,0|1,0,1]=4 5535 B5R1.2 NC1COC1 MCULE-3457998413 [1,0,0,1,0,0|1,0,1]=4 5536 B5R1.2 NC1COC1 MCULE-8439862131 [1,0,0,1,0,0|1,0,1]=4 5537 B5R1.2 NN1CCC1 MCULE-8176731673 [1,0,0,1,0,0|2,0,0]=4 5538 B5R1.2 NN1CCC1 MCULE-8382619719 [1,0,0,1,0,0|2,0,0]=4 5539 B5R1.2 O=C1CCC1 MCULE-4870967355 [1,0,0,1,0,0|0,0,0]=2 5540 B5R1.2 O=C1CCN1 MCULE-9053067221 [1,0,0,1,0,0|1,0,0]=3 5541 B5R1.2 O=C1CCO1 MCULE-1277069147 [1,0,0,1,0,0|1,0,0]=3 5542 B5R1.2 O=C1CNC1 MCULE-5171659870 [1,0,0,1,0,0|1,0,0]=3 5543 B5R1.2 O=C1CNC1 MCULE-8293494956 [1,0,0,1,0,0|1,0,0]=3 5544 B5R1.2 O=C1COC1 MCULE-6847248632 [1,0,0,1,0,0|0,0,0]=2 5545 B5R1.2 O=C1CSC1 MCULE-4436071261 [1,0,0,1,0,0|0,1,0]=3 5546 B5R1.2 OC1CCC1 MCULE-2856311430 [1,0,0,1,0,0|0,0,2]=4 5547 B5R1.2 OC1COC1 MCULE-2630355859 [1,0,0,1,0,0|0,0,2]=4 5548 B5R1.2 SC1CCC1 MCULE-1779239394 [1,0,0,1,0,0|0,1,1]=4 5549 B5R1.2 SC1COC1 MCULE-2175099379 [1,0,0,1,0,0|0,1,1]=4 5550 B5R1.3 CCC1CO1 MCULE-4316722229 [1,0,0,1,0,0|0,0,2]=4 5551 B5R1.3 CCC1CO1 MCULE-8341828978 [1,0,0,1,0,0|0,0,2]=4 5552 B5R1.3 CC[C@@H]1CO1 MCULE-4349820919 [1,0,0,1,0,0|0,0,2]=4 5553 B5R1.3 CC[C@@H]1CO1 MCULE-5929218989 [1,0,0,1,0,0|0,0,2]=4 5554 B5R1.3 CC[C@H]1CO1 MCULE-3647278168 [1,0,0,1,0,0|0,0,2]=4 5555 B5R1.3 CC[C@H]1CO1 MCULE-4369524443 [1,0,0,1,0,0|0,0,2]=4 5556 B5R1.3 OCC1CC1 MCULE-4492474357 [1,0,0,1,0,0|1,0,1]=4 5557 B5R1.3 OCC1CO1 MCULE-2158628585 [1,0,0,1,0,0|0,0,2]=4 5558 B5R1.3 OCC1CO1 MCULE-4063620133 [1,0,0,1,0,0|0,0,2]=4 5559 B5R1.3 OC[C@@H]1CO1 MCULE-4213198809 [1,0,0,1,0,0|0,0,2]=4 5560 B5R1.3 OC[C@@H]1CO1 MCULE-6922911793 [1,0,0,1,0,0|0,0,2]=4 5561 B5R1.3 OC[C@H]1CO1 MCULE-2018407404 [1,0,0,1,0,0|0,0,2]=4 5562 B5R1.3 OC[C@H]1CO1 MCULE-9773081927 [1,0,0,1,0,0|0,0,2]=4 5563 B5R1.4 CC1CC1N MCULE-4472318973 [1,0,0,1,0,0|1,0,1]=4 5564 B5R1.4 CC1CC1N MCULE-8037315228 [1,0,0,1,0,0|1,0,1]=4 5565 B5R1.4 CC1CC1O MCULE-2006758475 [1,0,0,1,0,0|0,0,2]=4 5566 B5R1.4 CC1OC1C MCULE-9780363671 [1,0,0,1,0,0|0,0,2]=4 5567 B5R1.4 C[C@@H]1C[C@@H]1N MCULE-6282896395 [1,0,0,1,0,0|1,0,1]=4 5568 B5R1.4 C[C@@H]1C[C@H]1N MCULE-1526017761 [1,0,0,1,0,0|1,0,1]=4 5569 B5R1.4 C[C@@H]1C[C@H]1N MCULE-7111745511 [1,0,0,1,0,0|1,0,1]=4 5570 B5R1.4 C[C@@H]1C[C@H]1N MCULE-7879046644 [1,0,0,1,0,0|1,0,1]=4 5571 B5R1.4 C[C@@H]1C[C@H]1N MCULE-9805986423 [1,0,0,1,0,0|1,0,1]=4 5572 B5R1.4 C[C@@H]1O[C@@H]1C MCULE-4355544092 [1,0,0,1,0,0|0,0,2]=4 5573 B5R1.4 C[C@@H]1O[C@H]1C MCULE-1930253682 [1,0,0,1,0,0|0,0,2]=4 5574 B5R1.4 C[C@H]1C[C@@H]1N MCULE-9525222696 [1,0,0,1,0,0|1,0,1]=4 5575 B5R1.4 C[C@H]1C[C@@H]1N MCULE-9658987958 [1,0,0,1,0,0|1,0,1]=4 5576 B5R1.4 C[C@H]1C[C@H]1N MCULE-4953477750 [1,0,0,1,0,0|1,0,1]=4 5577 B5R1.4 C[C@H]1C[C@H]1N MCULE-6429810931 [1,0,0,1,0,0|1,0,1]=4 5578 B5R1.4 C[C@H]1O[C@@H]1C MCULE-4354089942 [1,0,0,1,0,0|0,0,2]=4 5579 B5R1.4 C[C@H]1O[C@@H]1C MCULE-7982793342 [1,0,0,1,0,0|0,0,2]=4 5580 B5R1.4 NC1CC1O MCULE-2677451452 [1,0,0,1,0,0|1,0,1]=4 5581 B5R1.4 NC1CC1O MCULE-2909581707 [1,0,0,1,0,0|1,0,1]=4 5582 B5R1.4 N[C@@H]1C[C@@H]1O MCULE-1950197706 [1,0,0,1,0,0|1,0,1]=4 5583 B5R1.4 N[C@@H]1C[C@H]1O MCULE-5188790849 [1,0,0,1,0,0|1,0,1]=4 5584 B5R1.4 N[C@@H]1C[C@H]1O MCULE-8531829585 [1,0,0,1,0,0|1,0,1]=4 5585 B5R1.4 N[C@H]1C[C@@H]1O MCULE-4699241997 [1,0,0,1,0,0|1,0,1]=4 5586 B5R1.4 N[C@H]1C[C@H]1O MCULE-3609246488 [1,0,0,1,0,0|1,0,1]=4 5587 B5R1.4 N[C@H]1C[C@H]1O MCULE-3860963329 [1,0,0,1,0,0|1,0,1]=4 5588 B5R1.5 CC1(CC1)Br MCULE-7741990197 [1,0,0,1,0,0|1,0,1]=4 5589 B5R1.5 CC1(CC1)N MCULE-5669720871 [1,0,0,1,0,0|1,0,1]=4 5590 B5R1.5 CC1(CC1)N MCULE-6964629714 [1,0,0,1,0,0|1,0,1]=4 5591 B5R1.5 CC1(CC1)O MCULE-8472680145 [1,0,0,1,0,0|0,0,2]=4 5592 B5R1.5 CC1(CO1)C MCULE-4247049920 [1,0,0,1,0,0|1,0,1]=4 5593 B5R1.5 O=S1(=O)CC1 MCULE-3660879908 [1,0,0,1,0,0|2,0,0]=4 5594 B5R1.1 B1CCOO1 MCULE-4859234466 [1,0,0,1,0,0|1,0,1]=4 5595 B5R1.1 C1=CCCC1 MCULE-8785635218 [1,0,0,1,0,0|1,0,1]=4 5596 B5R1.1 C1=CCNC1 MCULE-4645888757 [1,0,0,1,0,0|1,0,1]=4 5597 B5R1.1 C1=CCNC1 MCULE-7386427096 [1,0,0,1,0,0|1,0,1]=4 5598 B5R1.1 C1=CCOC1 MCULE-1252378718 [1,0,0,1,0,0|0,0,1]=3 5599 B5R1.1 C1=CCSC1 MCULE-7848219599 [1,0,0,1,0,0|0,1,1]=4 5600 B5R1.1 C1=COCC1 MCULE-7714726225 [1,0,0,1,0,0|0,0,1]=3 5601 B5R1.1 C1=NNCC1 MCULE-2270087414 [1,0,0,1,0,0|2,0,0]=4 5602 B5R1.1 C1CCNC1 MCULE-2816679267 [1,0,0,1,0,0|1,0,1]=4 5603 B5R1.1 C1CCNC1 MCULE-8439725600 [1,0,0,1,0,0|1,0,1]=4 5604 B5R1.1 C1CCNC1 MCULE-8653165010 [1,0,0,1,0,0|1,0,1]=4 5605 B5R1.1 C1CCNC1 MCULE-9053007443 [1,0,0,1,0,0|1,0,1]=4 5606 B5R1.1 C1CCOC1 MCULE-3873245085 [1,0,0,1,0,0|0,0,1]=3 5607 B5R1.1 C1CCSC1 MCULE-4519380555 [1,0,0,1,0,0|0,1,1]=4 5608 B5R1.1 C1CNCN1 MCULE-6666768806 [1,0,0,1,0,0|2,0,0]=4 5609 B5R1.1 C1CNOC1 MCULE-3922840312 [1,0,0,1,0,0|1,0,1]=4 5610 B5R1.1 C1CNOC1 MCULE-6084499894 [1,0,0,1,0,0|1,0,1]=4 5611 B5R1.1 C1COCN1 MCULE-4693733872 [1,0,0,1,0,0|1,0,0]=3 5612 B5R1.1 C1COCO1 MCULE-3967810235 [1,0,0,1,0,0|1,0,0]=3 5613 B5R1.1 C1CSCN1 MCULE-1445529876 [1,0,0,1,0,0|1,1,0]=4 5614 B5R1.1 C1CSCN1 MCULE-8646299838 [1,0,0,1,0,0|1,1,0]=4 5615 B5R1.1 C1CSCS1 MCULE-2954642463 [1,0,0,1,0,0|1,1,0]=4 5616 B7R1.1 BrCC1=CCCC1 MCULE-9208619526 [0,1,0,1,0,0|2,0,0]=4 5617 B7R1.1 BrCC1CCOC1 MCULE-5109533414 [0,1,0,1,0,0|1,0,1]=4 5618 B7R1.1 BrC[C@H]1CCOC1 MCULE-3326059942 [0,1,0,1,0,0|1,0,1]=4 5619 B7R1.1 C#CC1CCOC1 MCULE-6007232344 [0,1,0,1,0,0|1,0,1]=4 5620 B7R1.1 C1(CCOC1)CN MCULE-1674920995 [0,1,0,1,0,0|1,0,1]=4 5621 B7R1.1 C1(CCOC1)CN MCULE-9715233219 [0,1,0,1,0,0|1,0,1]=4 5622 B7R1.1 C1(CCOC1)CO MCULE-2350780678 [0,1,0,1,0,0|0,0,2]=4 5623 B7R1.1 C1(CCOC1)NC MCULE-8636753374 [0,1,0,1,0,0|1,0,1]=4 5624 B7R1.1 CC=C1CCCC1 MCULE-9763131004 [0,1,0,1,0,0|2,0,0]=4 5625 B7R1.1 CC=C1CCNC1 MCULE-9077980338 [0,1,0,1,0,0|2,0,0]=4 5626 B7R1.1 CC=C1CCNC1 MCULE-9519724391 [0,1,0,1,0,0|2,0,0]=4 5627 B7R1.1 CCC1=CCCC1 MCULE-5154730597 [0,1,0,1,0,0|2,0,0]=4 5628 B7R1.1 CNC1CCOC1 MCULE-5628928593 [0,1,0,1,0,0|1,0,1]=4 5629 B7R1.1 CNC1CCOC1 MCULE-7465078745 [0,1,0,1,0,0|1,0,1]=4 5630 B7R1.1 CNC1CCOC1 MCULE-8928979869 [0,1,0,1,0,0|1,0,1]=4 5631 B7R1.1 CN[C@@H]1CCOC1 MCULE-2275496757 [0,1,0,1,0,0|1,0,1]=4 5632 B7R1.1 CN[C@@H]1CCOC1 MCULE-4479731635 [0,1,0,1,0,0|1,0,1]=4 5633 B7R1.1 CN[C@@H]1CCOC1 MCULE-4936509842 [0,1,0,1,0,0|1,0,1]=4 5634 B7R1.1 CN[C@@H]1CCOC1 MCULE-7543653230 [0,1,0,1,0,0|1,0,1]=4 5635 B7R1.1 CN[C@H]1CCOC1 MCULE-3884907072 [0,1,0,1,0,0|1,0,1]=4 5636 B7R1.1 CN[C@H]1CCOC1 MCULE-5671082057 [0,1,0,1,0,0|1,0,1]=4 5637 B7R1.1 CN[C@H]1CCOC1 MCULE-7223789451 [0,1,0,1,0,0|1,0,1]=4 5638 B7R1.1 CN[C@H]1CCOC1 MCULE-7903690510 [0,1,0,1,0,0|1,0,1]=4 5639 B7R1.1 COC1=CCCC1 MCULE-6260649761 [0,1,0,1,0,0|2,0,0]=4 5640 B7R1.1 COC1=NCCC1 MCULE-2625712954 [0,1,0,1,0,0|2,0,0]=4 5641 B7R1.1 ClCC1=NOCC1 MCULE-8714304275 [0,1,0,1,0,0|1,0,0]=3 5642 B7R1.1 ClCC1CCOC1 MCULE-1203835826 [0,1,0,1,0,0|1,0,1]=4 5643 B7R1.1 ICC1CCOC1 MCULE-2014671156 [0,1,0,1,0,0|1,0,1]=4 5644 B7R1.1 IC[C@H]1CCOC1 MCULE-5163407500 [0,1,0,1,0,0|1,0,1]=4 5645 B7R1.1 N#CC1=NOCC1 MCULE-6070275701 [0,1,0,1,0,0|1,0,1]=4 5646 B7R1.1 N#CC1CCOC1 MCULE-5555423051 [0,1,0,1,0,0|1,0,1]=4 5647 B7R1.1 N#C[C@@H]1CCOC1 MCULE-4697885787 [0,1,0,1,0,0|1,0,1]=4 5648 B7R1.1 N#C[C@@H]1CCOC1 MCULE-7073460204 [0,1,0,1,0,0|1,0,1]=4 5649 B7R1.1 N#C[C@H]1CCOC1 MCULE-6745266026 [0,1,0,1,0,0|1,0,1]=4 5650 B7R1.1 N#C[C@H]1CCOC1 MCULE-6946151061 [0,1,0,1,0,0|1,0,1]=4 5651 B7R1.1 NCC1CCOC1 MCULE-4208746127 [0,1,0,1,0,0|1,0,1]=4 5652 B7R1.1 NCC1CCOC1 MCULE-6540410947 [0,1,0,1,0,0|1,0,1]=4 5653 B7R1.1 NC[C@@H]1CCOC1 MCULE-2941934022 [0,1,0,1,0,0|1,0,1]=4 5654 B7R1.1 NC[C@@H]1CCOC1 MCULE-2981279377 [0,1,0,1,0,0|1,0,1]=4 5655 B7R1.1 NC[C@@H]1CCOC1 MCULE-6671508282 [0,1,0,1,0,0|1,0,1]=4 5656 B7R1.1 NC[C@@H]1CCOC1 MCULE-7170580817 [0,1,0,1,0,0|1,0,1]=4 5657 B7R1.1 NC[C@H]1CCOC1 MCULE-1537228220 [0,1,0,1,0,0|1,0,1]=4 5658 B7R1.1 NC[C@H]1CCOC1 MCULE-2673094483 [0,1,0,1,0,0|1,0,1]=4 5659 B7R1.1 NC[C@H]1CCOC1 MCULE-4873739830 [0,1,0,1,0,0|1,0,1]=4 5660 B7R1.1 NC[C@H]1CCOC1 MCULE-6059527282 [0,1,0,1,0,0|1,0,1]=4 5661 B7R1.1 NNC1CCOC1 MCULE-5497635104 [0,1,0,1,0,0|1,0,1]=4 5662 B7R1.1 NNC1CCOC1 MCULE-9086625827 [0,1,0,1,0,0|1,0,1]=4 5663 B7R1.1 NNC1CCOC1 MCULE-9696991785 [0,1,0,1,0,0|1,0,1]=4 5664 B7R1.1 NN[C@@H]1CCOC1 MCULE-5277138269 [0,1,0,1,0,0|1,0,1]=4 5665 B7R1.1 NN[C@@H]1CCOC1 MCULE-5921785384 [0,1,0,1,0,0|1,0,1]=4 5666 B7R1.1 NN[C@@H]1CCOC1 MCULE-7398479477 [0,1,0,1,0,0|1,0,1]=4 5667 B7R1.1 NN[C@@H]1CCOC1 MCULE-9971593238 [0,1,0,1,0,0|1,0,1]=4 5668 B7R1.1 NN[C@H]1CCOC1 MCULE-2032105408 [0,1,0,1,0,0|1,0,1]=4 5669 B7R1.1 NN[C@H]1CCOC1 MCULE-4857620237 [0,1,0,1,0,0|1,0,1]=4 5670 B7R1.1 NN[C@H]1CCOC1 MCULE-5796183363 [0,1,0,1,0,0|1,0,1]=4 5671 B7R1.1 NN[C@H]1CCOC1 MCULE-8921088992 [0,1,0,1,0,0|1,0,1]=4 5672 B7R1.1 NOC1CCOC1 MCULE-1016688849 [0,1,0,1,0,0|0,0,2]=4 5673 B7R1.1 O=CC1=CCCC1 MCULE-2270030217 [0,1,0,1,0,0|1,0,1]=4 5674 B7R1.1 O=CC1=CCSC1 MCULE-9591036145 [0,1,0,1,0,0|0,1,1]=4 5675 B7R1.1 O=CC1CCCC1 MCULE-4938681495 [0,1,0,1,0,0|1,0,1]=4 5676 B7R1.1 O=CC1CCNC1 MCULE-5188223111 [0,1,0,1,0,0|1,0,1]=4 5677 B7R1.1 O=CC1CCOC1 MCULE-9515567606 [0,1,0,1,0,0|0,0,1]=3 5678 B7R1.1 O=CC1CCSC1 MCULE-1282848613 [0,1,0,1,0,0|0,1,1]=4 5679 B7R1.1 O=CN1CCCC1 MCULE-1922854302 [0,1,0,1,0,0|2,0,0]=4 5680 B7R1.1 O=C[C@@H]1CCOC1 MCULE-5181257964 [0,1,0,1,0,0|0,0,1]=3 5681 B7R1.1 O=C[C@H]1CCOC1 MCULE-4532427366 [0,1,0,1,0,0|0,0,1]=3 5682 B7R1.1 O=NN1CCCC1 MCULE-8449068120 [0,1,0,1,0,0|2,0,0]=4 5683 B7R1.1 OCC1=CCCC1 MCULE-8850570361 [0,1,0,1,0,0|2,0,0]=4 5684 B7R1.1 OCC1CCOC1 MCULE-8926405046 [0,1,0,1,0,0|0,0,2]=4 5685 B7R1.1 OCC1CCON1 MCULE-1199975481 [0,1,0,1,0,0|1,0,1]=4 5686 B7R1.1 OCC1CCON1 MCULE-4772487016 [0,1,0,1,0,0|1,0,1]=4 5687 B7R1.1 OC[C@@H]1CCOC1 MCULE-2004616524 [0,1,0,1,0,0|0,0,2]=4 5688 B7R1.1 OC[C@@H]1CCOC1 MCULE-3801423698 [0,1,0,1,0,0|0,0,2]=4 5689 B7R1.1 OC[C@H]1CCOC1 MCULE-4226412289 [0,1,0,1,0,0|0,0,2]=4 5690 B7R1.1 OC[C@H]1CCOC1 MCULE-9076004118 [0,1,0,1,0,0|0,0,2]=4 5691 B7R1.1 ON=C1CCCC1 MCULE-9338449832 [0,1,0,1,0,0|1,0,1]=4 5692 B7R1.1 SCC1CCOC1 MCULE-4504314486 [0,1,0,1,0,0|0,1,1]=4 5693 B7R1.2 C1(CCN(C1)C)O MCULE-5142099784 [0,1,0,1,0,0|2,0,0]=4 5694 B7R1.2 C1(CNC(=O)C1)N MCULE-6663942203 [0,1,0,1,0,0|1,0,0]=3 5695 B7R1.2 C1(CNC(=O)C1)N MCULE-7862049809 [0,1,0,1,0,0|1,0,0]=3 5696 B7R1.2 C1(CNC(=O)C1)O MCULE-5557473335 [0,1,0,1,0,0|0,0,0]=2 5697 B7R1.2 C1(COC(=O)N1)C MCULE-2821940224 [0,1,0,1,0,0|2,0,0]=4 5698 B7R1.2 C=C1CCC(=O)O1 MCULE-2485348963 [0,1,0,1,0,0|2,0,0]=4 5699 B7R1.2 CC1=CC(=O)CC1 MCULE-5496838191 [0,1,0,1,0,0|1,0,1]=4 5700 B7R1.2 CC1=CC(=O)CO1 MCULE-6570401610 [0,1,0,1,0,0|0,0,2]=4 5701 B7R1.2 CC1=NC(CC1)C MCULE-9630685459 [0,1,0,1,0,0|2,0,0]=4 5702 B7R1.2 CC1=NC(CO1)C MCULE-2489340707 [0,1,0,1,0,0|2,0,0]=4 5703 B7R1.2 CC1=NC(CS1)C MCULE-8843957654 [0,1,0,1,0,0|2,0,0]=4 5704 B7R1.2 CC1=NOC(=O)C1 MCULE-2665741338 [0,1,0,1,0,0|1,0,1]=4 5705 B7R1.2 CC1=NOC(=O)C1 MCULE-3084424307 [0,1,0,1,0,0|1,0,1]=4 5706 B7R1.2 CC1CC(=NO1)N MCULE-8353889650 [0,1,0,1,0,0|2,0,0]=4 5707 B7R1.2 CC1CC(=O)CO1 MCULE-7022597277 [0,1,0,1,0,0|0,0,0]=2 5708 B7R1.2 CC1CC(=O)CS1 MCULE-7518365363 [0,1,0,1,0,0|0,1,0]=3 5709 B7R1.2 CC1CC(=O)NN1 MCULE-2056748401 [0,1,0,1,0,0|2,0,0]=4 5710 B7R1.2 CC1CC(=O)NN1 MCULE-8107476665 [0,1,0,1,0,0|2,0,0]=4 5711 B7R1.2 CC1CC(CN1)O MCULE-5630063862 [0,1,0,1,0,0|1,0,1]=4 5712 B7R1.2 CC1CC(CN1)O MCULE-7427731937 [0,1,0,1,0,0|1,0,1]=4 5713 B7R1.2 CC1CC(CO1)N MCULE-5031195609 [0,1,0,1,0,0|1,0,1]=4 5714 B7R1.2 CC1CC(CO1)N MCULE-6627149239 [0,1,0,1,0,0|1,0,1]=4 5715 B7R1.2 CC1CC(CO1)O MCULE-1304022283 [0,1,0,1,0,0|0,0,2]=4 5716 B7R1.2 CC1CCC(=O)C1 MCULE-6716533429 [0,1,0,1,0,0|1,0,0]=3 5717 B7R1.2 CC1CCC(=O)N1 MCULE-8928464449 [0,1,0,1,0,0|2,0,0]=4 5718 B7R1.2 CC1CCC(=O)N1 MCULE-9236321365 [0,1,0,1,0,0|2,0,0]=4 5719 B7R1.2 CC1CCC(=O)O1 MCULE-3014789527 [0,1,0,1,0,0|2,0,0]=4 5720 B7R1.2 CC1CCC(C1)O MCULE-7892602703 [0,1,0,1,0,0|1,0,1]=4 5721 B7R1.2 CC1CNC(=O)C1 MCULE-7180589009 [0,1,0,1,0,0|1,0,0]=3 5722 B7R1.2 CC1CNC(=O)N1 MCULE-3789430210 [0,1,0,1,0,0|2,0,0]=4 5723 B7R1.2 CC1CNC(=O)O1 MCULE-1288358267 [0,1,0,1,0,0|2,0,0]=4 5724 B7R1.2 CC1COC(=O)C1 MCULE-7226555218 [0,1,0,1,0,0|1,0,0]=3 5725 B7R1.2 CC1COC(=O)N1 MCULE-5787960105 [0,1,0,1,0,0|2,0,0]=4 5726 B7R1.2 CC1COC(=O)O1 MCULE-9055336051 [0,1,0,1,0,0|2,0,0]=4 5727 B7R1.2 CC1CSC(=O)S1 MCULE-5074098161 [0,1,0,1,0,0|2,0,0]=4 5728 B7R1.2 CC1NCC(=O)N1 MCULE-9790180398 [0,1,0,1,0,0|2,0,0]=4 5729 B7R1.2 CN1CCC(=O)C1 MCULE-4017029823 [0,1,0,1,0,0|1,0,0]=3 5730 B7R1.2 CN1CCC(=O)C1 MCULE-8684002131 [0,1,0,1,0,0|1,0,0]=3 5731 B7R1.2 CN1CCC(C1)O MCULE-7899934177 [0,1,0,1,0,0|2,0,0]=4 5732 B7R1.2 CN1CC[C@@H](C1)O MCULE-1236945758 [0,1,0,1,0,0|2,0,0]=4 5733 B7R1.2 CN1CC[C@@H](C1)O MCULE-4275527304 [0,1,0,1,0,0|2,0,0]=4 5734 B7R1.2 CN1CC[C@H](C1)O MCULE-6665002754 [0,1,0,1,0,0|2,0,0]=4 5735 B7R1.2 CN1CC[C@H](C1)O MCULE-8080661086 [0,1,0,1,0,0|2,0,0]=4 5736 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-1621276410 [0,1,0,1,0,0|1,0,0]=3 5737 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-8721208019 [0,1,0,1,0,0|1,0,0]=3 5738 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-2915942259 [0,1,0,1,0,0|2,0,0]=4 5739 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-8123247569 [0,1,0,1,0,0|2,0,0]=4 5740 B7R1.2 C[C@@H]1CCC(=O)O1 MCULE-5934008113 [0,1,0,1,0,0|2,0,0]=4 5741 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-2439559922 [0,1,0,1,0,0|1,0,0]=3 5742 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-7246323100 [0,1,0,1,0,0|1,0,0]=3 5743 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-8336717940 [0,1,0,1,0,0|2,0,0]=4 5744 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-9661080313 [0,1,0,1,0,0|2,0,0]=4 5745 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1121808555 [0,1,0,1,0,0|1,0,0]=3 5746 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1627827491 [0,1,0,1,0,0|1,0,0]=3 5747 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-2439588002 [0,1,0,1,0,0|2,0,0]=4 5748 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-5329850427 [0,1,0,1,0,0|2,0,0]=4 5749 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-3187800510 [0,1,0,1,0,0|2,0,0]=4 5750 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-6719271655 [0,1,0,1,0,0|2,0,0]=4 5751 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-1211015225 [0,1,0,1,0,0|1,0,1]=4 5752 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8025231795 [0,1,0,1,0,0|1,0,1]=4 5753 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8074184383 [0,1,0,1,0,0|1,0,1]=4 5754 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8403784233 [0,1,0,1,0,0|1,0,1]=4 5755 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-4359200896 [0,1,0,1,0,0|1,0,1]=4 5756 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-5029850022 [0,1,0,1,0,0|1,0,1]=4 5757 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8880723450 [0,1,0,1,0,0|1,0,1]=4 5758 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8966000465 [0,1,0,1,0,0|1,0,1]=4 5759 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-3272300487 [0,1,0,1,0,0|1,0,0]=3 5760 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-4583858198 [0,1,0,1,0,0|1,0,0]=3 5761 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-5135895304 [0,1,0,1,0,0|1,0,0]=3 5762 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-6058896534 [0,1,0,1,0,0|1,0,0]=3 5763 B7R1.2 C[C@H]1CCC(=O)C1 MCULE-7319626625 [0,1,0,1,0,0|1,0,0]=3 5764 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-2618122031 [0,1,0,1,0,0|2,0,0]=4 5765 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-6630066118 [0,1,0,1,0,0|2,0,0]=4 5766 B7R1.2 C[C@H]1CCC(=O)O1 MCULE-5274272771 [0,1,0,1,0,0|2,0,0]=4 5767 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-3395896178 [0,1,0,1,0,0|1,0,0]=3 5768 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-8492971593 [0,1,0,1,0,0|1,0,0]=3 5769 B7R1.2 C[C@H]1COC(=O)C1 MCULE-6050720348 [0,1,0,1,0,0|1,0,0]=3 5770 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7240884474 [0,1,0,1,0,0|2,0,0]=4 5771 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7811823319 [0,1,0,1,0,0|2,0,0]=4 5772 B7R1.2 C[C@H]1COC(=O)O1 MCULE-2416711374 [0,1,0,1,0,0|2,0,0]=4 5773 B7R1.2 C[C@H]1COC(=O)O1 MCULE-4223856214 [0,1,0,1,0,0|2,0,0]=4 5774 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-1346257695 [0,1,0,1,0,0|1,0,1]=4 5775 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-3035291598 [0,1,0,1,0,0|1,0,1]=4 5776 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-8611352921 [0,1,0,1,0,0|1,0,1]=4 5777 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-9413190353 [0,1,0,1,0,0|1,0,1]=4 5778 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-3188785695 [0,1,0,1,0,0|1,0,1]=4 5779 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-4518572489 [0,1,0,1,0,0|1,0,1]=4 5780 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-5322353871 [0,1,0,1,0,0|1,0,1]=4 5781 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-9693826142 [0,1,0,1,0,0|1,0,1]=4 5782 B7R1.2 NC1=CC(=O)CC1 MCULE-9465243079 [0,1,0,1,0,0|1,0,1]=4 5783 B7R1.2 NC1=NC(=O)CO1 MCULE-5739646901 [0,1,0,1,0,0|1,0,1]=4 5784 B7R1.2 NC1CCC(=O)C1 MCULE-5102535286 [0,1,0,1,0,0|1,0,0]=3 5785 B7R1.2 NC1CCC(=O)C1 MCULE-7722818264 [0,1,0,1,0,0|1,0,0]=3 5786 B7R1.2 NC1CCC(=O)N1 MCULE-1843033026 [0,1,0,1,0,0|2,0,0]=4 5787 B7R1.2 NC1CCC(=O)N1 MCULE-7671057220 [0,1,0,1,0,0|2,0,0]=4 5788 B7R1.2 NC1CCC(C1)O MCULE-5821071286 [0,1,0,1,0,0|1,0,1]=4 5789 B7R1.2 NC1CCC(C1)O MCULE-9391783901 [0,1,0,1,0,0|1,0,1]=4 5790 B7R1.2 NC1CCS(=O)C1 MCULE-7416029311 [0,1,0,1,0,0|2,0,0]=4 5791 B7R1.2 NC1CCS(=O)C1 MCULE-8914660363 [0,1,0,1,0,0|2,0,0]=4 5792 B7R1.2 NC1CNC(=O)C1 MCULE-1690074091 [0,1,0,1,0,0|1,0,0]=3 5793 B7R1.2 NC1CNC(=O)C1 MCULE-2563813057 [0,1,0,1,0,0|1,0,0]=3 5794 B7R1.2 NC1CNC(=O)C1 MCULE-5332234739 [0,1,0,1,0,0|1,0,0]=3 5795 B7R1.2 NC1CNC(=O)C1 MCULE-9955937074 [0,1,0,1,0,0|1,0,0]=3 5796 B7R1.2 NC1COC(=O)C1 MCULE-1027386953 [0,1,0,1,0,0|1,0,0]=3 5797 B7R1.2 NC1COC(=O)C1 MCULE-1493825051 [0,1,0,1,0,0|1,0,0]=3 5798 B7R1.2 NC1COC(=O)C1 MCULE-3118610284 [0,1,0,1,0,0|1,0,0]=3 5799 B7R1.2 NC1COC(=O)C1 MCULE-8194840985 [0,1,0,1,0,0|1,0,0]=3 5800 B7R1.2 NC1NC(=O)CS1 MCULE-5789159592 [0,1,0,1,0,0|1,1,0]=4 5801 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-2973461190 [0,1,0,1,0,0|1,0,1]=4 5802 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-5462229704 [0,1,0,1,0,0|1,0,1]=4 5803 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-6746606174 [0,1,0,1,0,0|1,0,1]=4 5804 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7196403409 [0,1,0,1,0,0|1,0,1]=4 5805 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7511735313 [0,1,0,1,0,0|1,0,1]=4 5806 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-9023897758 [0,1,0,1,0,0|1,0,1]=4 5807 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-3286276562 [0,1,0,1,0,0|1,0,1]=4 5808 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-5345953109 [0,1,0,1,0,0|1,0,1]=4 5809 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-6442703385 [0,1,0,1,0,0|1,0,1]=4 5810 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-7457197538 [0,1,0,1,0,0|1,0,1]=4 5811 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-1502944618 [0,1,0,1,0,0|1,0,0]=3 5812 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-2444469131 [0,1,0,1,0,0|1,0,0]=3 5813 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-7277309874 [0,1,0,1,0,0|1,0,0]=3 5814 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-8533160250 [0,1,0,1,0,0|1,0,0]=3 5815 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-2437548952 [0,1,0,1,0,0|1,0,0]=3 5816 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4215135536 [0,1,0,1,0,0|1,0,0]=3 5817 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4884145743 [0,1,0,1,0,0|1,0,0]=3 5818 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-9276068415 [0,1,0,1,0,0|1,0,0]=3 5819 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-2764158583 [0,1,0,1,0,0|1,0,1]=4 5820 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-5047569623 [0,1,0,1,0,0|1,0,1]=4 5821 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-7674066148 [0,1,0,1,0,0|1,0,1]=4 5822 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-8478778872 [0,1,0,1,0,0|1,0,1]=4 5823 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-3786824722 [0,1,0,1,0,0|1,0,1]=4 5824 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-4140170961 [0,1,0,1,0,0|1,0,1]=4 5825 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5760466174 [0,1,0,1,0,0|1,0,1]=4 5826 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5995468864 [0,1,0,1,0,0|1,0,1]=4 5827 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-6230469368 [0,1,0,1,0,0|1,0,1]=4 5828 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-9622062244 [0,1,0,1,0,0|1,0,1]=4 5829 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-1884894725 [0,1,0,1,0,0|1,0,0]=3 5830 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-2130809002 [0,1,0,1,0,0|1,0,0]=3 5831 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-3881338264 [0,1,0,1,0,0|1,0,0]=3 5832 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-4324375667 [0,1,0,1,0,0|1,0,0]=3 5833 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-5900761307 [0,1,0,1,0,0|1,0,0]=3 5834 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-6007209179 [0,1,0,1,0,0|1,0,0]=3 5835 B7R1.2 N[C@H]1COC(=O)C1 MCULE-2936782126 [0,1,0,1,0,0|1,0,0]=3 5836 B7R1.2 N[C@H]1COC(=O)C1 MCULE-4255876921 [0,1,0,1,0,0|1,0,0]=3 5837 B7R1.2 N[C@H]1COC(=O)C1 MCULE-5377151477 [0,1,0,1,0,0|1,0,0]=3 5838 B7R1.2 N[C@H]1COC(=O)C1 MCULE-6406960509 [0,1,0,1,0,0|1,0,0]=3 5839 B7R1.2 O=C1C=C(CC1)Br MCULE-8421005141 [0,1,0,1,0,0|1,0,1]=4 5840 B7R1.2 O=C1C=C(CC1)Cl MCULE-4481059890 [0,1,0,1,0,0|1,0,1]=4 5841 B7R1.2 O=C1C=C(CC1)I MCULE-9887353763 [0,1,0,1,0,0|1,0,1]=4 5842 B7R1.2 O=C1C=C(CC1)O MCULE-4815747510 [0,1,0,1,0,0|0,0,1]=3 5843 B7R1.2 O=C1C=C(CN1)O MCULE-4305405716 [0,1,0,1,0,0|0,0,2]=4 5844 B7R1.2 O=C1C=C(CO1)O MCULE-5095558101 [0,1,0,1,0,0|0,0,2]=4 5845 B7R1.2 O=C1C=CC(C1)O MCULE-6464451546 [0,1,0,1,0,0|0,0,1]=3 5846 B7R1.2 O=C1C=CC(O1)O MCULE-7170809381 [0,1,0,1,0,0|1,0,1]=4 5847 B7R1.2 O=C1C=C[C@@H](C1)O MCULE-4535052390 [0,1,0,1,0,0|0,0,1]=3 5848 B7R1.2 O=C1C=C[C@H](C1)O MCULE-9347047598 [0,1,0,1,0,0|0,0,1]=3 5849 B7R1.2 O=C1CC(=CO1)O MCULE-3691688750 [0,1,0,1,0,0|0,0,2]=4 5850 B7R1.2 O=C1CC(CN1)O MCULE-8498039777 [0,1,0,1,0,0|0,0,0]=2 5851 B7R1.2 O=C1CC(CN1)S MCULE-3257609096 [0,1,0,1,0,0|0,1,0]=3 5852 B7R1.2 O=C1CC(CO1)O MCULE-3779919332 [0,1,0,1,0,0|0,0,0]=2 5853 B7R1.2 O=C1CC(CO1)O MCULE-5609071664 [0,1,0,1,0,0|0,0,0]=2 5854 B7R1.2 O=C1CCC(=O)C1 MCULE-6436831689 [0,1,0,1,0,0|0,0,1]=3 5855 B7R1.2 O=C1CCC(=O)N1 MCULE-8278049979 [0,1,0,1,0,0|1,0,1]=4 5856 B7R1.2 O=C1CCC(=O)O1 MCULE-1458819618 [0,1,0,1,0,0|1,0,1]=4 5857 B7R1.2 O=C1CCC(C1)F MCULE-9585894610 [0,1,0,1,0,0|1,0,0]=3 5858 B7R1.2 O=C1CCC(C1)I MCULE-5558007377 [0,1,0,1,0,0|1,0,0]=3 5859 B7R1.2 O=C1CCC(C1)O MCULE-8500536547 [0,1,0,1,0,0|0,0,0]=2 5860 B7R1.2 O=C1CCC(N1)O MCULE-1790956080 [0,1,0,1,0,0|1,0,0]=3 5861 B7R1.2 O=C1CCC(O1)F MCULE-6874239017 [0,1,0,1,0,0|2,0,0]=4 5862 B7R1.2 O=C1CCC(O1)O MCULE-5296344468 [0,1,0,1,0,0|1,0,0]=3 5863 B7R1.2 O=C1CNC(=O)C1 MCULE-6981924013 [0,1,0,1,0,0|0,0,2]=4 5864 B7R1.2 O=C1CNC(S1)S MCULE-9237115672 [0,1,0,1,0,0|1,1,0]=4 5865 B7R1.2 O=C1COC(=O)C1 MCULE-3258090872 [0,1,0,1,0,0|0,0,1]=3 5866 B7R1.2 O=C1COC(=O)N1 MCULE-3103815953 [0,1,0,1,0,0|1,0,1]=4 5867 B7R1.2 O=C1COC(=O)[N-]1 MCULE-2786348217 [0,1,0,1,0,0|1,0,1]=4 5868 B7R1.2 O=C1C[C@@H](CN1)O MCULE-2016792324 [0,1,0,1,0,0|0,0,0]=2 5869 B7R1.2 O=C1C[C@@H](CN1)O MCULE-9756194758 [0,1,0,1,0,0|0,0,0]=2 5870 B7R1.2 O=C1C[C@@H](CO1)O MCULE-1467506377 [0,1,0,1,0,0|0,0,0]=2 5871 B7R1.2 O=C1C[C@@H](CO1)O MCULE-3668466479 [0,1,0,1,0,0|0,0,0]=2 5872 B7R1.2 O=C1C[C@H](CN1)O MCULE-2017150152 [0,1,0,1,0,0|0,0,0]=2 5873 B7R1.2 O=C1C[C@H](CN1)O MCULE-5168961542 [0,1,0,1,0,0|0,0,0]=2 5874 B7R1.2 O=C1C[C@H](CN1)S MCULE-6980612759 [0,1,0,1,0,0|0,1,0]=3 5875 B7R1.2 O=C1C[C@H](CN1)S MCULE-7205538285 [0,1,0,1,0,0|0,1,0]=3 5876 B7R1.2 O=C1C[C@H](CO1)O MCULE-5756899897 [0,1,0,1,0,0|0,0,0]=2 5877 B7R1.2 O=C1C[C@H](CO1)O MCULE-6247095672 [0,1,0,1,0,0|0,0,0]=2 5878 B7R1.2 O=C1OCC(O1)Cl MCULE-4046020713 [0,1,0,1,0,0|2,0,0]=4 5879 B7R1.2 O=C1OCC(O1)F MCULE-7198712298 [0,1,0,1,0,0|2,0,0]=4 5880 B7R1.2 OC1CCC(C1)O MCULE-2799846813 [0,1,0,1,0,0|0,0,2]=4 5881 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-4481324218 [0,1,0,1,0,0|0,0,2]=4 5882 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-6560672131 [0,1,0,1,0,0|0,0,2]=4 5883 B7R1.2 O[C@H]1CC[C@H](C1)O MCULE-4640874873 [0,1,0,1,0,0|0,0,2]=4 5884 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-3137346382 [0,1,0,1,0,0|1,0,1]=4 5885 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-9954737796 [0,1,0,1,0,0|1,0,1]=4 5886 B7R1.2 [C@H]1(CCC(=O)C1)C MCULE-3827565169 [0,1,0,1,0,0|1,0,0]=3 5887 B7R1.2 [C@H]1(CC[C@H](C1)O)O MCULE-4834858159 [0,1,0,1,0,0|0,0,2]=4 5888 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-1916837136 [0,1,0,1,0,0|1,0,1]=4 5889 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-8263093896 [0,1,0,1,0,0|1,0,1]=4 5890 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9065610836 [0,1,0,1,0,0|1,0,1]=4 5891 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9910248291 [0,1,0,1,0,0|1,0,1]=4 5892 B7R1.3 BrC1=CCCCC1 MCULE-6137796305 [0,1,0,1,0,0|2,0,0]=4 5893 B7R1.3 BrC1=CCCNC1 MCULE-1016336040 [0,1,0,1,0,0|2,0,0]=4 5894 B7R1.3 BrC1=CCCNC1 MCULE-9845052592 [0,1,0,1,0,0|2,0,0]=4 5895 B7R1.3 BrC1=CCOCC1 MCULE-7609274912 [0,1,0,1,0,0|1,0,0]=3 5896 B7R1.3 BrC1=CCSCC1 MCULE-6964400494 [0,1,0,1,0,0|1,1,0]=4 5897 B7R1.3 BrC1=COCCC1 MCULE-7754503978 [0,1,0,1,0,0|1,0,1]=4 5898 B7R1.3 BrC1CCCOC1 MCULE-5781416415 [0,1,0,1,0,0|1,0,1]=4 5899 B7R1.3 BrC1CCOCC1 MCULE-4896539126 [0,1,0,1,0,0|1,0,1]=4 5900 B7R1.3 C1(CCCOC1)N MCULE-7160456966 [0,1,0,1,0,0|1,0,1]=4 5901 B7R1.3 C1(CCCOC1)N MCULE-9418657332 [0,1,0,1,0,0|1,0,1]=4 5902 B7R1.3 C=C1CCCCC1 MCULE-9812236661 [0,1,0,1,0,0|2,0,0]=4 5903 B7R1.3 C=C1CCCCN1 MCULE-8375354748 [0,1,0,1,0,0|2,0,0]=4 5904 B7R1.3 C=C1CCCNC1 MCULE-2588575300 [0,1,0,1,0,0|2,0,0]=4 5905 B7R1.3 C=C1CCCNC1 MCULE-9758065019 [0,1,0,1,0,0|2,0,0]=4 5906 B7R1.3 C=C1CCCOC1 MCULE-5236529273 [0,1,0,1,0,0|1,0,0]=3 5907 B7R1.3 C=C1CCNCC1 MCULE-4460895436 [0,1,0,1,0,0|2,0,0]=4 5908 B7R1.3 C=C1CCNCC1 MCULE-6605411269 [0,1,0,1,0,0|2,0,0]=4 5909 B7R1.3 C=C1CCNCC1 MCULE-6729798105 [0,1,0,1,0,0|2,0,0]=4 5910 B7R1.3 C=C1CCOCC1 MCULE-2744722311 [0,1,0,1,0,0|1,0,0]=3 5911 B7R1.3 CC1=CC=CCC1 MCULE-3797800778 [0,1,0,1,0,0|2,0,0]=4 5912 B7R1.3 CC1=CCCC=C1 MCULE-6224653152 [0,1,0,1,0,0|2,0,0]=4 5913 B7R1.3 CC1=CCCCC1 MCULE-2795172496 [0,1,0,1,0,0|2,0,0]=4 5914 B7R1.3 CC1=CCCNC1 MCULE-8145216779 [0,1,0,1,0,0|2,0,0]=4 5915 B7R1.3 CC1=CCCNC1 MCULE-9021954061 [0,1,0,1,0,0|2,0,0]=4 5916 B7R1.3 CC1=CCNCC1 MCULE-1503915992 [0,1,0,1,0,0|2,0,0]=4 5917 B7R1.3 CC1=CCNCC1 MCULE-3349815065 [0,1,0,1,0,0|2,0,0]=4 5918 B7R1.3 CC1=NCCNC1 MCULE-2066788449 [0,1,0,1,0,0|2,0,0]=4 5919 B7R1.3 CC1CCOCC1 MCULE-8623581625 [0,1,0,1,0,0|1,0,1]=4 5920 B7R1.3 CC1CCOCN1 MCULE-5420262342 [0,1,0,1,0,0|1,0,1]=4 5921 B7R1.3 CC1CCOCO1 MCULE-5013590651 [0,1,0,1,0,0|0,0,2]=4 5922 B7R1.3 CC1COCCN1 MCULE-1305824409 [0,1,0,1,0,0|1,0,1]=4 5923 B7R1.3 CC1COCCN1 MCULE-4570632464 [0,1,0,1,0,0|1,0,1]=4 5924 B7R1.3 CC1COCCN1 MCULE-6275555682 [0,1,0,1,0,0|1,0,1]=4 5925 B7R1.3 CC1COCCN1 MCULE-8711024794 [0,1,0,1,0,0|1,0,1]=4 5926 B7R1.3 CN1CCOCC1 MCULE-1649171852 [0,1,0,1,0,0|2,0,0]=4 5927 B7R1.3 C[C@@H]1COCCN1 MCULE-2750151013 [0,1,0,1,0,0|1,0,1]=4 5928 B7R1.3 C[C@@H]1COCCN1 MCULE-4003273424 [0,1,0,1,0,0|1,0,1]=4 5929 B7R1.3 C[C@@H]1COCCN1 MCULE-4627627990 [0,1,0,1,0,0|1,0,1]=4 5930 B7R1.3 C[C@@H]1COCCN1 MCULE-8600287111 [0,1,0,1,0,0|1,0,1]=4 5931 B7R1.3 C[C@H]1COCCN1 MCULE-1467834624 [0,1,0,1,0,0|1,0,1]=4 5932 B7R1.3 C[C@H]1COCCN1 MCULE-3486079226 [0,1,0,1,0,0|1,0,1]=4 5933 B7R1.3 C[C@H]1COCCN1 MCULE-5726525044 [0,1,0,1,0,0|1,0,1]=4 5934 B7R1.3 C[C@H]1COCCN1 MCULE-9977133603 [0,1,0,1,0,0|1,0,1]=4 5935 B7R1.3 ClC1=CCCCC1 MCULE-6882712527 [0,1,0,1,0,0|2,0,0]=4 5936 B7R1.3 ClC1=CCCNC1 MCULE-2132976242 [0,1,0,1,0,0|2,0,0]=4 5937 B7R1.3 ClC1=CCCNC1 MCULE-9013141821 [0,1,0,1,0,0|2,0,0]=4 5938 B7R1.3 ClC1CCCOC1 MCULE-5733907796 [0,1,0,1,0,0|1,0,1]=4 5939 B7R1.3 ClC1CCOCC1 MCULE-5672440693 [0,1,0,1,0,0|1,0,1]=4 5940 B7R1.3 ClN1CCOCC1 MCULE-2275187473 [0,1,0,1,0,0|2,0,0]=4 5941 B7R1.3 FC1=CCCNC1 MCULE-5131057553 [0,1,0,1,0,0|2,0,0]=4 5942 B7R1.3 FC1=CCCNC1 MCULE-8459145085 [0,1,0,1,0,0|2,0,0]=4 5943 B7R1.3 FC1=CCNCC1 MCULE-5573410633 [0,1,0,1,0,0|2,0,0]=4 5944 B7R1.3 FC1=CCNCC1 MCULE-9755070929 [0,1,0,1,0,0|2,0,0]=4 5945 B7R1.3 FC1CCCOC1 MCULE-9003204358 [0,1,0,1,0,0|1,0,1]=4 5946 B7R1.3 IC1CCOCC1 MCULE-7226892860 [0,1,0,1,0,0|1,0,1]=4 5947 B7R1.3 IN1CCOCC1 MCULE-2342142292 [0,1,0,1,0,0|2,0,0]=4 5948 B7R1.3 IN1CCOCC1 MCULE-6623188938 [0,1,0,1,0,0|2,0,0]=4 5949 B7R1.3 NC1=NCCCC1 MCULE-1020722938 [0,1,0,1,0,0|2,0,0]=4 5950 B7R1.3 NC1=NCCCC1 MCULE-9735306041 [0,1,0,1,0,0|2,0,0]=4 5951 B7R1.3 NC1=NCCSC1 MCULE-4272591822 [0,1,0,1,0,0|1,1,0]=4 5952 B7R1.3 NC1CCCOC1 MCULE-3002610862 [0,1,0,1,0,0|1,0,1]=4 5953 B7R1.3 NC1CCCOC1 MCULE-8678558313 [0,1,0,1,0,0|1,0,1]=4 5954 B7R1.3 NC1CCOCC1 MCULE-4830730893 [0,1,0,1,0,0|1,0,1]=4 5955 B7R1.3 NC1CCOCC1 MCULE-6229850202 [0,1,0,1,0,0|1,0,1]=4 5956 B7R1.3 NC1CCOCC1 MCULE-7619874469 [0,1,0,1,0,0|1,0,1]=4 5957 B7R1.3 NN1CCOCC1 MCULE-8277539965 [0,1,0,1,0,0|2,0,0]=4 5958 B7R1.3 N[C@@H]1CCCOC1 MCULE-3329999118 [0,1,0,1,0,0|1,0,1]=4 5959 B7R1.3 N[C@@H]1CCCOC1 MCULE-5434456311 [0,1,0,1,0,0|1,0,1]=4 5960 B7R1.3 N[C@@H]1CCCOC1 MCULE-8416525332 [0,1,0,1,0,0|1,0,1]=4 5961 B7R1.3 N[C@@H]1CCCOC1 MCULE-9941756618 [0,1,0,1,0,0|1,0,1]=4 5962 B7R1.3 N[C@H]1CCCOC1 MCULE-1619050625 [0,1,0,1,0,0|1,0,1]=4 5963 B7R1.3 N[C@H]1CCCOC1 MCULE-4275969826 [0,1,0,1,0,0|1,0,1]=4 5964 B7R1.3 N[C@H]1CCCOC1 MCULE-4421099383 [0,1,0,1,0,0|1,0,1]=4 5965 B7R1.3 N[C@H]1CCCOC1 MCULE-9281030983 [0,1,0,1,0,0|1,0,1]=4 5966 B7R1.3 O=C1C=CCCC1 MCULE-5207755083 [0,1,0,1,0,0|1,0,1]=4 5967 B7R1.3 O=C1C=CCCN1 MCULE-9815380990 [0,1,0,1,0,0|1,0,1]=4 5968 B7R1.3 O=C1C=CCCO1 MCULE-2962791770 [0,1,0,1,0,0|1,0,1]=4 5969 B7R1.3 O=C1C=CCOC1 MCULE-4817981961 [0,1,0,1,0,0|0,0,1]=3 5970 B7R1.3 O=C1C=COCC1 MCULE-2954829305 [0,1,0,1,0,0|0,0,1]=3 5971 B7R1.3 O=C1C=COCN1 MCULE-7471476237 [0,1,0,1,0,0|0,0,2]=4 5972 B7R1.3 O=C1CC=CCN1 MCULE-7370958955 [0,1,0,1,0,0|1,0,1]=4 5973 B7R1.3 O=C1CC=COC1 MCULE-3434064170 [0,1,0,1,0,0|0,0,1]=3 5974 B7R1.3 O=C1CCCCC1 MCULE-5664385838 [0,1,0,1,0,0|1,0,0]=3 5975 B7R1.3 O=C1CCCCN1 MCULE-9168245534 [0,1,0,1,0,0|1,0,0]=3 5976 B7R1.3 O=C1CCCCO1 MCULE-4682307363 [0,1,0,1,0,0|1,0,0]=3 5977 B7R1.3 O=C1CCCCS1 MCULE-5383777119 [0,1,0,1,0,0|1,0,0]=3 5978 B7R1.3 O=C1CCCNC1 MCULE-2774326662 [0,1,0,1,0,0|1,0,0]=3 5979 B7R1.3 O=C1CCCNC1 MCULE-8149766009 [0,1,0,1,0,0|1,0,0]=3 5980 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [0,1,0,1,0,0|0,0,0]=2 5981 B7R1.3 O=C1CCCSC1 MCULE-1649390503 [0,1,0,1,0,0|0,1,0]=3 5982 B7R1.3 O=C1CCNCC1 MCULE-7526186270 [0,1,0,1,0,0|1,0,0]=3 5983 B7R1.3 O=C1CCNCC1 MCULE-9761063200 [0,1,0,1,0,0|1,0,0]=3 5984 B7R1.3 O=C1CCNCN1 MCULE-5793765281 [0,1,0,1,0,0|1,0,0]=3 5985 B7R1.3 O=C1CCOCC1 MCULE-6728095514 [0,1,0,1,0,0|0,0,0]=2 5986 B7R1.3 O=C1CCSCC1 MCULE-8638366518 [0,1,0,1,0,0|0,1,0]=3 5987 B7R1.3 O=C1CNCCN1 MCULE-5599978871 [0,1,0,1,0,0|1,0,0]=3 5988 B7R1.3 O=C1CNCCO1 MCULE-2634056082 [0,1,0,1,0,0|1,0,0]=3 5989 B7R1.3 O=C1CNCCO1 MCULE-6420255529 [0,1,0,1,0,0|1,0,0]=3 5990 B7R1.3 O=C1COCCN1 MCULE-8242898041 [0,1,0,1,0,0|0,0,0]=2 5991 B7R1.3 O=C1COCCO1 MCULE-5754504096 [0,1,0,1,0,0|0,0,0]=2 5992 B7R1.3 O=C1CSCCN1 MCULE-1492056440 [0,1,0,1,0,0|0,1,0]=3 5993 B7R1.3 O=C1CSCSC1 MCULE-8034252746 [0,1,0,1,0,0|0,1,0]=3 5994 B7R1.3 O=C1NCCCN1 MCULE-4876148406 [0,1,0,1,0,0|2,0,0]=4 5995 B7R1.3 O=C1NCCCO1 MCULE-9333383492 [0,1,0,1,0,0|2,0,0]=4 5996 B7R1.3 O=C1NNCCO1 MCULE-2913818828 [0,1,0,1,0,0|2,0,0]=4 5997 B7R1.3 O=C1OCCCO1 MCULE-7728322911 [0,1,0,1,0,0|2,0,0]=4 5998 B7R1.3 O=S1CCCCC1 MCULE-1275253796 [0,1,0,1,0,0|2,0,0]=4 5999 B7R1.3 O=S1CCCSC1 MCULE-5552019770 [0,1,0,1,0,0|1,1,0]=4 6000 B7R1.3 O=S1CCNCC1 MCULE-1812570930 [0,1,0,1,0,0|2,0,0]=4 6001 B7R1.3 O=S1CCNCC1 MCULE-9878649050 [0,1,0,1,0,0|2,0,0]=4 6002 B7R1.3 O=S1CCOCC1 MCULE-4979531002 [0,1,0,1,0,0|1,0,0]=3 6003 B7R1.3 OC1CCCOC1 MCULE-3820663957 [0,1,0,1,0,0|0,0,2]=4 6004 B7R1.3 OC1CCCOC1 MCULE-4349250540 [0,1,0,1,0,0|0,0,2]=4 6005 B7R1.3 OC1CCOCC1 MCULE-3789534226 [0,1,0,1,0,0|0,0,2]=4 6006 B7R1.3 OC1COCOC1 MCULE-1056094446 [0,1,0,1,0,0|0,0,2]=4 6007 B7R1.3 ON1CCOCC1 MCULE-9071295312 [0,1,0,1,0,0|1,0,1]=4 6008 B7R1.3 O[C@@H]1CCCOC1 MCULE-1439860824 [0,1,0,1,0,0|0,0,2]=4 6009 B7R1.3 O[C@@H]1CCCOC1 MCULE-5515107963 [0,1,0,1,0,0|0,0,2]=4 6010 B7R1.3 O[C@H]1CCCOC1 MCULE-2228949296 [0,1,0,1,0,0|0,0,2]=4 6011 B7R1.3 O[C@H]1CCCOC1 MCULE-6500179909 [0,1,0,1,0,0|0,0,2]=4 6012 B7R1.3 S=C1CCCCC1 MCULE-6072375043 [0,1,0,1,0,0|1,1,0]=4 6013 B7R1.3 S=C1CCCCN1 MCULE-2004608075 [0,1,0,1,0,0|1,1,0]=4 6014 B7R1.3 S=C1COCCN1 MCULE-1743172522 [0,1,0,1,0,0|0,1,0]=3 6015 B7R1.3 SC1CCCOC1 MCULE-9540212924 [0,1,0,1,0,0|0,1,1]=4 6016 B7R1.3 SC1CCOCC1 MCULE-1287019115 [0,1,0,1,0,0|0,1,1]=4 6017 B7R1.4 C1(CCNC1=O)N MCULE-4906952813 [0,1,0,1,0,0|2,0,0]=4 6018 B7R1.4 C1(CCNC1=O)N MCULE-9500853209 [0,1,0,1,0,0|2,0,0]=4 6019 B7R1.4 C=C1CCCC1O MCULE-3026250203 [0,1,0,1,0,0|2,0,0]=4 6020 B7R1.4 C=C1CCNC1=O MCULE-2729105523 [0,1,0,1,0,0|1,0,1]=4 6021 B7R1.4 C=C1CCOC1=O MCULE-5907828600 [0,1,0,1,0,0|0,0,1]=3 6022 B7R1.4 C=C1COCC1N MCULE-4632261286 [0,1,0,1,0,0|1,0,0]=3 6023 B7R1.4 C=C1COCC1N MCULE-7153575301 [0,1,0,1,0,0|1,0,0]=3 6024 B7R1.4 CC1=CCCC1=O MCULE-3713655264 [0,1,0,1,0,0|1,0,0]=3 6025 B7R1.4 CC1=CCOC1=O MCULE-9785490540 [0,1,0,1,0,0|0,0,1]=3 6026 B7R1.4 CC1CCCC1=O MCULE-3710290162 [0,1,0,1,0,0|1,0,0]=3 6027 B7R1.4 CC1CCNC1=O MCULE-7799644249 [0,1,0,1,0,0|1,0,1]=4 6028 B7R1.4 CC1CCOC1=O MCULE-2223078294 [0,1,0,1,0,0|0,0,1]=3 6029 B7R1.4 CC1CNCC1=O MCULE-2728909327 [0,1,0,1,0,0|1,0,0]=3 6030 B7R1.4 CC1CNCC1=O MCULE-9172381840 [0,1,0,1,0,0|1,0,0]=3 6031 B7R1.4 CC1COCC1=O MCULE-8115238635 [0,1,0,1,0,0|0,0,0]=2 6032 B7R1.4 CC1COCC1N MCULE-5453471722 [0,1,0,1,0,0|1,0,1]=4 6033 B7R1.4 CC1COCC1N MCULE-6647217023 [0,1,0,1,0,0|1,0,1]=4 6034 B7R1.4 CC1COCC1O MCULE-5925280081 [0,1,0,1,0,0|0,0,2]=4 6035 B7R1.4 CC1CON=C1N MCULE-8845082604 [0,1,0,1,0,0|2,0,0]=4 6036 B7R1.4 CC1CSCC1=O MCULE-5611423322 [0,1,0,1,0,0|0,1,0]=3 6037 B7R1.4 CC1NCCC1=O MCULE-4206844406 [0,1,0,1,0,0|1,0,0]=3 6038 B7R1.4 CC1NCCC1=O MCULE-7025918222 [0,1,0,1,0,0|1,0,0]=3 6039 B7R1.4 CC1OCCC1=O MCULE-8278816952 [0,1,0,1,0,0|0,0,0]=2 6040 B7R1.4 CC1OCCC1N MCULE-4343663724 [0,1,0,1,0,0|1,0,1]=4 6041 B7R1.4 CC1OCCC1N MCULE-9003879039 [0,1,0,1,0,0|1,0,1]=4 6042 B7R1.4 CC1OCCC1O MCULE-6904695721 [0,1,0,1,0,0|0,0,2]=4 6043 B7R1.4 CC1OCCC1S MCULE-9127694888 [0,1,0,1,0,0|0,1,1]=4 6044 B7R1.4 CC1SCCC1=O MCULE-5264322365 [0,1,0,1,0,0|0,1,0]=3 6045 B7R1.4 CN1CCCC1=O MCULE-1381506705 [0,1,0,1,0,0|1,0,0]=3 6046 B7R1.4 CN1CCCC1=S MCULE-1990879544 [0,1,0,1,0,0|1,1,0]=4 6047 B7R1.4 CN1CCNC1=O MCULE-9774864412 [0,1,0,1,0,0|2,0,0]=4 6048 B7R1.4 CN1CCOC1=O MCULE-7467321799 [0,1,0,1,0,0|1,0,0]=3 6049 B7R1.4 CN1CNCC1=O MCULE-2252466841 [0,1,0,1,0,0|2,0,0]=4 6050 B7R1.4 CN1N=CCC1=O MCULE-2362806196 [0,1,0,1,0,0|1,0,1]=4 6051 B7R1.4 C[C@@H]1CCNC1=O MCULE-1037883660 [0,1,0,1,0,0|1,0,1]=4 6052 B7R1.4 C[C@@H]1COC[C@@H]1O MCULE-3198029643 [0,1,0,1,0,0|0,0,2]=4 6053 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-1145772262 [0,1,0,1,0,0|1,0,1]=4 6054 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-6639849267 [0,1,0,1,0,0|1,0,1]=4 6055 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-9659959713 [0,1,0,1,0,0|1,0,1]=4 6056 B7R1.4 C[C@@H]1COC[C@H]1O MCULE-1967963278 [0,1,0,1,0,0|0,0,2]=4 6057 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-5910807847 [0,1,0,1,0,0|1,0,1]=4 6058 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-7586038907 [0,1,0,1,0,0|1,0,1]=4 6059 B7R1.4 C[C@H]1CCNC1=O MCULE-9500360544 [0,1,0,1,0,0|1,0,1]=4 6060 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-3765921602 [0,1,0,1,0,0|0,0,2]=4 6061 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-5201903195 [0,1,0,1,0,0|0,0,2]=4 6062 B7R1.4 C[C@H]1COC[C@H]1O MCULE-2974083166 [0,1,0,1,0,0|0,0,2]=4 6063 B7R1.4 C[C@H]1COC[C@H]1O MCULE-6725207001 [0,1,0,1,0,0|0,0,2]=4 6064 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-1432785321 [0,1,0,1,0,0|1,0,1]=4 6065 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-3008045787 [0,1,0,1,0,0|1,0,1]=4 6066 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-7656776924 [0,1,0,1,0,0|1,0,1]=4 6067 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-8087379612 [0,1,0,1,0,0|1,0,1]=4 6068 B7R1.4 ClC1CCOC1Cl MCULE-1186010832 [0,1,0,1,0,0|1,0,1]=4 6069 B7R1.4 NC1=CCOC1=O MCULE-9089854091 [0,1,0,1,0,0|1,0,1]=4 6070 B7R1.4 NC1CCCC1=O MCULE-3654949473 [0,1,0,1,0,0|1,0,0]=3 6071 B7R1.4 NC1CCCC1=O MCULE-6579965788 [0,1,0,1,0,0|1,0,0]=3 6072 B7R1.4 NC1CCNC1=O MCULE-2061829370 [0,1,0,1,0,0|2,0,0]=4 6073 B7R1.4 NC1CCNC1=O MCULE-4272585488 [0,1,0,1,0,0|2,0,0]=4 6074 B7R1.4 NC1CCOC1=O MCULE-1011670330 [0,1,0,1,0,0|1,0,1]=4 6075 B7R1.4 NC1CCOC1=O MCULE-1366805966 [0,1,0,1,0,0|1,0,1]=4 6076 B7R1.4 NC1CCOC1=O MCULE-1874490478 [0,1,0,1,0,0|1,0,1]=4 6077 B7R1.4 NC1CCOC1=O MCULE-4434379753 [0,1,0,1,0,0|1,0,1]=4 6078 B7R1.4 NC1CCOC1=O MCULE-7302633352 [0,1,0,1,0,0|1,0,1]=4 6079 B7R1.4 NC1CCOC1=O MCULE-8009953591 [0,1,0,1,0,0|1,0,1]=4 6080 B7R1.4 NC1CCSC1=O MCULE-5181497015 [0,1,0,1,0,0|2,0,0]=4 6081 B7R1.4 NC1CCSC1=O MCULE-8775141567 [0,1,0,1,0,0|2,0,0]=4 6082 B7R1.4 NC1COCC1Br MCULE-5821692966 [0,1,0,1,0,0|1,0,1]=4 6083 B7R1.4 NC1COCC1F MCULE-5032224318 [0,1,0,1,0,0|1,0,1]=4 6084 B7R1.4 NC1COCC1F MCULE-8302920845 [0,1,0,1,0,0|1,0,1]=4 6085 B7R1.4 NC1COCC1N MCULE-1202195361 [0,1,0,1,0,0|1,0,1]=4 6086 B7R1.4 NC1COCC1N MCULE-4117465167 [0,1,0,1,0,0|1,0,1]=4 6087 B7R1.4 NC1COCC1O MCULE-3115911209 [0,1,0,1,0,0|0,0,2]=4 6088 B7R1.4 NC1COCC1O MCULE-9837103399 [0,1,0,1,0,0|0,0,2]=4 6089 B7R1.4 NC1CONC1=O MCULE-3118867985 [0,1,0,1,0,0|1,0,0]=3 6090 B7R1.4 NC1CONC1=O MCULE-3159218372 [0,1,0,1,0,0|1,0,0]=3 6091 B7R1.4 NN1CCCC1=O MCULE-2994786381 [0,1,0,1,0,0|2,0,0]=4 6092 B7R1.4 NN1CCCC1=O MCULE-5599329775 [0,1,0,1,0,0|2,0,0]=4 6093 B7R1.4 NN1CCOC1=O MCULE-7407834106 [0,1,0,1,0,0|2,0,0]=4 6094 B7R1.4 NN1CCOC1=O MCULE-8091613930 [0,1,0,1,0,0|2,0,0]=4 6095 B7R1.4 N[C@@H]1CCNC1=O MCULE-2357766642 [0,1,0,1,0,0|2,0,0]=4 6096 B7R1.4 N[C@@H]1CCNC1=O MCULE-9089591546 [0,1,0,1,0,0|2,0,0]=4 6097 B7R1.4 N[C@@H]1CCNC1=O MCULE-9558758567 [0,1,0,1,0,0|2,0,0]=4 6098 B7R1.4 N[C@@H]1CCNC1=O MCULE-9668255740 [0,1,0,1,0,0|2,0,0]=4 6099 B7R1.4 N[C@@H]1CCOC1=O MCULE-1027751896 [0,1,0,1,0,0|1,0,1]=4 6100 B7R1.4 N[C@@H]1CCOC1=O MCULE-4034349263 [0,1,0,1,0,0|1,0,1]=4 6101 B7R1.4 N[C@@H]1CCOC1=O MCULE-8790782772 [0,1,0,1,0,0|1,0,1]=4 6102 B7R1.4 N[C@@H]1CCOC1=O MCULE-9300265861 [0,1,0,1,0,0|1,0,1]=4 6103 B7R1.4 N[C@@H]1CCSC1=O MCULE-1269968791 [0,1,0,1,0,0|2,0,0]=4 6104 B7R1.4 N[C@@H]1CCSC1=O MCULE-5374422420 [0,1,0,1,0,0|2,0,0]=4 6105 B7R1.4 N[C@@H]1CCSC1=O MCULE-8203732076 [0,1,0,1,0,0|2,0,0]=4 6106 B7R1.4 N[C@@H]1CCSC1=O MCULE-8418670804 [0,1,0,1,0,0|2,0,0]=4 6107 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-1582887664 [0,1,0,1,0,0|1,0,1]=4 6108 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-3978694929 [0,1,0,1,0,0|1,0,1]=4 6109 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-4503972605 [0,1,0,1,0,0|1,0,1]=4 6110 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-6640537480 [0,1,0,1,0,0|1,0,1]=4 6111 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5625344145 [0,1,0,1,0,0|1,0,1]=4 6112 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5743565778 [0,1,0,1,0,0|1,0,1]=4 6113 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-7916026303 [0,1,0,1,0,0|1,0,1]=4 6114 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-2891920420 [0,1,0,1,0,0|0,0,2]=4 6115 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-5764643856 [0,1,0,1,0,0|0,0,2]=4 6116 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3183837574 [0,1,0,1,0,0|1,0,1]=4 6117 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3329511858 [0,1,0,1,0,0|1,0,1]=4 6118 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3234416434 [0,1,0,1,0,0|1,0,1]=4 6119 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3421021007 [0,1,0,1,0,0|1,0,1]=4 6120 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-1399984261 [0,1,0,1,0,0|0,0,2]=4 6121 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-2321912677 [0,1,0,1,0,0|0,0,2]=4 6122 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-4422404071 [0,1,0,1,0,0|0,0,2]=4 6123 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-7801515292 [0,1,0,1,0,0|0,0,2]=4 6124 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9112718041 [0,1,0,1,0,0|0,0,2]=4 6125 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9447703783 [0,1,0,1,0,0|0,0,2]=4 6126 B7R1.4 N[C@@H]1CONC1=O MCULE-4212827696 [0,1,0,1,0,0|1,0,0]=3 6127 B7R1.4 N[C@@H]1CONC1=O MCULE-6014142329 [0,1,0,1,0,0|1,0,0]=3 6128 B7R1.4 N[C@H]1CCNC1=O MCULE-2327147408 [0,1,0,1,0,0|2,0,0]=4 6129 B7R1.4 N[C@H]1CCNC1=O MCULE-2923469662 [0,1,0,1,0,0|2,0,0]=4 6130 B7R1.4 N[C@H]1CCNC1=O MCULE-5882745021 [0,1,0,1,0,0|2,0,0]=4 6131 B7R1.4 N[C@H]1CCNC1=O MCULE-7846724738 [0,1,0,1,0,0|2,0,0]=4 6132 B7R1.4 N[C@H]1CCOC1=O MCULE-4393293388 [0,1,0,1,0,0|1,0,1]=4 6133 B7R1.4 N[C@H]1CCOC1=O MCULE-4751602783 [0,1,0,1,0,0|1,0,1]=4 6134 B7R1.4 N[C@H]1CCOC1=O MCULE-7924572479 [0,1,0,1,0,0|1,0,1]=4 6135 B7R1.4 N[C@H]1CCOC1=O MCULE-8545644747 [0,1,0,1,0,0|1,0,1]=4 6136 B7R1.4 N[C@H]1CCOC1=O MCULE-8634641228 [0,1,0,1,0,0|1,0,1]=4 6137 B7R1.4 N[C@H]1CCSC1=O MCULE-4497814170 [0,1,0,1,0,0|2,0,0]=4 6138 B7R1.4 N[C@H]1CCSC1=O MCULE-6209097230 [0,1,0,1,0,0|2,0,0]=4 6139 B7R1.4 N[C@H]1CCSC1=O MCULE-6419348515 [0,1,0,1,0,0|2,0,0]=4 6140 B7R1.4 N[C@H]1CCSC1=O MCULE-9091827364 [0,1,0,1,0,0|2,0,0]=4 6141 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-1031359839 [0,1,0,1,0,0|1,0,1]=4 6142 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-6239060869 [0,1,0,1,0,0|1,0,1]=4 6143 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-4495433095 [0,1,0,1,0,0|1,0,1]=4 6144 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-6217406845 [0,1,0,1,0,0|1,0,1]=4 6145 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-9762071646 [0,1,0,1,0,0|1,0,1]=4 6146 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-1604156911 [0,1,0,1,0,0|0,0,2]=4 6147 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-3157811195 [0,1,0,1,0,0|0,0,2]=4 6148 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-4377495223 [0,1,0,1,0,0|0,0,2]=4 6149 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-8412403655 [0,1,0,1,0,0|0,0,2]=4 6150 B7R1.4 N[C@H]1COC[C@H]1F MCULE-7980939593 [0,1,0,1,0,0|1,0,1]=4 6151 B7R1.4 N[C@H]1COC[C@H]1F MCULE-8990550970 [0,1,0,1,0,0|1,0,1]=4 6152 B7R1.4 N[C@H]1COC[C@H]1O MCULE-5907972681 [0,1,0,1,0,0|0,0,2]=4 6153 B7R1.4 N[C@H]1COC[C@H]1O MCULE-7502895716 [0,1,0,1,0,0|0,0,2]=4 6154 B7R1.4 N[C@H]1COC[C@H]1O MCULE-8985833831 [0,1,0,1,0,0|0,0,2]=4 6155 B7R1.4 N[C@H]1COC[C@H]1O MCULE-9971794275 [0,1,0,1,0,0|0,0,2]=4 6156 B7R1.4 N[C@H]1CONC1=O MCULE-4286940154 [0,1,0,1,0,0|1,0,0]=3 6157 B7R1.4 N[C@H]1CONC1=O MCULE-9925977120 [0,1,0,1,0,0|1,0,0]=3 6158 B7R1.4 O=C1CCC=C1Br MCULE-1509582125 [0,1,0,1,0,0|1,0,1]=4 6159 B7R1.4 O=C1CCC=C1I MCULE-2710048446 [0,1,0,1,0,0|1,0,1]=4 6160 B7R1.4 O=C1CCC=C1O MCULE-8745661989 [0,1,0,1,0,0|1,0,1]=4 6161 B7R1.4 O=C1CCCC1=O MCULE-8040167119 [0,1,0,1,0,0|1,0,1]=4 6162 B7R1.4 O=C1CCCC1Br MCULE-3651373380 [0,1,0,1,0,0|1,0,0]=3 6163 B7R1.4 O=C1CCCC1Cl MCULE-7745647260 [0,1,0,1,0,0|1,0,0]=3 6164 B7R1.4 O=C1CCCC1F MCULE-8001765295 [0,1,0,1,0,0|1,0,0]=3 6165 B7R1.4 O=C1CCCC1O MCULE-6795188798 [0,1,0,1,0,0|1,0,0]=3 6166 B7R1.4 O=C1CCNC1=O MCULE-6243503430 [0,1,0,1,0,0|1,0,1]=4 6167 B7R1.4 O=C1NCCC1Br MCULE-5321265801 [0,1,0,1,0,0|2,0,0]=4 6168 B7R1.4 O=C1NCCC1Cl MCULE-1663035789 [0,1,0,1,0,0|2,0,0]=4 6169 B7R1.4 O=C1NCCC1F MCULE-2209899044 [0,1,0,1,0,0|2,0,0]=4 6170 B7R1.4 O=C1NCCC1O MCULE-8818841339 [0,1,0,1,0,0|2,0,0]=4 6171 B7R1.4 O=C1NCCC1O MCULE-9662824811 [0,1,0,1,0,0|2,0,0]=4 6172 B7R1.4 O=C1NCC[C@@H]1O MCULE-3212474164 [0,1,0,1,0,0|2,0,0]=4 6173 B7R1.4 O=C1NCC[C@@H]1O MCULE-7816291255 [0,1,0,1,0,0|2,0,0]=4 6174 B7R1.4 O=C1NCC[C@H]1O MCULE-1281835510 [0,1,0,1,0,0|2,0,0]=4 6175 B7R1.4 O=C1NCC[C@H]1O MCULE-6809356348 [0,1,0,1,0,0|2,0,0]=4 6176 B7R1.4 O=C1OCC=C1Br MCULE-9287853531 [0,1,0,1,0,0|1,0,1]=4 6177 B7R1.4 O=C1OCCC1Br MCULE-8316114331 [0,1,0,1,0,0|1,0,1]=4 6178 B7R1.4 O=C1OCCC1O MCULE-2144002601 [0,1,0,1,0,0|1,0,1]=4 6179 B7R1.4 O=C1OCCC1S MCULE-2130434062 [0,1,0,1,0,0|1,0,1]=4 6180 B7R1.4 O=C1OCC[C@@H]1O MCULE-7764011790 [0,1,0,1,0,0|1,0,1]=4 6181 B7R1.4 O=C1OCC[C@@H]1O MCULE-9001729998 [0,1,0,1,0,0|1,0,1]=4 6182 B7R1.4 O=C1OCC[C@H]1O MCULE-6949645282 [0,1,0,1,0,0|1,0,1]=4 6183 B7R1.4 O=C1OCC[C@H]1O MCULE-7110242636 [0,1,0,1,0,0|1,0,1]=4 6184 B7R1.4 OC1COCC1Br MCULE-8642236751 [0,1,0,1,0,0|0,0,2]=4 6185 B7R1.4 OC1COCC1F MCULE-3255803142 [0,1,0,1,0,0|0,0,2]=4 6186 B7R1.4 OC1COCC1O MCULE-2982401803 [0,1,0,1,0,0|0,0,2]=4 6187 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-2460253154 [0,1,0,1,0,0|0,0,2]=4 6188 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-3624406213 [0,1,0,1,0,0|0,0,2]=4 6189 B7R1.4 O[C@@H]1COC[C@H]1O MCULE-5846282762 [0,1,0,1,0,0|0,0,2]=4 6190 B7R1.4 O[C@H]1COC[C@@H]1F MCULE-7724910066 [0,1,0,1,0,0|0,0,2]=4 6191 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-2140544466 [0,1,0,1,0,0|0,0,2]=4 6192 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-9526811966 [0,1,0,1,0,0|0,0,2]=4 6193 B7R1.4 O[C@H]1COC[C@H]1O MCULE-2862505352 [0,1,0,1,0,0|0,0,2]=4 6194 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-3635591654 [0,1,0,1,0,0|1,0,1]=4 6195 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-5914925477 [0,1,0,1,0,0|1,0,1]=4 6196 B7R1.4 [C@@H]1(COC[C@@H]1N)N MCULE-4324328112 [0,1,0,1,0,0|1,0,1]=4 6197 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-5920046767 [0,1,0,1,0,0|1,0,1]=4 6198 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-6282053067 [0,1,0,1,0,0|1,0,1]=4 6199 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-8432332245 [0,1,0,1,0,0|1,0,1]=4 6200 B7R1.4 [NH3+][C@H]1CCOC1=O MCULE-8903471982 [0,1,0,1,0,0|1,0,1]=4 6201 B7R1.6 OCCC1CCC1 MCULE-1014969390 [0,1,0,1,0,0|1,0,1]=4 6202 B7R1.6 OCCC1CCN1 MCULE-4368379502 [0,1,0,1,0,0|1,0,1]=4 6203 B7R1.6 OCCC1CCO1 MCULE-3323265996 [0,1,0,1,0,0|0,0,2]=4 6204 B7R1.6 OCCC1CNC1 MCULE-1975411420 [0,1,0,1,0,0|1,0,1]=4 6205 B7R1.6 OCCC1CNC1 MCULE-4993890888 [0,1,0,1,0,0|1,0,1]=4 6206 B7R1.6 OCCC1COC1 MCULE-2515762048 [0,1,0,1,0,0|0,0,2]=4 6207 B7R1.6 OCCN1CCC1 MCULE-5517552533 [0,1,0,1,0,0|2,0,0]=4 6208 B7R1.6 OCC[C@@H]1CCN1 MCULE-9567198532 [0,1,0,1,0,0|1,0,1]=4 6209 B7R1.6 OCC[C@@H]1CCO1 MCULE-6606073727 [0,1,0,1,0,0|0,0,2]=4 6210 B7R1.6 OCC[C@H]1CCN1 MCULE-7385668340 [0,1,0,1,0,0|1,0,1]=4 6211 B7R1.6 OCC[C@H]1CCO1 MCULE-4848994972 [0,1,0,1,0,0|0,0,2]=4 6212 B7R1.6 OCC[C@H]1CCO1 MCULE-9787306242 [0,1,0,1,0,0|0,0,2]=4 6213 B7R1.8 CC1CCC1CO MCULE-4677269341 [0,1,0,1,0,0|1,0,1]=4 6214 B7R1.8 CCC1CCC1=O MCULE-5109615435 [0,1,0,1,0,0|1,0,0]=3 6215 B7R1.8 CN1CCC1CO MCULE-3475629266 [0,1,0,1,0,0|2,0,0]=4 6216 B7R1.8 CN1CC[C@@H]1CO MCULE-2590783241 [0,1,0,1,0,0|2,0,0]=4 6217 B7R1.8 CN1CC[C@@H]1CO MCULE-9683847113 [0,1,0,1,0,0|2,0,0]=4 6218 B7R1.8 CN1CC[C@H]1CO MCULE-6507300625 [0,1,0,1,0,0|2,0,0]=4 6219 B7R1.8 CN1CC[C@H]1CO MCULE-9641004134 [0,1,0,1,0,0|2,0,0]=4 6220 B7R1.8 COC1CCC1=O MCULE-6511996246 [0,1,0,1,0,0|2,0,0]=4 6221 B7R1.8 CSC1CCC1=O MCULE-3892720319 [0,1,0,1,0,0|2,0,0]=4 6222 B7R1.8 N#CC1CCC1=O MCULE-3371494435 [0,1,0,1,0,0|1,0,1]=4 6223 B7R1.8 O=C1CCC1CO MCULE-5501600764 [0,1,0,1,0,0|0,0,0]=2 6224 B7R1.8 O=C1CC[C@@H]1CO MCULE-9840363539 [0,1,0,1,0,0|0,0,0]=2 6225 B7R1.8 OCC1CCC1F MCULE-2481035584 [0,1,0,1,0,0|1,0,1]=4 6226 B7R1.8 OCC1CCC1O MCULE-9764745395 [0,1,0,1,0,0|0,0,2]=4 6227 B7R1.8 OC[C@@H]1CC[C@H]1O MCULE-5043281368 [0,1,0,1,0,0|0,0,2]=4 6228 B7R1.8 OC[C@H]1CC[C@H]1O MCULE-1536326248 [0,1,0,1,0,0|0,0,2]=4 6229 B7R1.9 C#CC1CC1CO MCULE-9506693915 [0,1,0,1,0,0|1,0,1]=4 6230 B7R1.9 C#C[C@H]1C[C@H]1CO MCULE-5176741676 [0,1,0,1,0,0|1,0,1]=4 6231 B7R1.9 CCC1CC1CO MCULE-3342087238 [0,1,0,1,0,0|1,0,1]=4 6232 B7R1.9 N#CC1CC1CO MCULE-7679796035 [0,1,0,1,0,0|1,0,1]=4 6233 B7R1.9 NCC1CC1CO MCULE-2679526126 [0,1,0,1,0,0|1,0,1]=4 6234 B7R1.9 NC[C@H]1C[C@@H]1CO MCULE-4100547975 [0,1,0,1,0,0|1,0,1]=4 6235 B7R1.9 NC[C@H]1C[C@H]1CO MCULE-4756509186 [0,1,0,1,0,0|1,0,1]=4 6236 B7R1.9 OCC1CC1CO MCULE-5153064657 [0,1,0,1,0,0|0,0,2]=4 6237 B7R1.9 OC[C@H]1C[C@H]1CO MCULE-9036138013 [0,1,0,1,0,0|0,0,2]=4 6238 B7R1.10 C#CC1CC(=O)C1 MCULE-3858789141 [0,1,0,1,0,0|1,0,0]=3 6239 B7R1.10 C#CC1CC(C1)O MCULE-6127254681 [0,1,0,1,0,0|1,0,1]=4 6240 B7R1.10 C=C1CC(C1)C#N MCULE-9330463463 [0,1,0,1,0,0|2,0,0]=4 6241 B7R1.10 C=C1CC(C1)CBr MCULE-5306604568 [0,1,0,1,0,0|2,0,0]=4 6242 B7R1.10 C=C1CC(C1)CN MCULE-1227151583 [0,1,0,1,0,0|2,0,0]=4 6243 B7R1.10 C=C1CC(C1)CO MCULE-6295731045 [0,1,0,1,0,0|1,0,0]=3 6244 B7R1.10 C=C1CC(C1)NC MCULE-3988893291 [0,1,0,1,0,0|2,0,0]=4 6245 B7R1.10 C=CC1CC(=O)C1 MCULE-2741892250 [0,1,0,1,0,0|1,0,0]=3 6246 B7R1.10 C=CC1CC(=O)N1 MCULE-2790457728 [0,1,0,1,0,0|1,0,1]=4 6247 B7R1.10 CC1CC(C1)C=O MCULE-1258886786 [0,1,0,1,0,0|1,0,1]=4 6248 B7R1.10 CC1CC(C1)CO MCULE-5730978355 [0,1,0,1,0,0|1,0,1]=4 6249 B7R1.10 CCC1CC(=O)C1 MCULE-6356390328 [0,1,0,1,0,0|1,0,0]=3 6250 B7R1.10 CCN1CC(C1)O MCULE-6471655695 [0,1,0,1,0,0|2,0,0]=4 6251 B7R1.10 CCN1CC(C1)O MCULE-9317904836 [0,1,0,1,0,0|2,0,0]=4 6252 B7R1.10 CN1CC(C1)CO MCULE-7263385340 [0,1,0,1,0,0|2,0,0]=4 6253 B7R1.10 CN1CC(C1)CO MCULE-8892079014 [0,1,0,1,0,0|2,0,0]=4 6254 B7R1.10 CNC1CC(C1)O MCULE-1360972312 [0,1,0,1,0,0|1,0,1]=4 6255 B7R1.10 CNC1CC(C1)O MCULE-1798280109 [0,1,0,1,0,0|1,0,1]=4 6256 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-2573139583 [0,1,0,1,0,0|1,0,1]=4 6257 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-8240672064 [0,1,0,1,0,0|1,0,1]=4 6258 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-1676114682 [0,1,0,1,0,0|1,0,1]=4 6259 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-5219886186 [0,1,0,1,0,0|1,0,1]=4 6260 B7R1.10 COC1CC(=O)C1 MCULE-3488458490 [0,1,0,1,0,0|0,0,0]=2 6261 B7R1.10 COC1CC(C1)Br MCULE-8691368603 [0,1,0,1,0,0|1,0,1]=4 6262 B7R1.10 COC1CC(C1)N MCULE-1660819417 [0,1,0,1,0,0|1,0,1]=4 6263 B7R1.10 COC1CC(C1)N MCULE-8999221377 [0,1,0,1,0,0|1,0,1]=4 6264 B7R1.10 COC1CC(C1)O MCULE-6762585493 [0,1,0,1,0,0|0,0,2]=4 6265 B7R1.10 CO[C@H]1C[C@@H](C1)Br MCULE-1579786868 [0,1,0,1,0,0|1,0,1]=4 6266 B7R1.10 CO[C@H]1C[C@@H](C1)N MCULE-7191327129 [0,1,0,1,0,0|1,0,1]=4 6267 B7R1.10 CO[C@H]1C[C@@H](C1)N MCULE-8453539406 [0,1,0,1,0,0|1,0,1]=4 6268 B7R1.10 CO[C@H]1C[C@@H](C1)O MCULE-8355585959 [0,1,0,1,0,0|0,0,2]=4 6269 B7R1.10 CO[C@H]1C[C@H](C1)N MCULE-1470713902 [0,1,0,1,0,0|1,0,1]=4 6270 B7R1.10 CO[C@H]1C[C@H](C1)N MCULE-7213635913 [0,1,0,1,0,0|1,0,1]=4 6271 B7R1.10 CO[C@H]1C[C@H](C1)O MCULE-4960775262 [0,1,0,1,0,0|0,0,2]=4 6272 B7R1.10 CSC1CC(=O)C1 MCULE-4578180421 [0,1,0,1,0,0|0,1,0]=3 6273 B7R1.10 CSC1CC(C1)O MCULE-1605912153 [0,1,0,1,0,0|0,1,1]=4 6274 B7R1.10 N#CC1CC(=O)C1 MCULE-7054848642 [0,1,0,1,0,0|1,0,0]=3 6275 B7R1.10 N#CC1CC(C1)O MCULE-4680091192 [0,1,0,1,0,0|1,0,1]=4 6276 B7R1.10 N#C[C@H]1C[C@@H](C1)O MCULE-1011646509 [0,1,0,1,0,0|1,0,1]=4 6277 B7R1.10 N#C[C@H]1C[C@H](C1)O MCULE-9751568094 [0,1,0,1,0,0|1,0,1]=4 6278 B7R1.10 NC1CC(C1)CO MCULE-4549811698 [0,1,0,1,0,0|1,0,1]=4 6279 B7R1.10 NC1CC(C1)CO MCULE-9310533439 [0,1,0,1,0,0|1,0,1]=4 6280 B7R1.10 NCC1CC(=O)C1 MCULE-2475090953 [0,1,0,1,0,0|1,0,0]=3 6281 B7R1.10 NCC1CC(=O)C1 MCULE-3448735299 [0,1,0,1,0,0|1,0,0]=3 6282 B7R1.10 NCC1CC(=O)N1 MCULE-6099913032 [0,1,0,1,0,0|1,0,0]=3 6283 B7R1.10 NCC1CC(C1)O MCULE-1448807479 [0,1,0,1,0,0|1,0,1]=4 6284 B7R1.10 NCC1CC(C1)O MCULE-5095960848 [0,1,0,1,0,0|1,0,1]=4 6285 B7R1.10 NC[C@H]1C[C@@H](C1)O MCULE-2155101378 [0,1,0,1,0,0|1,0,1]=4 6286 B7R1.10 NC[C@H]1C[C@@H](C1)O MCULE-3237212031 [0,1,0,1,0,0|1,0,1]=4 6287 B7R1.10 NC[C@H]1C[C@H](C1)O MCULE-3137766844 [0,1,0,1,0,0|1,0,1]=4 6288 B7R1.10 NC[C@H]1C[C@H](C1)O MCULE-6173771659 [0,1,0,1,0,0|1,0,1]=4 6289 B7R1.10 NNC1CC(C1)O MCULE-5994485672 [0,1,0,1,0,0|1,0,1]=4 6290 B7R1.10 NN[C@H]1C[C@@H](C1)O MCULE-7299068166 [0,1,0,1,0,0|1,0,1]=4 6291 B7R1.10 NN[C@H]1C[C@H](C1)O MCULE-6067864594 [0,1,0,1,0,0|1,0,1]=4 6292 B7R1.10 NN[C@H]1C[C@H](C1)O MCULE-8225790345 [0,1,0,1,0,0|1,0,1]=4 6293 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-1976271596 [0,1,0,1,0,0|1,0,1]=4 6294 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-2004610084 [0,1,0,1,0,0|1,0,1]=4 6295 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-3406959231 [0,1,0,1,0,0|1,0,1]=4 6296 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-9771399616 [0,1,0,1,0,0|1,0,1]=4 6297 B7R1.10 O=C1CC(C1)CBr MCULE-3146426428 [0,1,0,1,0,0|1,0,0]=3 6298 B7R1.10 O=C1CC(C1)CCl MCULE-9945216137 [0,1,0,1,0,0|1,0,0]=3 6299 B7R1.10 O=C1CC(C1)CF MCULE-5064337976 [0,1,0,1,0,0|1,0,0]=3 6300 B7R1.10 O=C1CC(C1)CO MCULE-6785243243 [0,1,0,1,0,0|0,0,0]=2 6301 B7R1.10 O=C1CC(N1)CI MCULE-8223453504 [0,1,0,1,0,0|1,0,0]=3 6302 B7R1.10 O=C1CC(N1)CO MCULE-5966757004 [0,1,0,1,0,0|0,0,0]=2 6303 B7R1.10 O=C1CC(N1)CO MCULE-7672639952 [0,1,0,1,0,0|0,0,0]=2 6304 B7R1.10 O=C1CC(O1)CBr MCULE-1451058371 [0,1,0,1,0,0|1,0,0]=3 6305 B7R1.10 O=C1C[C@@H](N1)CO MCULE-7235908958 [0,1,0,1,0,0|0,0,0]=2 6306 B7R1.10 O=C1C[C@@H](N1)CO MCULE-9940834935 [0,1,0,1,0,0|0,0,0]=2 6307 B7R1.10 O=C1C[C@H](N1)CO MCULE-1643787736 [0,1,0,1,0,0|0,0,0]=2 6308 B7R1.10 OC1CC(C1)CBr MCULE-8641406432 [0,1,0,1,0,0|1,0,1]=4 6309 B7R1.10 OC1CC(C1)CF MCULE-9152872996 [0,1,0,1,0,0|1,0,1]=4 6310 B7R1.10 OCC1CC(C1)Br MCULE-6426656913 [0,1,0,1,0,0|1,0,1]=4 6311 B7R1.10 OCC1CC(C1)Cl MCULE-8102550006 [0,1,0,1,0,0|1,0,1]=4 6312 B7R1.10 OCC1CC(C1)F MCULE-8343173774 [0,1,0,1,0,0|1,0,1]=4 6313 B7R1.10 OCC1CC(C1)O MCULE-3885216336 [0,1,0,1,0,0|0,0,2]=4 6314 B7R1.10 OC[C@H]1C[C@H](C1)O MCULE-2350233032 [0,1,0,1,0,0|0,0,2]=4 6315 B7R1.10 O[C@H]1C[C@H](C1)CF MCULE-2417083162 [0,1,0,1,0,0|1,0,1]=4 6316 B7R1.15 CC1CC(=O)C1C MCULE-1068922218 [0,1,0,1,0,0|1,0,0]=3 6317 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2032555036 [0,1,0,1,0,0|2,0,0]=4 6318 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2738127555 [0,1,0,1,0,0|2,0,0]=4 6319 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-5044901082 [0,1,0,1,0,0|2,0,0]=4 6320 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-7632990759 [0,1,0,1,0,0|2,0,0]=4 6321 B7R1.21 CC1(CC1)CCO MCULE-4173763460 [0,1,0,1,0,0|1,0,1]=4 6322 B7R1.21 CC1(N=N1)CCO MCULE-6336884717 [0,1,0,1,0,0|1,0,1]=4 6323 B7R1.21 NC1(CC1)CCO MCULE-6023170197 [0,1,0,1,0,0|1,0,1]=4 6324 B7R1.21 NC1(CC1)CCO MCULE-6146864546 [0,1,0,1,0,0|1,0,1]=4 6325 B7R1.21 OCCC1(CC1)O MCULE-9575986419 [0,1,0,1,0,0|0,0,2]=4 6326 B7R1.22 C/C(=N/O)/C1CC1 MCULE-9504873944 [0,1,0,1,0,0|1,0,1]=4 6327 B7R1.22 C1(CO1)C(=O)OC MCULE-1350193594 [0,1,0,1,0,0|0,0,0]=2 6328 B7R1.22 C=CC(=O)C1CC1 MCULE-4167270466 [0,1,0,1,0,0|1,0,1]=4 6329 B7R1.22 CC(=NO)C1CC1 MCULE-2639658638 [0,1,0,1,0,0|1,0,1]=4 6330 B7R1.22 CC(C=O)C1CC1 MCULE-9307079880 [0,1,0,1,0,0|1,0,1]=4 6331 B7R1.22 CC(CO)C1CC1 MCULE-8325587009 [0,1,0,1,0,0|1,0,1]=4 6332 B7R1.22 CCC(=O)C1CC1 MCULE-6231785303 [0,1,0,1,0,0|1,0,0]=3 6333 B7R1.22 CN(C=O)C1CC1 MCULE-4185514369 [0,1,0,1,0,0|2,0,0]=4 6334 B7R1.22 CNC(=O)C1CC1 MCULE-5799863193 [0,1,0,1,0,0|1,0,0]=3 6335 B7R1.22 COC(=N)C1CC1 MCULE-3594886802 [0,1,0,1,0,0|2,0,0]=4 6336 B7R1.22 COC(=N)C1CC1 MCULE-6548060912 [0,1,0,1,0,0|2,0,0]=4 6337 B7R1.22 COC(=O)C1CC1 MCULE-3338113454 [0,1,0,1,0,0|1,0,0]=3 6338 B7R1.22 COC(=O)C1CN1 MCULE-2166427972 [0,1,0,1,0,0|1,0,0]=3 6339 B7R1.22 COC(=O)C1CO1 MCULE-1745412030 [0,1,0,1,0,0|0,0,0]=2 6340 B7R1.22 COC(=O)N1CC1 MCULE-2788788116 [0,1,0,1,0,0|2,0,0]=4 6341 B7R1.22 COC(=O)[C@@H]1CN1 MCULE-1955059175 [0,1,0,1,0,0|1,0,0]=3 6342 B7R1.22 COC(=O)[C@@H]1CN1 MCULE-5011635876 [0,1,0,1,0,0|1,0,0]=3 6343 B7R1.22 COC(=O)[C@@H]1CO1 MCULE-2259836812 [0,1,0,1,0,0|0,0,0]=2 6344 B7R1.22 COC(=O)[C@H]1CN1 MCULE-5882979938 [0,1,0,1,0,0|1,0,0]=3 6345 B7R1.22 COC(=O)[C@H]1CN1 MCULE-8601280412 [0,1,0,1,0,0|1,0,0]=3 6346 B7R1.22 COC(=O)[C@H]1CO1 MCULE-5568309714 [0,1,0,1,0,0|0,0,0]=2 6347 B7R1.22 COC(=O)[C@H]1CO1 MCULE-9432053348 [0,1,0,1,0,0|0,0,0]=2 6348 B7R1.22 ClCC(Cl)C1CO1 MCULE-4739045871 [0,1,0,1,0,0|1,0,1]=4 6349 B7R1.22 NC(CO)C1CC1 MCULE-5154854421 [0,1,0,1,0,0|1,0,1]=4 6350 B7R1.22 NC(CO)C1CC1 MCULE-8775546228 [0,1,0,1,0,0|1,0,1]=4 6351 B7R1.22 NCC(=O)C1CC1 MCULE-1927654168 [0,1,0,1,0,0|1,0,0]=3 6352 B7R1.22 NCC(=O)C1CC1 MCULE-4415662894 [0,1,0,1,0,0|1,0,0]=3 6353 B7R1.22 NNC(=O)C1CC1 MCULE-3608531301 [0,1,0,1,0,0|2,0,0]=4 6354 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5231249344 [0,1,0,1,0,0|1,0,1]=4 6355 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5233980282 [0,1,0,1,0,0|1,0,1]=4 6356 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9664157108 [0,1,0,1,0,0|1,0,1]=4 6357 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9941605288 [0,1,0,1,0,0|1,0,1]=4 6358 B7R1.22 N[C@H](CO)C1CC1 MCULE-3523450080 [0,1,0,1,0,0|1,0,1]=4 6359 B7R1.22 N[C@H](CO)C1CC1 MCULE-6097147899 [0,1,0,1,0,0|1,0,1]=4 6360 B7R1.22 N[C@H](CO)C1CC1 MCULE-9050007019 [0,1,0,1,0,0|1,0,1]=4 6361 B7R1.22 N[C@H](CO)C1CC1 MCULE-9945100855 [0,1,0,1,0,0|1,0,1]=4 6362 B7R1.22 O=C(CBr)C1CC1 MCULE-1037373080 [0,1,0,1,0,0|1,0,0]=3 6363 B7R1.22 O=C(CCl)C1CC1 MCULE-9791345328 [0,1,0,1,0,0|1,0,0]=3 6364 B7R1.22 O=C(CCl)N1CC1 MCULE-3092013537 [0,1,0,1,0,0|2,0,0]=4 6365 B7R1.22 O=C(CO)C1CC1 MCULE-4276266642 [0,1,0,1,0,0|1,0,0]=3 6366 B7R1.22 O=C(NO)C1CC1 MCULE-2299815322 [0,1,0,1,0,0|2,0,0]=4 6367 B7R1.22 OCC(O)C1CC1 MCULE-9694056700 [0,1,0,1,0,0|1,0,1]=4 6368 B7R1.22 [C@H]1(CO1)C(=O)OC MCULE-2114123664 [0,1,0,1,0,0|0,0,0]=2 6369 B7R1.25 CC1(CCC1)C=O MCULE-9513047998 [0,1,0,1,0,0|1,0,1]=4 6370 B7R1.25 CC1(CCO1)CN MCULE-1371408706 [0,1,0,1,0,0|1,0,1]=4 6371 B7R1.25 CC1(CCO1)CO MCULE-6424264752 [0,1,0,1,0,0|0,0,2]=4 6372 B7R1.25 C[C@@]1(CCO1)CN MCULE-8755107224 [0,1,0,1,0,0|1,0,1]=4 6373 B7R1.25 C[C@@]1(CCO1)CO MCULE-4685471926 [0,1,0,1,0,0|0,0,2]=4 6374 B7R1.25 C[C@@]1(CCO1)CO MCULE-5799098537 [0,1,0,1,0,0|0,0,2]=4 6375 B7R1.25 C[C@]1(CCO1)CO MCULE-5749345841 [0,1,0,1,0,0|0,0,2]=4 6376 B7R1.27 CC1(CC1Br)CO MCULE-5286402958 [0,1,0,1,0,0|1,0,1]=4 6377 B7R1.27 CC1(CC1F)CO MCULE-9626513813 [0,1,0,1,0,0|1,0,1]=4 6378 B7R1.27 CC1CC1(C)C=O MCULE-1780701123 [0,1,0,1,0,0|1,0,1]=4 6379 B7R1.12 C=C1CC1C(=O)O MCULE-4330944573 [0,1,0,1,0,0|1,0,1]=4 6380 B7R1.12 CC(=O)C1CC1C MCULE-5857709747 [0,1,0,1,0,0|1,0,0]=3 6381 B7R1.12 CC(=O)[C@@H]1C[C@H]1C MCULE-4367650211 [0,1,0,1,0,0|1,0,0]=3 6382 B7R1.12 CC1=CC1C(=O)O MCULE-6979504623 [0,1,0,1,0,0|1,0,1]=4 6383 B7R1.12 CC1CC1C(=O)Cl MCULE-7645594952 [0,1,0,1,0,0|2,0,0]=4 6384 B7R1.12 CC1CC1C(=O)N MCULE-4145079494 [0,1,0,1,0,0|2,0,0]=4 6385 B7R1.12 CC1CC1C(=O)O MCULE-1757330006 [0,1,0,1,0,0|2,0,0]=4 6386 B7R1.12 CC1SC1C(=O)N MCULE-7010314546 [0,1,0,1,0,0|1,1,0]=4 6387 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-1245851874 [0,1,0,1,0,0|2,0,0]=4 6388 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-9582782871 [0,1,0,1,0,0|2,0,0]=4 6389 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-2621918749 [0,1,0,1,0,0|2,0,0]=4 6390 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-7347988261 [0,1,0,1,0,0|2,0,0]=4 6391 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-4499487863 [0,1,0,1,0,0|2,0,0]=4 6392 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-9300153165 [0,1,0,1,0,0|2,0,0]=4 6393 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-4410115478 [0,1,0,1,0,0|2,0,0]=4 6394 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-6590525761 [0,1,0,1,0,0|2,0,0]=4 6395 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-8070492716 [0,1,0,1,0,0|2,0,0]=4 6396 B7R1.12 NC(=O)C1CC1N MCULE-9433325277 [0,1,0,1,0,0|2,0,0]=4 6397 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F MCULE-2857193174 [0,1,0,1,0,0|2,0,0]=4 6398 B7R1.12 O=C(O)C1CC1Br MCULE-6387317137 [0,1,0,1,0,0|2,0,0]=4 6399 B7R1.12 O=C(O)C1CC1Cl MCULE-8907850405 [0,1,0,1,0,0|2,0,0]=4 6400 B7R1.12 O=C(O)C1CC1F MCULE-8258481986 [0,1,0,1,0,0|2,0,0]=4 6401 B7R1.12 O=C(O)C1CC1I MCULE-9535592263 [0,1,0,1,0,0|2,0,0]=4 6402 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-1882710455 [0,1,0,1,0,0|2,0,0]=4 6403 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-7715660561 [0,1,0,1,0,0|2,0,0]=4 6404 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-7741460434 [0,1,0,1,0,0|2,0,0]=4 6405 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-2594739726 [0,1,0,1,0,0|2,0,0]=4 6406 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-3033770510 [0,1,0,1,0,0|2,0,0]=4 6407 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-6224902495 [0,1,0,1,0,0|2,0,0]=4 6408 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br MCULE-3031410853 [0,1,0,1,0,0|2,0,0]=4 6409 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-1201733028 [0,1,0,1,0,0|2,0,0]=4 6410 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-5963625184 [0,1,0,1,0,0|2,0,0]=4 6411 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-9724617114 [0,1,0,1,0,0|2,0,0]=4 6412 B7R1.12 O=C(O)[C@@H]1C[C@H]1I MCULE-3702576454 [0,1,0,1,0,0|2,0,0]=4 6413 B7R1.12 O=C(O)[C@H]1C[C@@H]1F MCULE-3766204952 [0,1,0,1,0,0|2,0,0]=4 6414 B7R1.12 O=C(O)[C@H]1C[C@@H]1F MCULE-4258983574 [0,1,0,1,0,0|2,0,0]=4 6415 B7R1.12 O=C(O)[C@H]1C[C@H]1Br MCULE-3094747797 [0,1,0,1,0,0|2,0,0]=4 6416 B7R1.12 O=C(O)[C@H]1C[C@H]1F MCULE-7993479857 [0,1,0,1,0,0|2,0,0]=4 6417 B7R1.12 O=C(O)[C@H]1C[C@H]1F MCULE-9922834235 [0,1,0,1,0,0|2,0,0]=4 6418 B7R1.12 O=C(O)[C@H]1C[C@H]1I MCULE-5714437007 [0,1,0,1,0,0|2,0,0]=4 6419 B7R1.12 O=C(O)[C@H]1C[C@H]1I MCULE-8000208987 [0,1,0,1,0,0|2,0,0]=4 6420 B7R1.12 [C@H]1(C[C@H]1C(=O)O)C MCULE-9539625763 [0,1,0,1,0,0|2,0,0]=4 6421 B7R1.16 C=C1CC(C1)(F)F MCULE-4710509042 [0,1,0,1,0,0|2,0,0]=4 6422 B7R1.16 CC1(CC(=O)C1)C MCULE-4306266527 [0,1,0,1,0,0|1,0,0]=3 6423 B7R1.16 CC1(CC(=O)C1)N MCULE-1739432720 [0,1,0,1,0,0|1,0,0]=3 6424 B7R1.16 CC1(CC(=O)C1)N MCULE-2529462721 [0,1,0,1,0,0|1,0,0]=3 6425 B7R1.16 CC1(CC(=O)N1)C MCULE-5555898363 [0,1,0,1,0,0|2,0,0]=4 6426 B7R1.16 CC1(CC(C1)N)O MCULE-4731102959 [0,1,0,1,0,0|1,0,1]=4 6427 B7R1.16 CC1(CC(C1)N)O MCULE-9310046804 [0,1,0,1,0,0|1,0,1]=4 6428 B7R1.16 CC1(CC(C1)O)C MCULE-3648206950 [0,1,0,1,0,0|1,0,1]=4 6429 B7R1.16 CC1(CC(C1)O)N MCULE-1038746550 [0,1,0,1,0,0|1,0,1]=4 6430 B7R1.16 CC1(CC(C1)O)N MCULE-9322183723 [0,1,0,1,0,0|1,0,1]=4 6431 B7R1.16 C[C@@]1(C[C@@H](C1)N)O MCULE-2987812366 [0,1,0,1,0,0|1,0,1]=4 6432 B7R1.16 C[C@@]1(C[C@@H](C1)N)O MCULE-7967573609 [0,1,0,1,0,0|1,0,1]=4 6433 B7R1.16 C[C@@]1(C[C@@H](C1)O)N MCULE-6217394176 [0,1,0,1,0,0|1,0,1]=4 6434 B7R1.16 C[C@@]1(C[C@@H](C1)O)N MCULE-8859357729 [0,1,0,1,0,0|1,0,1]=4 6435 B7R1.16 C[C@@]1(C[C@H](C1)N)O MCULE-4536582361 [0,1,0,1,0,0|1,0,1]=4 6436 B7R1.16 C[C@@]1(C[C@H](C1)N)O MCULE-9705176834 [0,1,0,1,0,0|1,0,1]=4 6437 B7R1.16 C[C@@]1(C[C@H](C1)O)N MCULE-4910539354 [0,1,0,1,0,0|1,0,1]=4 6438 B7R1.16 C[C@@]1(C[C@H](C1)O)N MCULE-5459432358 [0,1,0,1,0,0|1,0,1]=4 6439 B7R1.16 NC1CS(=O)(=O)C1 MCULE-1434085604 [0,1,0,1,0,0|2,0,0]=4 6440 B7R1.16 NC1CS(=O)(=O)C1 MCULE-8044332494 [0,1,0,1,0,0|2,0,0]=4 6441 B7R1.16 O=C1CC(C1)(F)F MCULE-6471478479 [0,1,0,1,0,0|1,0,0]=3 6442 B7R1.16 O=C1CS(=O)(=O)C1 MCULE-9020745203 [0,1,0,1,0,0|1,0,1]=4 6443 B7R1.16 O=S1(=O)CC(C1)Br MCULE-9320976413 [0,1,0,1,0,0|2,0,0]=4 6444 B7R1.16 O=S1(=O)CC(C1)Cl MCULE-7312536397 [0,1,0,1,0,0|2,0,0]=4 6445 B7R1.16 O=S1(=O)CC(C1)O MCULE-6917376424 [0,1,0,1,0,0|1,0,0]=3 6446 B7R1.16 OC1CC(C1)(F)F MCULE-8854780666 [0,1,0,1,0,0|1,0,1]=4 6447 B7R1.20 CC(=O)CC1CC1 MCULE-3465510397 [0,1,0,1,0,0|1,0,0]=3 6448 B7R1.20 CC(=O)NC1CC1 MCULE-7553641762 [0,1,0,1,0,0|1,0,0]=3 6449 B7R1.20 CC(C)CC1CO1 MCULE-7259971470 [0,1,0,1,0,0|1,0,1]=4 6450 B7R1.20 CC(O)CC1CC1 MCULE-1952195648 [0,1,0,1,0,0|1,0,1]=4 6451 B7R1.20 CN(C)CC1CO1 MCULE-3116266625 [0,1,0,1,0,0|2,0,0]=4 6452 B7R1.20 C[C@@H](O)CC1CC1 MCULE-2616688976 [0,1,0,1,0,0|1,0,1]=4 6453 B7R1.20 C[C@H](O)CC1CC1 MCULE-5001414363 [0,1,0,1,0,0|1,0,1]=4 6454 B7R1.20 NC(=O)CC1CC1 MCULE-3835601763 [0,1,0,1,0,0|2,0,0]=4 6455 B7R1.20 NC(=O)CC1CO1 MCULE-9954364706 [0,1,0,1,0,0|1,0,0]=3 6456 B7R1.20 NC(=O)NC1CC1 MCULE-4338833542 [0,1,0,1,0,0|2,0,0]=4 6457 B7R1.20 O=C(Cl)CC1CC1 MCULE-9640878584 [0,1,0,1,0,0|2,0,0]=4 6458 B7R1.20 O=C(Cl)NC1CC1 MCULE-8107862020 [0,1,0,1,0,0|2,0,0]=4 6459 B7R1.20 O=C(Cl)OC1CC1 MCULE-4373365407 [0,1,0,1,0,0|2,0,0]=4 6460 B7R1.20 O=C(O)CC1CC1 MCULE-3026300598 [0,1,0,1,0,0|2,0,0]=4 6461 B7R1.20 O=C(O)CC1CO1 MCULE-5322663834 [0,1,0,1,0,0|1,0,0]=3 6462 B7R1.20 O=C(O)C[C@H]1CO1 MCULE-2418249972 [0,1,0,1,0,0|1,0,0]=3 6463 B7R1.17 CC1(CCC1O)C MCULE-7385359414 [0,1,0,1,0,0|1,0,1]=4 6464 B7R1.17 CC1(CC[C@@H]1O)C MCULE-9766955692 [0,1,0,1,0,0|1,0,1]=4 6465 B7R1.17 CC1(NCC1O)C MCULE-5840741801 [0,1,0,1,0,0|1,0,1]=4 6466 B7R1.17 CC1(NCC1O)C MCULE-7044413523 [0,1,0,1,0,0|1,0,1]=4 6467 B7R1.17 CC1(OCC1N)C MCULE-2792085100 [0,1,0,1,0,0|1,0,1]=4 6468 B7R1.17 CC1(OCC1O)C MCULE-4679216060 [0,1,0,1,0,0|1,0,1]=4 6469 B7R1.17 CC1(OC[C@@H]1N)C MCULE-1806722832 [0,1,0,1,0,0|1,0,1]=4 6470 B7R1.18 C1(CCN1)C(=O)O MCULE-9324355017 [0,1,0,1,0,0|2,0,0]=4 6471 B7R1.18 CC(=O)C1CCC1 MCULE-5770046789 [0,1,0,1,0,0|1,0,0]=3 6472 B7R1.18 CC(=O)C1CNC1 MCULE-2354733934 [0,1,0,1,0,0|1,0,0]=3 6473 B7R1.18 CC(=O)C1CNC1 MCULE-3110609785 [0,1,0,1,0,0|1,0,0]=3 6474 B7R1.18 CC(=O)C1CNC1 MCULE-4112322251 [0,1,0,1,0,0|1,0,0]=3 6475 B7R1.18 CC(=O)C1COC1 MCULE-3416774210 [0,1,0,1,0,0|0,0,0]=2 6476 B7R1.18 CC(=O)N1C=CC1 MCULE-4207230175 [0,1,0,1,0,0|1,0,1]=4 6477 B7R1.18 CC(=O)N1CCC1 MCULE-6467100562 [0,1,0,1,0,0|1,0,0]=3 6478 B7R1.18 CC(N)C1COC1 MCULE-1380624257 [0,1,0,1,0,0|1,0,1]=4 6479 B7R1.18 CC(O)C1COC1 MCULE-4981198639 [0,1,0,1,0,0|0,0,2]=4 6480 B7R1.18 CS(=O)C1CNC1 MCULE-1896314246 [0,1,0,1,0,0|2,0,0]=4 6481 B7R1.18 CS(=O)C1CNC1 MCULE-3655021594 [0,1,0,1,0,0|2,0,0]=4 6482 B7R1.18 C[C@@H](N)C1COC1 MCULE-7669553866 [0,1,0,1,0,0|1,0,1]=4 6483 B7R1.18 C[C@@H](O)C1COC1 MCULE-5223611242 [0,1,0,1,0,0|0,0,2]=4 6484 B7R1.18 C[C@@H](O)C1COC1 MCULE-5819578881 [0,1,0,1,0,0|0,0,2]=4 6485 B7R1.18 C[C@H](N)C1COC1 MCULE-8337949293 [0,1,0,1,0,0|1,0,1]=4 6486 B7R1.18 C[C@H](O)C1COC1 MCULE-1396791034 [0,1,0,1,0,0|0,0,2]=4 6487 B7R1.18 C[C@H](O)C1COC1 MCULE-8805369596 [0,1,0,1,0,0|0,0,2]=4 6488 B7R1.18 NC(=O)C1CCC1 MCULE-5151176129 [0,1,0,1,0,0|2,0,0]=4 6489 B7R1.18 NC(=O)C1CCN1 MCULE-1856696035 [0,1,0,1,0,0|2,0,0]=4 6490 B7R1.18 NC(=O)C1CCN1 MCULE-5757704016 [0,1,0,1,0,0|2,0,0]=4 6491 B7R1.18 NC(=O)C1CNC1 MCULE-2319282799 [0,1,0,1,0,0|2,0,0]=4 6492 B7R1.18 NC(=O)C1CNC1 MCULE-4985073048 [0,1,0,1,0,0|2,0,0]=4 6493 B7R1.18 NC(=O)C1CNC1 MCULE-8796959516 [0,1,0,1,0,0|2,0,0]=4 6494 B7R1.18 NC(=O)C1COC1 MCULE-1077689713 [0,1,0,1,0,0|1,0,0]=3 6495 B7R1.18 NC(=O)N1CCC1 MCULE-1594728830 [0,1,0,1,0,0|2,0,0]=4 6496 B7R1.18 NC(=O)[C@H]1CCN1 MCULE-7187425143 [0,1,0,1,0,0|2,0,0]=4 6497 B7R1.18 O=C(Cl)C1CCC1 MCULE-2155859428 [0,1,0,1,0,0|2,0,0]=4 6498 B7R1.18 O=C(Cl)N1CCC1 MCULE-8313088104 [0,1,0,1,0,0|2,0,0]=4 6499 B7R1.18 O=C(O)C1=CCC1 MCULE-4244912351 [0,1,0,1,0,0|2,0,0]=4 6500 B7R1.18 O=C(O)C1CCC1 MCULE-2498509888 [0,1,0,1,0,0|2,0,0]=4 6501 B7R1.18 O=C(O)C1CCN1 MCULE-1336085891 [0,1,0,1,0,0|2,0,0]=4 6502 B7R1.18 O=C(O)C1CCN1 MCULE-6501890131 [0,1,0,1,0,0|2,0,0]=4 6503 B7R1.18 O=C(O)C1CCN1 MCULE-7647115314 [0,1,0,1,0,0|2,0,0]=4 6504 B7R1.18 O=C(O)C1CCO1 MCULE-6065911736 [0,1,0,1,0,0|1,0,0]=3 6505 B7R1.18 O=C(O)C1CCO1 MCULE-9296370119 [0,1,0,1,0,0|1,0,0]=3 6506 B7R1.18 O=C(O)C1CNC1 MCULE-2350328355 [0,1,0,1,0,0|2,0,0]=4 6507 B7R1.18 O=C(O)C1CNC1 MCULE-7890374869 [0,1,0,1,0,0|2,0,0]=4 6508 B7R1.18 O=C(O)C1COC1 MCULE-2530431165 [0,1,0,1,0,0|1,0,0]=3 6509 B7R1.18 O=C(O)C1CSC1 MCULE-4019152056 [0,1,0,1,0,0|1,1,0]=4 6510 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2126306157 [0,1,0,1,0,0|2,0,0]=4 6511 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2597576629 [0,1,0,1,0,0|2,0,0]=4 6512 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-6006656004 [0,1,0,1,0,0|2,0,0]=4 6513 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-7241612713 [0,1,0,1,0,0|2,0,0]=4 6514 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-5117442811 [0,1,0,1,0,0|1,0,0]=3 6515 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-8116248615 [0,1,0,1,0,0|1,0,0]=3 6516 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-3254184046 [0,1,0,1,0,0|2,0,0]=4 6517 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5162570273 [0,1,0,1,0,0|2,0,0]=4 6518 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5488052558 [0,1,0,1,0,0|2,0,0]=4 6519 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-8240936495 [0,1,0,1,0,0|2,0,0]=4 6520 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-5499247834 [0,1,0,1,0,0|1,0,0]=3 6521 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-7468207073 [0,1,0,1,0,0|1,0,0]=3 6522 B7R1.18 O=N(=O)C1COC1 MCULE-1243582303 [0,1,0,1,0,0|2,0,0]=4 6523 B7R1.19 CC(=O)C1(CC1)Br MCULE-6185731473 [0,1,0,1,0,0|1,0,0]=3 6524 B7R1.19 CC(=O)C1(CC1)C MCULE-8745387740 [0,1,0,1,0,0|1,0,0]=3 6525 B7R1.19 CC(=O)C1(CC1)Cl MCULE-5975776904 [0,1,0,1,0,0|1,0,0]=3 6526 B7R1.19 CC(=O)C1(CC1)F MCULE-5848997919 [0,1,0,1,0,0|1,0,0]=3 6527 B7R1.19 CC(=O)C1(CC1)N MCULE-2138315633 [0,1,0,1,0,0|1,0,0]=3 6528 B7R1.19 CC(=O)C1(CC1)N MCULE-4094057841 [0,1,0,1,0,0|1,0,0]=3 6529 B7R1.19 CC(=O)C1(CO1)C MCULE-3263824467 [0,1,0,1,0,0|0,0,0]=2 6530 B7R1.19 CC(C)C1(CO1)C MCULE-6945955143 [0,1,0,1,0,0|1,0,1]=4 6531 B7R1.19 CC1(CC1)C(=O)Cl MCULE-6881294103 [0,1,0,1,0,0|2,0,0]=4 6532 B7R1.19 CC1(CC1)C(=O)N MCULE-7674282751 [0,1,0,1,0,0|2,0,0]=4 6533 B7R1.19 CC1(CC1)C(=O)O MCULE-6220717648 [0,1,0,1,0,0|2,0,0]=4 6534 B7R1.19 CC1(CO1)C(=O)O MCULE-9344660544 [0,1,0,1,0,0|1,0,0]=3 6535 B7R1.19 CC1(CS1)C(=O)N MCULE-5046393193 [0,1,0,1,0,0|1,1,0]=4 6536 B7R1.19 NC(=O)C1(CC1)Br MCULE-5824122510 [0,1,0,1,0,0|2,0,0]=4 6537 B7R1.19 NC(=O)C1(CC1)N MCULE-3982594366 [0,1,0,1,0,0|2,0,0]=4 6538 B7R1.19 NC(=O)C1(CC1)N MCULE-7935338610 [0,1,0,1,0,0|2,0,0]=4 6539 B7R1.19 NC(=O)C1(CC1)O MCULE-6542611632 [0,1,0,1,0,0|2,0,0]=4 6540 B7R1.19 NC1(CC1)C(=O)Cl MCULE-1901749245 [0,1,0,1,0,0|2,0,0]=4 6541 B7R1.19 NC1(CC1)C(=O)Cl MCULE-4354269723 [0,1,0,1,0,0|2,0,0]=4 6542 B7R1.19 NC1(CC1)C(=O)O MCULE-8718774934 [0,1,0,1,0,0|2,0,0]=4 6543 B7R1.19 NC1(CC1)C(=O)O MCULE-8788149299 [0,1,0,1,0,0|2,0,0]=4 6544 B7R1.19 O=C(O)C1(CC1)Br MCULE-9862099846 [0,1,0,1,0,0|2,0,0]=4 6545 B7R1.19 O=C(O)C1(CC1)Cl MCULE-9183003328 [0,1,0,1,0,0|2,0,0]=4 6546 B7R1.19 O=C(O)C1(CC1)F MCULE-1230430743 [0,1,0,1,0,0|2,0,0]=4 6547 B7R1.19 O=C(O)C1(CC1)I MCULE-7977320561 [0,1,0,1,0,0|2,0,0]=4 6548 B7R1.19 O=C(O)C1(CC1)O MCULE-7923609070 [0,1,0,1,0,0|2,0,0]=4 6549 B7R1.23 CC1(CC1CO)Br MCULE-1246890004 [0,1,0,1,0,0|1,0,1]=4 6550 B7R1.23 CC1(CC1CO)C MCULE-3855230422 [0,1,0,1,0,0|1,0,1]=4 6551 B7R1.23 CC1(C[C@@H]1CO)C MCULE-2771980454 [0,1,0,1,0,0|1,0,1]=4 6552 B7R1.23 CC1(C[C@H]1CO)C MCULE-7876524457 [0,1,0,1,0,0|1,0,1]=4 6553 B7R1.23 CC1(OC1CO)C MCULE-5147602353 [0,1,0,1,0,0|0,0,2]=4 6554 B7R1.23 OCC1CC1(Br)Br MCULE-7089012177 [0,1,0,1,0,0|1,0,1]=4 6555 B7R1.23 OCC1CC1(Cl)Cl MCULE-7270696266 [0,1,0,1,0,0|1,0,1]=4 6556 B7R1.23 OCC1CC1(F)F MCULE-7947011827 [0,1,0,1,0,0|1,0,1]=4 6557 B7R1.23 OCC1CC1(F)F MCULE-8758794887 [0,1,0,1,0,0|1,0,1]=4 6558 B7R1.23 OC[C@@H]1CC1(F)F MCULE-7341169417 [0,1,0,1,0,0|1,0,1]=4 6559 B7R1.23 OC[C@@H]1CC1(F)F MCULE-8085476948 [0,1,0,1,0,0|1,0,1]=4 6560 B7R1.23 OC[C@H]1CC1(F)F MCULE-4517768682 [0,1,0,1,0,0|1,0,1]=4 6561 B7R1.23 OC[C@H]1CC1(F)F MCULE-7100712334 [0,1,0,1,0,0|1,0,1]=4 6562 B7R1.7 COCCC1CO1 MCULE-9068008411 [0,1,0,1,0,0|0,0,2]=4 6563 B7R1.7 NOCCC1CC1 MCULE-1304023980 [0,1,0,1,0,0|1,0,1]=4 6564 B7R1.7 NOCCC1CC1 MCULE-8656049274 [0,1,0,1,0,0|1,0,1]=4 6565 B7R1.7 OCCCC1CC1 MCULE-5336501479 [0,1,0,1,0,0|1,0,1]=4 6566 B7R1.7 OCCNC1CC1 MCULE-2068668434 [0,1,0,1,0,0|1,0,1]=4 6567 B7R1.7 OCCOC1CC1 MCULE-8583841482 [0,1,0,1,0,0|1,0,1]=4 6568 B7R1.14 CC1(CCOC1)N MCULE-1997756007 [0,1,0,1,0,0|1,0,1]=4 6569 B7R1.14 CC1(CCOC1)N MCULE-5807249895 [0,1,0,1,0,0|1,0,1]=4 6570 B7R1.14 CC1(CCOC1)O MCULE-5065022086 [0,1,0,1,0,0|0,0,2]=4 6571 B7R1.14 CC1(NCCO1)C MCULE-5384206883 [0,1,0,1,0,0|1,0,1]=4 6572 B7R1.14 CC1(OCCO1)C MCULE-3382136459 [0,1,0,1,0,0|1,0,1]=4 6573 B7R1.14 N=S1(=O)CCCC1 MCULE-6922708158 [0,1,0,1,0,0|2,0,0]=4 6574 B7R1.14 O=P1(CCCC1)Cl MCULE-9877294162 [0,1,0,1,0,0|2,0,0]=4 6575 B7R1.14 O=P1(OCCO1)Cl MCULE-8220157277 [0,1,0,1,0,0|2,0,0]=4 6576 B7R1.14 O=S1(=O)CCCC1 MCULE-3506686856 [0,1,0,1,0,0|2,0,0]=4 6577 B7R1.14 O=S1(=O)CCCO1 MCULE-4897687828 [0,1,0,1,0,0|2,0,0]=4 6578 B7R1.14 O=S1(=O)NCCO1 MCULE-2978152198 [0,1,0,1,0,0|2,0,0]=4 6579 B7R1.14 O=S1(=O)OCCO1 MCULE-4563579294 [0,1,0,1,0,0|2,0,0]=4 6580 B7R1.26 CC(C)(C)C1CO1 MCULE-7365554350 [0,1,0,1,0,0|1,0,1]=4 6581 B7R1.26 CC(C)(O)C1CO1 MCULE-7074440148 [0,1,0,1,0,0|0,0,2]=4 6582 B7R1.26 CS(=N)(=O)C1CC1 MCULE-4537651837 [0,1,0,1,0,0|2,0,0]=4 6583 B7R2.13 C1OCC2C1O2 MCULE-5569274990 [0,0,0,2,0,0|0,0,2]=4 6584 B7R2.1 C1CC1C2CO2 MCULE-9859676878 [0,0,0,2,0,0|1,0,1]=4 6585 B7R2.1 C1O[C@@H]1[C@@H]2CO2 MCULE-3158496673 [0,0,0,2,0,0|0,0,2]=4 6586 B7R2.1 C1O[C@@H]1[C@@H]2CO2 MCULE-4139336692 [0,0,0,2,0,0|0,0,2]=4