0 B4R0.1 BrC=C(Br)Br MCULE-9536958233 [0,0,0,0,0,0|4,0,0]=4 1 B4R0.1 C#CC(=C)C MCULE-6826835331 [0,0,0,0,0,0|2,0,2]=4 2 B4R0.1 C#CC(=O)C MCULE-1296030711 [0,0,0,0,0,0|3,0,1]=4 3 B4R0.1 C#CC(C)Br MCULE-6701225038 [0,0,0,0,0,0|3,0,1]=4 4 B4R0.1 C#CC(C)C MCULE-4600802925 [0,0,0,0,0,0|2,0,1]=3 5 B4R0.1 C#CC(C)Cl MCULE-2069451312 [0,0,0,0,0,0|3,0,1]=4 6 B4R0.1 C#CC(C)N MCULE-5174459541 [0,0,0,0,0,0|3,0,1]=4 7 B4R0.1 C#CC(C)N MCULE-7552261137 [0,0,0,0,0,0|3,0,1]=4 8 B4R0.1 C#CC(C)N MCULE-8458008104 [0,0,0,0,0,0|3,0,1]=4 9 B4R0.1 C#CC(C)N MCULE-8872781976 [0,0,0,0,0,0|3,0,1]=4 10 B4R0.1 C#CC(C)O MCULE-6692690957 [0,0,0,0,0,0|3,0,1]=4 11 B4R0.1 C#CC(C)O MCULE-8115962170 [0,0,0,0,0,0|3,0,1]=4 12 B4R0.1 C#C[C@@H](C)N MCULE-1688945745 [0,0,0,0,0,0|3,0,1]=4 13 B4R0.1 C#C[C@@H](C)N MCULE-2648127023 [0,0,0,0,0,0|3,0,1]=4 14 B4R0.1 C#C[C@@H](C)N MCULE-4450167680 [0,0,0,0,0,0|3,0,1]=4 15 B4R0.1 C#C[C@@H](C)N MCULE-5940189329 [0,0,0,0,0,0|3,0,1]=4 16 B4R0.1 C#C[C@@H](C)O MCULE-3014030718 [0,0,0,0,0,0|3,0,1]=4 17 B4R0.1 C#C[C@@H](C)O MCULE-5925379513 [0,0,0,0,0,0|3,0,1]=4 18 B4R0.1 C#C[C@H](C)N MCULE-1256303297 [0,0,0,0,0,0|3,0,1]=4 19 B4R0.1 C#C[C@H](C)N MCULE-4223264163 [0,0,0,0,0,0|3,0,1]=4 20 B4R0.1 C#C[C@H](C)N MCULE-9450573338 [0,0,0,0,0,0|3,0,1]=4 21 B4R0.1 C#C[C@H](C)N MCULE-9795039145 [0,0,0,0,0,0|3,0,1]=4 22 B4R0.1 C#C[C@H](C)O MCULE-3264536845 [0,0,0,0,0,0|3,0,1]=4 23 B4R0.1 C(C)(N)CN MCULE-5877041140 [0,0,0,0,0,0|3,0,1]=4 24 B4R0.1 C(C)(N)CO MCULE-5844242932 [0,0,0,0,0,0|2,0,2]=4 25 B4R0.1 C/C(=N/O)/N MCULE-5595239824 [0,0,0,0,0,0|3,0,1]=4 26 B4R0.1 C/C(=N\O)/N MCULE-8004142092 [0,0,0,0,0,0|3,0,1]=4 27 B4R0.1 C/C=C(/C)\Cl MCULE-6841426098 [0,0,0,0,0,0|3,0,0]=3 28 B4R0.1 C/C=C(\C)/Br MCULE-3045523462 [0,0,0,0,0,0|3,0,0]=3 29 B4R0.1 C/C=C(\C)/Cl MCULE-4683862502 [0,0,0,0,0,0|3,0,0]=3 30 B4R0.1 C=C(Br)C=O MCULE-9500973388 [0,0,0,0,0,0|2,0,1]=3 31 B4R0.1 C=C(C)C#N MCULE-9177849910 [0,0,0,0,0,0|2,0,2]=4 32 B4R0.1 C=C(C)C=O MCULE-3758355501 [0,0,0,0,0,0|1,0,1]=2 33 B4R0.1 C=C(C)CBr MCULE-1361893863 [0,0,0,0,0,0|2,0,2]=4 34 B4R0.1 C=C(C)CCl MCULE-5586406339 [0,0,0,0,0,0|2,0,2]=4 35 B4R0.1 C=C(C)CI MCULE-3678124406 [0,0,0,0,0,0|2,0,2]=4 36 B4R0.1 C=C(C)CN MCULE-1033495975 [0,0,0,0,0,0|2,0,2]=4 37 B4R0.1 C=C(C)CN MCULE-8730181300 [0,0,0,0,0,0|2,0,2]=4 38 B4R0.1 C=C(C)CO MCULE-8641288398 [0,0,0,0,0,0|1,0,3]=4 39 B4R0.1 C=C(C)CS MCULE-5174170431 [0,0,0,0,0,0|1,1,2]=4 40 B4R0.1 C=C(C)OC MCULE-7344104255 [0,0,0,0,0,0|3,0,1]=4 41 B4R0.1 C=C=C(C)C MCULE-8705186354 [0,0,0,0,0,0|2,0,1]=3 42 B4R0.1 C=CB(O)O MCULE-2531600001 [0,0,0,0,0,0|4,0,0]=4 43 B4R0.1 C=CC(=C)C MCULE-1668999564 [0,0,0,0,0,0|2,0,1]=3 44 B4R0.1 C=CC(=O)C MCULE-4924646293 [0,0,0,0,0,0|3,0,0]=3 45 B4R0.1 C=CC(=O)Cl MCULE-3579233798 [0,0,0,0,0,0|4,0,0]=4 46 B4R0.1 C=CC(=O)N MCULE-4309430654 [0,0,0,0,0,0|4,0,0]=4 47 B4R0.1 C=CC(=O)O MCULE-9352227082 [0,0,0,0,0,0|4,0,0]=4 48 B4R0.1 C=CC(=O)[O-] MCULE-3928960314 [0,0,0,0,0,0|4,0,0]=4 49 B4R0.1 C=CC(=O)[O-] MCULE-4331301308 [0,0,0,0,0,0|4,0,0]=4 50 B4R0.1 C=CC(=O)[O-] MCULE-5516854555 [0,0,0,0,0,0|4,0,0]=4 51 B4R0.1 C=CC(C)Cl MCULE-1756172983 [0,0,0,0,0,0|3,0,0]=3 52 B4R0.1 C=CC(C)N MCULE-5748048106 [0,0,0,0,0,0|3,0,0]=3 53 B4R0.1 C=CC(C)N MCULE-6786590923 [0,0,0,0,0,0|3,0,0]=3 54 B4R0.1 C=CC(C)O MCULE-4525368256 [0,0,0,0,0,0|3,0,0]=3 55 B4R0.1 C=CN(=O)=O MCULE-1988475489 [0,0,0,0,0,0|3,0,1]=4 56 B4R0.1 C=C[C@@H](C)N MCULE-4388444035 [0,0,0,0,0,0|3,0,0]=3 57 B4R0.1 C=C[C@@H](C)N MCULE-6107415849 [0,0,0,0,0,0|3,0,0]=3 58 B4R0.1 C=C[C@@H](C)N MCULE-6707490046 [0,0,0,0,0,0|3,0,0]=3 59 B4R0.1 C=C[C@@H](C)N MCULE-9654995108 [0,0,0,0,0,0|3,0,0]=3 60 B4R0.1 C=C[C@H](C)N MCULE-1396113041 [0,0,0,0,0,0|3,0,0]=3 61 B4R0.1 C=C[C@H](C)N MCULE-2197513722 [0,0,0,0,0,0|3,0,0]=3 62 B4R0.1 C=C[C@H](C)N MCULE-4698235480 [0,0,0,0,0,0|3,0,0]=3 63 B4R0.1 C=C[C@H](C)N MCULE-8745929233 [0,0,0,0,0,0|3,0,0]=3 64 B4R0.1 C=C[C@H](C)O MCULE-2251589245 [0,0,0,0,0,0|3,0,0]=3 65 B4R0.1 C=NN(C)C MCULE-4915917395 [0,0,0,0,0,0|2,0,0]=2 66 B4R0.1 CC(=CBr)C MCULE-9508381610 [0,0,0,0,0,0|2,0,0]=2 67 B4R0.1 CC(=CCl)C MCULE-4321554138 [0,0,0,0,0,0|2,0,0]=2 68 B4R0.1 CC(=CCl)Cl MCULE-3528888685 [0,0,0,0,0,0|3,0,0]=3 69 B4R0.1 CC(=N)NN MCULE-2302306720 [0,0,0,0,0,0|4,0,0]=4 70 B4R0.1 CC(=N)NN MCULE-5362481009 [0,0,0,0,0,0|4,0,0]=4 71 B4R0.1 CC(=NN)C MCULE-8828852790 [0,0,0,0,0,0|3,0,0]=3 72 B4R0.1 CC(=NO)C MCULE-3243100216 [0,0,0,0,0,0|2,0,1]=3 73 B4R0.1 CC(=O)C#N MCULE-6317771757 [0,0,0,0,0,0|3,0,1]=4 74 B4R0.1 CC(=O)C=O MCULE-2718961814 [0,0,0,0,0,0|2,0,0]=2 75 B4R0.1 CC(=O)CBr MCULE-7812920675 [0,0,0,0,0,0|3,0,1]=4 76 B4R0.1 CC(=O)CCl MCULE-2501365933 [0,0,0,0,0,0|3,0,1]=4 77 B4R0.1 CC(=O)CF MCULE-7417279999 [0,0,0,0,0,0|3,0,1]=4 78 B4R0.1 CC(=O)CN MCULE-2715277783 [0,0,0,0,0,0|3,0,1]=4 79 B4R0.1 CC(=O)CN MCULE-6004541862 [0,0,0,0,0,0|3,0,1]=4 80 B4R0.1 CC(=O)CO MCULE-2989526028 [0,0,0,0,0,0|2,0,2]=4 81 B4R0.1 CC(=O)CS MCULE-9736174016 [0,0,0,0,0,0|2,1,1]=4 82 B4R0.1 CC(=O)NBr MCULE-6502070876 [0,0,0,0,0,0|4,0,0]=4 83 B4R0.1 CC(=O)NN MCULE-9183467120 [0,0,0,0,0,0|4,0,0]=4 84 B4R0.1 CC(=O)NO MCULE-2682231025 [0,0,0,0,0,0|3,0,1]=4 85 B4R0.1 CC(=O)OO MCULE-6028338742 [0,0,0,0,0,0|3,0,1]=4 86 B4R0.1 CC(Br)C#N MCULE-2994851090 [0,0,0,0,0,0|3,0,1]=4 87 B4R0.1 CC(Br)C=O MCULE-6060704330 [0,0,0,0,0,0|2,0,0]=2 88 B4R0.1 CC(Br)CBr MCULE-6304574748 [0,0,0,0,0,0|3,0,1]=4 89 B4R0.1 CC(Br)CCl MCULE-8021380791 [0,0,0,0,0,0|3,0,1]=4 90 B4R0.1 CC(Br)CN MCULE-5214613046 [0,0,0,0,0,0|3,0,1]=4 91 B4R0.1 CC(Br)CN MCULE-6326218362 [0,0,0,0,0,0|3,0,1]=4 92 B4R0.1 CC(Br)CO MCULE-8344365003 [0,0,0,0,0,0|2,0,2]=4 93 B4R0.1 CC(C)C#N MCULE-8390118776 [0,0,0,0,0,0|2,0,1]=3 94 B4R0.1 CC(C)C=O MCULE-3575731904 [0,0,0,0,0,0|1,0,0]=1 95 B4R0.1 CC(C)CBr MCULE-6039420480 [0,0,0,0,0,0|2,0,1]=3 96 B4R0.1 CC(C)CCl MCULE-6524976746 [0,0,0,0,0,0|2,0,1]=3 97 B4R0.1 CC(C)CI MCULE-5280589461 [0,0,0,0,0,0|2,0,1]=3 98 B4R0.1 CC(C)CN MCULE-2158650588 [0,0,0,0,0,0|2,0,1]=3 99 B4R0.1 CC(C)CN MCULE-6751437658 [0,0,0,0,0,0|2,0,1]=3 100 B4R0.1 CC(C)CN MCULE-8319193456 [0,0,0,0,0,0|2,0,1]=3 101 B4R0.1 CC(C)CN MCULE-8705657065 [0,0,0,0,0,0|2,0,1]=3 102 B4R0.1 CC(C)CO MCULE-6294327194 [0,0,0,0,0,0|1,0,2]=3 103 B4R0.1 CC(C)CP MCULE-3724358658 [0,0,0,0,0,0|2,0,1]=3 104 B4R0.1 CC(C)CS MCULE-7978911055 [0,0,0,0,0,0|1,1,1]=3 105 B4R0.1 CC(C)NN MCULE-4673953224 [0,0,0,0,0,0|3,0,0]=3 106 B4R0.1 CC(C)NN MCULE-7901160798 [0,0,0,0,0,0|3,0,0]=3 107 B4R0.1 CC(C)NN MCULE-9473118288 [0,0,0,0,0,0|3,0,0]=3 108 B4R0.1 CC(C)NO MCULE-6516566403 [0,0,0,0,0,0|2,0,1]=3 109 B4R0.1 CC(C)NO MCULE-8545146035 [0,0,0,0,0,0|2,0,1]=3 110 B4R0.1 CC(C)ON MCULE-4063407094 [0,0,0,0,0,0|3,0,0]=3 111 B4R0.1 CC(C)ON MCULE-9108231771 [0,0,0,0,0,0|3,0,0]=3 112 B4R0.1 CC(C)O[NH3+] MCULE-7527132972 [0,0,0,0,0,0|3,0,0]=3 113 B4R0.1 CC(C)O[NH3+] MCULE-8847326857 [0,0,0,0,0,0|3,0,0]=3 114 B4R0.1 CC(Cl)C#N MCULE-9841634909 [0,0,0,0,0,0|3,0,1]=4 115 B4R0.1 CC(Cl)CBr MCULE-8474943880 [0,0,0,0,0,0|3,0,1]=4 116 B4R0.1 CC(Cl)CCl MCULE-1548912109 [0,0,0,0,0,0|3,0,1]=4 117 B4R0.1 CC(Cl)CN MCULE-2637316379 [0,0,0,0,0,0|3,0,1]=4 118 B4R0.1 CC(Cl)CN MCULE-5591419030 [0,0,0,0,0,0|3,0,1]=4 119 B4R0.1 CC(Cl)CO MCULE-3857255988 [0,0,0,0,0,0|2,0,2]=4 120 B4R0.1 CC(Cl)CO MCULE-7538548427 [0,0,0,0,0,0|2,0,2]=4 121 B4R0.1 CC(F)CN MCULE-6584490651 [0,0,0,0,0,0|3,0,1]=4 122 B4R0.1 CC(F)CN MCULE-9499916116 [0,0,0,0,0,0|3,0,1]=4 123 B4R0.1 CC(F)CO MCULE-6006763378 [0,0,0,0,0,0|2,0,2]=4 124 B4R0.1 CC(N)C#N MCULE-4008524363 [0,0,0,0,0,0|3,0,1]=4 125 B4R0.1 CC(N)C#N MCULE-8654767875 [0,0,0,0,0,0|3,0,1]=4 126 B4R0.1 CC(N)C=O MCULE-3421118418 [0,0,0,0,0,0|2,0,0]=2 127 B4R0.1 CC(N)CBr MCULE-1783493149 [0,0,0,0,0,0|3,0,1]=4 128 B4R0.1 CC(N)CBr MCULE-2775398297 [0,0,0,0,0,0|3,0,1]=4 129 B4R0.1 CC(N)CCl MCULE-8652434595 [0,0,0,0,0,0|3,0,1]=4 130 B4R0.1 CC(N)CCl MCULE-9580466630 [0,0,0,0,0,0|3,0,1]=4 131 B4R0.1 CC(N)CF MCULE-1603143200 [0,0,0,0,0,0|3,0,1]=4 132 B4R0.1 CC(N)CF MCULE-3787216870 [0,0,0,0,0,0|3,0,1]=4 133 B4R0.1 CC(N)CF MCULE-4138869746 [0,0,0,0,0,0|3,0,1]=4 134 B4R0.1 CC(N)CF MCULE-8611760275 [0,0,0,0,0,0|3,0,1]=4 135 B4R0.1 CC(N)CN MCULE-2119036110 [0,0,0,0,0,0|3,0,1]=4 136 B4R0.1 CC(N)CN MCULE-6286216576 [0,0,0,0,0,0|3,0,1]=4 137 B4R0.1 CC(N)CN MCULE-9919433465 [0,0,0,0,0,0|3,0,1]=4 138 B4R0.1 CC(N)CO MCULE-1361379423 [0,0,0,0,0,0|2,0,2]=4 139 B4R0.1 CC(N)CO MCULE-2098440985 [0,0,0,0,0,0|2,0,2]=4 140 B4R0.1 CC(N)CS MCULE-1396853557 [0,0,0,0,0,0|2,1,1]=4 141 B4R0.1 CC(N)CS MCULE-4094732666 [0,0,0,0,0,0|2,1,1]=4 142 B4R0.1 CC(O)C#N MCULE-3166802314 [0,0,0,0,0,0|3,0,1]=4 143 B4R0.1 CC(O)CBr MCULE-7835094737 [0,0,0,0,0,0|3,0,1]=4 144 B4R0.1 CC(O)CCl MCULE-9140807958 [0,0,0,0,0,0|3,0,1]=4 145 B4R0.1 CC(O)CF MCULE-1023052065 [0,0,0,0,0,0|3,0,1]=4 146 B4R0.1 CC(O)CN MCULE-4370440652 [0,0,0,0,0,0|3,0,1]=4 147 B4R0.1 CC(O)CN MCULE-5694317743 [0,0,0,0,0,0|3,0,1]=4 148 B4R0.1 CC(O)CN MCULE-6406041538 [0,0,0,0,0,0|3,0,1]=4 149 B4R0.1 CC(O)CN MCULE-6636652305 [0,0,0,0,0,0|3,0,1]=4 150 B4R0.1 CC(O)CO MCULE-5574440784 [0,0,0,0,0,0|2,0,2]=4 151 B4R0.1 CC(O)CO MCULE-8743139013 [0,0,0,0,0,0|2,0,2]=4 152 B4R0.1 CC(O)CS MCULE-7881083356 [0,0,0,0,0,0|2,1,1]=4 153 B4R0.1 CC(O)C[NH3+] MCULE-6871369474 [0,0,0,0,0,0|3,0,1]=4 154 B4R0.1 CC(S)CN MCULE-1957568322 [0,0,0,0,0,0|3,0,1]=4 155 B4R0.1 CC(S)CN MCULE-7469442412 [0,0,0,0,0,0|3,0,1]=4 156 B4R0.1 CC(S)CO MCULE-5090908062 [0,0,0,0,0,0|2,0,2]=4 157 B4R0.1 CC(S)CS MCULE-9264694858 [0,0,0,0,0,0|2,1,1]=4 158 B4R0.1 CC=C(C)Br MCULE-1371905211 [0,0,0,0,0,0|3,0,0]=3 159 B4R0.1 CC=C(C)C MCULE-4230157245 [0,0,0,0,0,0|2,0,0]=2 160 B4R0.1 CC=C(C)Cl MCULE-3844314543 [0,0,0,0,0,0|3,0,0]=3 161 B4R0.1 CC=C(Cl)Cl MCULE-3741261135 [0,0,0,0,0,0|4,0,0]=4 162 B4R0.1 CC=C(F)F MCULE-5544510852 [0,0,0,0,0,0|4,0,0]=4 163 B4R0.1 CCC(=O)C MCULE-8276670748 [0,0,0,0,0,0|3,0,1]=4 164 B4R0.1 CCC(C)Br MCULE-9661620259 [0,0,0,0,0,0|3,0,1]=4 165 B4R0.1 CCC(C)C MCULE-5376105936 [0,0,0,0,0,0|2,0,1]=3 166 B4R0.1 CCC(C)Cl MCULE-2954418486 [0,0,0,0,0,0|3,0,1]=4 167 B4R0.1 CCC(C)I MCULE-5239699587 [0,0,0,0,0,0|3,0,1]=4 168 B4R0.1 CCC(C)N MCULE-5041676035 [0,0,0,0,0,0|3,0,1]=4 169 B4R0.1 CCC(C)N MCULE-5835091553 [0,0,0,0,0,0|3,0,1]=4 170 B4R0.1 CCC(C)N MCULE-6631606230 [0,0,0,0,0,0|3,0,1]=4 171 B4R0.1 CCC(C)N MCULE-8165681721 [0,0,0,0,0,0|3,0,1]=4 172 B4R0.1 CCC(C)O MCULE-4099350806 [0,0,0,0,0,0|3,0,1]=4 173 B4R0.1 CCC(C)O MCULE-5005120003 [0,0,0,0,0,0|3,0,1]=4 174 B4R0.1 CCC(C)S MCULE-4988033753 [0,0,0,0,0,0|3,0,1]=4 175 B4R0.1 CCN(C)C MCULE-5825033552 [0,0,0,0,0,0|1,0,1]=2 176 B4R0.1 CCN(C)N MCULE-2279492356 [0,0,0,0,0,0|2,0,1]=3 177 B4R0.1 CCN(C)N MCULE-5660338703 [0,0,0,0,0,0|2,0,1]=3 178 B4R0.1 CCN(C)N MCULE-9839987578 [0,0,0,0,0,0|2,0,1]=3 179 B4R0.1 CCS(=O)C MCULE-4400935745 [0,0,0,0,0,0|3,0,1]=4 180 B4R0.1 CC[C@@H](C)N MCULE-2017255826 [0,0,0,0,0,0|3,0,1]=4 181 B4R0.1 CC[C@@H](C)N MCULE-3555707512 [0,0,0,0,0,0|3,0,1]=4 182 B4R0.1 CC[C@@H](C)N MCULE-6783735598 [0,0,0,0,0,0|3,0,1]=4 183 B4R0.1 CC[C@@H](C)N MCULE-7004219201 [0,0,0,0,0,0|3,0,1]=4 184 B4R0.1 CC[C@@H](C)O MCULE-2661481448 [0,0,0,0,0,0|3,0,1]=4 185 B4R0.1 CC[C@@H](C)O MCULE-6785232833 [0,0,0,0,0,0|3,0,1]=4 186 B4R0.1 CC[C@H](C)N MCULE-2450201533 [0,0,0,0,0,0|3,0,1]=4 187 B4R0.1 CC[C@H](C)N MCULE-2998961427 [0,0,0,0,0,0|3,0,1]=4 188 B4R0.1 CC[C@H](C)N MCULE-6692190471 [0,0,0,0,0,0|3,0,1]=4 189 B4R0.1 CC[C@H](C)N MCULE-6904795465 [0,0,0,0,0,0|3,0,1]=4 190 B4R0.1 CC[C@H](C)O MCULE-3700911573 [0,0,0,0,0,0|3,0,1]=4 191 B4R0.1 CC[C@H](C)O MCULE-6063716138 [0,0,0,0,0,0|3,0,1]=4 192 B4R0.1 CN(C)C#N MCULE-2744421860 [0,0,0,0,0,0|1,0,1]=2 193 B4R0.1 CN(C)C=O MCULE-6290117712 [0,0,0,0,0,0|0,0,0]=0 194 B4R0.1 CN(C)C=S MCULE-3571847382 [0,0,0,0,0,0|0,1,0]=1 195 B4R0.1 CN(C)CCl MCULE-4906480184 [0,0,0,0,0,0|1,0,1]=2 196 B4R0.1 CN(C)CCl MCULE-5465672480 [0,0,0,0,0,0|1,0,1]=2 197 B4R0.1 CN(C)N=O MCULE-1157726226 [0,0,0,0,0,0|1,0,0]=1 198 B4R0.1 CN(N)C=O MCULE-6353057165 [0,0,0,0,0,0|1,0,0]=1 199 B4R0.1 CNC(=O)C MCULE-2612997941 [0,0,0,0,0,0|4,0,0]=4 200 B4R0.1 CNC(=S)C MCULE-8699171591 [0,0,0,0,0,0|4,0,0]=4 201 B4R0.1 CNC(C)C MCULE-3849513543 [0,0,0,0,0,0|3,0,0]=3 202 B4R0.1 CNN(C)C MCULE-7120869955 [0,0,0,0,0,0|2,0,0]=2 203 B4R0.1 CNN(C)C MCULE-8318926099 [0,0,0,0,0,0|2,0,0]=2 204 B4R0.1 COC(=N)C MCULE-2752794913 [0,0,0,0,0,0|4,0,0]=4 205 B4R0.1 COC(=N)C MCULE-2904991083 [0,0,0,0,0,0|4,0,0]=4 206 B4R0.1 COC(=O)C MCULE-7368066093 [0,0,0,0,0,0|4,0,0]=4 207 B4R0.1 COC(C)Cl MCULE-9043930044 [0,0,0,0,0,0|4,0,0]=4 208 B4R0.1 CSC(=O)C MCULE-7061634598 [0,0,0,0,0,0|4,0,0]=4 209 B4R0.1 CSC(=S)C MCULE-4836153374 [0,0,0,0,0,0|4,0,0]=4 210 B4R0.1 CSC(C)C MCULE-5932565699 [0,0,0,0,0,0|3,0,0]=3 211 B4R0.1 CSS(=O)C MCULE-6515592458 [0,0,0,0,0,0|4,0,0]=4 212 B4R0.1 CS[S+](C)C MCULE-1869043585 [0,0,0,0,0,0|3,0,0]=3 213 B4R0.1 CS[S+](C)C MCULE-4164877790 [0,0,0,0,0,0|3,0,0]=3 214 B4R0.1 C[C@@H](Cl)CO MCULE-4834664531 [0,0,0,0,0,0|2,0,2]=4 215 B4R0.1 C[C@@H](Cl)CO MCULE-8797955903 [0,0,0,0,0,0|2,0,2]=4 216 B4R0.1 C[C@@H](F)CO MCULE-3312305972 [0,0,0,0,0,0|2,0,2]=4 217 B4R0.1 C[C@@H](F)CO MCULE-4754825872 [0,0,0,0,0,0|2,0,2]=4 218 B4R0.1 C[C@@H](N)C#N MCULE-4366493733 [0,0,0,0,0,0|3,0,1]=4 219 B4R0.1 C[C@@H](N)C#N MCULE-4475438132 [0,0,0,0,0,0|3,0,1]=4 220 B4R0.1 C[C@@H](N)C#N MCULE-8152568021 [0,0,0,0,0,0|3,0,1]=4 221 B4R0.1 C[C@@H](N)C#N MCULE-9327848803 [0,0,0,0,0,0|3,0,1]=4 222 B4R0.1 C[C@@H](N)CF MCULE-2227343602 [0,0,0,0,0,0|3,0,1]=4 223 B4R0.1 C[C@@H](N)CF MCULE-2283243747 [0,0,0,0,0,0|3,0,1]=4 224 B4R0.1 C[C@@H](N)CF MCULE-6326763354 [0,0,0,0,0,0|3,0,1]=4 225 B4R0.1 C[C@@H](N)CF MCULE-6630824972 [0,0,0,0,0,0|3,0,1]=4 226 B4R0.1 C[C@@H](N)CN MCULE-5207840256 [0,0,0,0,0,0|3,0,1]=4 227 B4R0.1 C[C@@H](N)CN MCULE-5332214014 [0,0,0,0,0,0|3,0,1]=4 228 B4R0.1 C[C@@H](N)CN MCULE-7816211809 [0,0,0,0,0,0|3,0,1]=4 229 B4R0.1 C[C@@H](N)CN MCULE-7982492466 [0,0,0,0,0,0|3,0,1]=4 230 B4R0.1 C[C@@H](N)CO MCULE-5655560645 [0,0,0,0,0,0|2,0,2]=4 231 B4R0.1 C[C@@H](N)CO MCULE-8066658004 [0,0,0,0,0,0|2,0,2]=4 232 B4R0.1 C[C@@H](O)C=O MCULE-5921136435 [0,0,0,0,0,0|2,0,0]=2 233 B4R0.1 C[C@@H](O)CCl MCULE-4669677883 [0,0,0,0,0,0|3,0,1]=4 234 B4R0.1 C[C@@H](O)CCl MCULE-7670590902 [0,0,0,0,0,0|3,0,1]=4 235 B4R0.1 C[C@@H](O)CN MCULE-9301041927 [0,0,0,0,0,0|3,0,1]=4 236 B4R0.1 C[C@@H](O)CO MCULE-4464598400 [0,0,0,0,0,0|2,0,2]=4 237 B4R0.1 C[C@@H](O)CO MCULE-9914833832 [0,0,0,0,0,0|2,0,2]=4 238 B4R0.1 C[C@@H](O)CS MCULE-8817452889 [0,0,0,0,0,0|2,1,1]=4 239 B4R0.1 C[C@H](Cl)CO MCULE-6747279587 [0,0,0,0,0,0|2,0,2]=4 240 B4R0.1 C[C@H](Cl)CO MCULE-8509218918 [0,0,0,0,0,0|2,0,2]=4 241 B4R0.1 C[C@H](F)CO MCULE-1024261541 [0,0,0,0,0,0|2,0,2]=4 242 B4R0.1 C[C@H](F)CO MCULE-7028098137 [0,0,0,0,0,0|2,0,2]=4 243 B4R0.1 C[C@H](N)C#N MCULE-2449963253 [0,0,0,0,0,0|3,0,1]=4 244 B4R0.1 C[C@H](N)C#N MCULE-3624286995 [0,0,0,0,0,0|3,0,1]=4 245 B4R0.1 C[C@H](N)CF MCULE-1053227516 [0,0,0,0,0,0|3,0,1]=4 246 B4R0.1 C[C@H](N)CF MCULE-4024916343 [0,0,0,0,0,0|3,0,1]=4 247 B4R0.1 C[C@H](N)CF MCULE-6312285034 [0,0,0,0,0,0|3,0,1]=4 248 B4R0.1 C[C@H](N)CF MCULE-7630744199 [0,0,0,0,0,0|3,0,1]=4 249 B4R0.1 C[C@H](N)CN MCULE-2048837128 [0,0,0,0,0,0|3,0,1]=4 250 B4R0.1 C[C@H](N)CN MCULE-4105152552 [0,0,0,0,0,0|3,0,1]=4 251 B4R0.1 C[C@H](N)CN MCULE-7106390536 [0,0,0,0,0,0|3,0,1]=4 252 B4R0.1 C[C@H](N)CN MCULE-9863306005 [0,0,0,0,0,0|3,0,1]=4 253 B4R0.1 C[C@H](N)CO MCULE-2471107013 [0,0,0,0,0,0|2,0,2]=4 254 B4R0.1 C[C@H](N)CO MCULE-5424195678 [0,0,0,0,0,0|2,0,2]=4 255 B4R0.1 C[C@H](O)CCl MCULE-3018109825 [0,0,0,0,0,0|3,0,1]=4 256 B4R0.1 C[C@H](O)CCl MCULE-5836677540 [0,0,0,0,0,0|3,0,1]=4 257 B4R0.1 C[C@H](O)CN MCULE-3227371869 [0,0,0,0,0,0|3,0,1]=4 258 B4R0.1 C[C@H](O)CN MCULE-5480489257 [0,0,0,0,0,0|3,0,1]=4 259 B4R0.1 C[C@H](O)CO MCULE-6582852191 [0,0,0,0,0,0|2,0,2]=4 260 B4R0.1 C[C@H](O)CO MCULE-8074793296 [0,0,0,0,0,0|2,0,2]=4 261 B4R0.1 C[C@H](O)CS MCULE-9061842733 [0,0,0,0,0,0|2,1,1]=4 262 B4R0.1 C[N+](=CBr)C MCULE-4078543172 [0,0,0,0,0,0|1,0,1]=2 263 B4R0.1 C[N+](=CBr)C MCULE-9146783444 [0,0,0,0,0,0|1,0,1]=2 264 B4R0.1 C[N+](=CCl)C MCULE-5768539789 [0,0,0,0,0,0|1,0,1]=2 265 B4R0.1 C[N+](=CCl)C MCULE-6936774679 [0,0,0,0,0,0|1,0,1]=2 266 B4R0.1 ClC=C(Cl)Cl MCULE-3945953656 [0,0,0,0,0,0|4,0,0]=4 267 B4R0.1 FC(=CBr)F MCULE-5114290777 [0,0,0,0,0,0|4,0,0]=4 268 B4R0.1 FC=C(Br)Br MCULE-3150710627 [0,0,0,0,0,0|4,0,0]=4 269 B4R0.1 FC=C(F)F MCULE-2449532887 [0,0,0,0,0,0|4,0,0]=4 270 B4R0.1 O=CC(=O)O MCULE-5307898766 [0,0,0,0,0,0|3,0,0]=3 271 B4R0.1 O=CC(Cl)Cl MCULE-7925858204 [0,0,0,0,0,0|3,0,0]=3 272 B4R0.1 [C@@H](C)(O)C#C MCULE-8971134855 [0,0,0,0,0,0|3,0,1]=4 273 B4R0.1 [C@H](C)(O)CN MCULE-8212000072 [0,0,0,0,0,0|3,0,1]=4 274 B4R0.1 [NH3+]C(C)CC MCULE-3066898055 [0,0,0,0,0,0|3,0,1]=4 275 B3R0.1 Br/C=C/Br MCULE-6284547614 [1,0,0,0,0,0|3,0,0]=4 276 B3R0.1 BrC=CBr MCULE-4478409345 [1,0,0,0,0,0|3,0,0]=4 277 B3R0.1 C#CC=O MCULE-4187736819 [1,0,0,0,0,0|1,0,1]=3 278 B3R0.1 C#CCC MCULE-8090253856 [1,0,0,0,0,0|2,0,1]=4 279 B3R0.1 C/B=N/O MCULE-5227399299 [1,0,0,0,0,0|2,0,1]=4 280 B3R0.1 C/C=C/Br MCULE-4076369660 [1,0,0,0,0,0|2,0,0]=3 281 B3R0.1 C/C=N/O MCULE-2376410404 [1,0,0,0,0,0|2,0,1]=4 282 B3R0.1 C=CC#N MCULE-8176403366 [1,0,0,0,0,0|3,0,0]=4 283 B3R0.1 C=CC=C MCULE-4134157329 [1,0,0,0,0,0|2,0,1]=4 284 B3R0.1 C=CC=O MCULE-2104890669 [1,0,0,0,0,0|1,0,1]=3 285 B3R0.1 C=CCBr MCULE-9486454833 [1,0,0,0,0,0|3,0,0]=4 286 B3R0.1 C=CCC MCULE-8167907130 [1,0,0,0,0,0|2,0,0]=3 287 B3R0.1 C=CCCl MCULE-4067772785 [1,0,0,0,0,0|3,0,0]=4 288 B3R0.1 C=CCF MCULE-7783191980 [1,0,0,0,0,0|3,0,0]=4 289 B3R0.1 C=CCI MCULE-5037698873 [1,0,0,0,0,0|3,0,0]=4 290 B3R0.1 C=CCN MCULE-2424616806 [1,0,0,0,0,0|3,0,0]=4 291 B3R0.1 C=CCN MCULE-2473480946 [1,0,0,0,0,0|3,0,0]=4 292 B3R0.1 C=CCO MCULE-2145308838 [1,0,0,0,0,0|3,0,0]=4 293 B3R0.1 C=CCS MCULE-7270484838 [1,0,0,0,0,0|3,0,0]=4 294 B3R0.1 C=COC MCULE-4880746684 [1,0,0,0,0,0|2,0,0]=3 295 B3R0.1 CC#CC MCULE-3721942346 [1,0,0,0,0,0|2,0,1]=4 296 B3R0.1 CC#CI MCULE-4817406645 [1,0,0,0,0,0|2,0,1]=4 297 B3R0.1 CC=CBr MCULE-2098755460 [1,0,0,0,0,0|2,0,0]=3 298 B3R0.1 CC=CCl MCULE-9225887510 [1,0,0,0,0,0|2,0,0]=3 299 B3R0.1 CC=NO MCULE-9761317381 [1,0,0,0,0,0|2,0,1]=4 300 B3R0.1 CCC#N MCULE-9484970536 [1,0,0,0,0,0|2,0,1]=4 301 B3R0.1 CCC=O MCULE-4079744837 [1,0,0,0,0,0|1,0,0]=2 302 B3R0.1 CCCBr MCULE-2393970713 [1,0,0,0,0,0|2,0,1]=4 303 B3R0.1 CCCC MCULE-9760497805 [1,0,0,0,0,0|2,0,1]=4 304 B3R0.1 CCCCl MCULE-3496412829 [1,0,0,0,0,0|2,0,1]=4 305 B3R0.1 CCCF MCULE-8540338768 [1,0,0,0,0,0|2,0,1]=4 306 B3R0.1 CCCI MCULE-1721488805 [1,0,0,0,0,0|2,0,1]=4 307 B3R0.1 CCCN MCULE-2885523792 [1,0,0,0,0,0|2,0,1]=4 308 B3R0.1 CCCN MCULE-4318907091 [1,0,0,0,0,0|2,0,1]=4 309 B3R0.1 CCCN MCULE-6330457870 [1,0,0,0,0,0|2,0,1]=4 310 B3R0.1 CCCN MCULE-7146820007 [1,0,0,0,0,0|2,0,1]=4 311 B3R0.1 CCCO MCULE-6252105126 [1,0,0,0,0,0|1,0,2]=4 312 B3R0.1 CCCS MCULE-8267649092 [1,0,0,0,0,0|1,1,1]=4 313 B3R0.1 CCNC MCULE-7215376398 [1,0,0,0,0,0|1,0,1]=3 314 B3R0.1 CCNC MCULE-9811899205 [1,0,0,0,0,0|1,0,1]=3 315 B3R0.1 CCNN MCULE-4753127904 [1,0,0,0,0,0|2,0,1]=4 316 B3R0.1 CCNN MCULE-7630363192 [1,0,0,0,0,0|2,0,1]=4 317 B3R0.1 CCNN MCULE-8402230944 [1,0,0,0,0,0|2,0,1]=4 318 B3R0.1 CCNO MCULE-1215586669 [1,0,0,0,0,0|2,0,1]=4 319 B3R0.1 CCNO MCULE-7075818857 [1,0,0,0,0,0|2,0,1]=4 320 B3R0.1 CCON MCULE-5316082054 [1,0,0,0,0,0|3,0,0]=4 321 B3R0.1 CCON MCULE-6621418839 [1,0,0,0,0,0|3,0,0]=4 322 B3R0.1 CCO[NH3+] MCULE-7670481464 [1,0,0,0,0,0|3,0,0]=4 323 B3R0.1 CCO[NH3+] MCULE-7871083232 [1,0,0,0,0,0|3,0,0]=4 324 B3R0.1 CCSC MCULE-6944750263 [1,0,0,0,0,0|2,0,1]=4 325 B3R0.1 CN=C=O MCULE-7764606582 [1,0,0,0,0,0|0,0,2]=3 326 B3R0.1 CN=C=S MCULE-6174235995 [1,0,0,0,0,0|0,1,2]=4 327 B3R0.1 CNC#N MCULE-9135475289 [1,0,0,0,0,0|1,0,1]=3 328 B3R0.1 CNC=O MCULE-4739122677 [1,0,0,0,0,0|0,0,0]=1 329 B3R0.1 CNC=S MCULE-1018523469 [1,0,0,0,0,0|0,1,0]=2 330 B3R0.1 CNNC MCULE-5932476941 [1,0,0,0,0,0|2,0,0]=3 331 B3R0.1 CNNC MCULE-6419598860 [1,0,0,0,0,0|2,0,0]=3 332 B3R0.1 CNOC MCULE-1706082503 [1,0,0,0,0,0|2,0,0]=3 333 B3R0.1 CNOC MCULE-6224540090 [1,0,0,0,0,0|2,0,0]=3 334 B3R0.1 COC=O MCULE-9122749354 [1,0,0,0,0,0|1,0,0]=2 335 B3R0.1 COCBr MCULE-2566721472 [1,0,0,0,0,0|2,0,1]=4 336 B3R0.1 COCCl MCULE-5928768006 [1,0,0,0,0,0|2,0,1]=4 337 B3R0.1 COCI MCULE-5215132549 [1,0,0,0,0,0|2,0,1]=4 338 B3R0.1 CSC#N MCULE-3677411130 [1,0,0,0,0,0|2,0,1]=4 339 B3R0.1 CSCCl MCULE-1281800596 [1,0,0,0,0,0|2,0,1]=4 340 B3R0.1 CSSC MCULE-7451882535 [1,0,0,0,0,0|3,0,0]=4 341 B3R0.1 C[Se][Se]C MCULE-1189700302 [1,0,0,0,0,0|3,0,0]=4 342 B3R0.1 Cl/C=C/Cl MCULE-8326307647 [1,0,0,0,0,0|3,0,0]=4 343 B3R0.1 Cl/C=C\Cl MCULE-8638364223 [1,0,0,0,0,0|3,0,0]=4 344 B3R0.1 ClC=CCl MCULE-1709740532 [1,0,0,0,0,0|3,0,0]=4 345 B3R0.1 F/C=C/Cl MCULE-6748930384 [1,0,0,0,0,0|3,0,0]=4 346 B3R0.1 FC=CBr MCULE-3730796032 [1,0,0,0,0,0|3,0,0]=4 347 B3R0.1 FC=CCl MCULE-8668714110 [1,0,0,0,0,0|3,0,0]=4 348 B3R0.1 FC=CF MCULE-1668825245 [1,0,0,0,0,0|3,0,0]=4 349 B3R0.1 N/C=N/O MCULE-9567664507 [1,0,0,0,0,0|2,0,1]=4 350 B3R0.1 NNC=O MCULE-6986968107 [1,0,0,0,0,0|1,0,0]=2 351 B3R0.1 NOC=O MCULE-4489199776 [1,0,0,0,0,0|2,0,0]=3 352 B3R0.1 O=CC=O MCULE-3212938778 [1,0,0,0,0,0|2,0,0]=3 353 B3R0.1 O=CCBr MCULE-9076011270 [1,0,0,0,0,0|2,0,0]=3 354 B3R0.1 O=CCCl MCULE-7307216184 [1,0,0,0,0,0|2,0,0]=3 355 B3R0.1 O=CCI MCULE-1146810366 [1,0,0,0,0,0|2,0,0]=3 356 B3R0.2 BN(C)C MCULE-2470964161 [1,0,0,0,0,0|1,0,0]=2 357 B3R0.2 C=C(C)Br MCULE-7805530064 [1,0,0,0,0,0|2,0,0]=3 358 B3R0.2 C=C(C)C MCULE-5640095130 [1,0,0,0,0,0|1,0,0]=2 359 B3R0.2 C=C(C)Cl MCULE-1752401095 [1,0,0,0,0,0|2,0,0]=3 360 B3R0.2 C=C(C)F MCULE-3213198231 [1,0,0,0,0,0|2,0,0]=3 361 B3R0.2 C=C(Cl)Cl MCULE-1430323756 [1,0,0,0,0,0|3,0,0]=4 362 B3R0.2 C=C(F)Cl MCULE-8528897253 [1,0,0,0,0,0|3,0,0]=4 363 B3R0.2 C=C(F)F MCULE-2471767745 [1,0,0,0,0,0|3,0,0]=4 364 B3R0.2 C=[N+](C)C MCULE-4450980212 [1,0,0,0,0,0|0,0,1]=2 365 B3R0.2 C=[N+](C)C MCULE-5309464837 [1,0,0,0,0,0|0,0,1]=2 366 B3R0.2 C=[N+](C)C MCULE-9321779445 [1,0,0,0,0,0|0,0,1]=2 367 B3R0.2 CB(O)O MCULE-3510763826 [1,0,0,0,0,0|2,0,1]=4 368 B3R0.2 CC(=N)N MCULE-3235425606 [1,0,0,0,0,0|3,0,0]=4 369 B3R0.2 CC(=N)N MCULE-3546679379 [1,0,0,0,0,0|3,0,0]=4 370 B3R0.2 CC(=N)N MCULE-3597638887 [1,0,0,0,0,0|3,0,0]=4 371 B3R0.2 CC(=N)N MCULE-9831274654 [1,0,0,0,0,0|3,0,0]=4 372 B3R0.2 CC(=O)Br MCULE-4892265063 [1,0,0,0,0,0|2,0,0]=3 373 B3R0.2 CC(=O)C MCULE-6679625040 [1,0,0,0,0,0|1,0,0]=2 374 B3R0.2 CC(=O)Cl MCULE-9041746362 [1,0,0,0,0,0|2,0,0]=3 375 B3R0.2 CC(=O)I MCULE-4812718701 [1,0,0,0,0,0|2,0,0]=3 376 B3R0.2 CC(=O)N MCULE-9280264861 [1,0,0,0,0,0|2,0,0]=3 377 B3R0.2 CC(=O)O MCULE-1502330578 [1,0,0,0,0,0|2,0,0]=3 378 B3R0.2 CC(=O)O MCULE-5514028500 [1,0,0,0,0,0|2,0,0]=3 379 B3R0.2 CC(=O)O MCULE-5942589566 [1,0,0,0,0,0|2,0,0]=3 380 B3R0.2 CC(=O)O MCULE-6780070129 [1,0,0,0,0,0|2,0,0]=3 381 B3R0.2 CC(=O)O MCULE-8295936189 [1,0,0,0,0,0|2,0,0]=3 382 B3R0.2 CC(=O)O MCULE-9103972283 [1,0,0,0,0,0|2,0,0]=3 383 B3R0.2 CC(=O)O MCULE-9900518424 [1,0,0,0,0,0|2,0,0]=3 384 B3R0.2 CC(=O)S MCULE-5769447035 [1,0,0,0,0,0|2,0,0]=3 385 B3R0.2 CC(=O)[O-] MCULE-2314460022 [1,0,0,0,0,0|2,0,0]=3 386 B3R0.2 CC(=O)[O-] MCULE-2960771771 [1,0,0,0,0,0|2,0,0]=3 387 B3R0.2 CC(=O)[O-] MCULE-5334052410 [1,0,0,0,0,0|2,0,0]=3 388 B3R0.2 CC(=O)[O-] MCULE-5482908386 [1,0,0,0,0,0|2,0,0]=3 389 B3R0.2 CC(=O)[O-] MCULE-9723570182 [1,0,0,0,0,0|2,0,0]=3 390 B3R0.2 CC(=O)[O-] MCULE-9910426896 [1,0,0,0,0,0|2,0,0]=3 391 B3R0.2 CC(=S)N MCULE-4635097605 [1,0,0,0,0,0|2,1,0]=4 392 B3R0.2 CC(=S)[O-] MCULE-1878530758 [1,0,0,0,0,0|2,0,1]=4 393 B3R0.2 CC(Br)Br MCULE-3156450089 [1,0,0,0,0,0|3,0,0]=4 394 B3R0.2 CC(C)Br MCULE-4068304617 [1,0,0,0,0,0|2,0,0]=3 395 B3R0.2 CC(C)C MCULE-6616676274 [1,0,0,0,0,0|1,0,1]=3 396 B3R0.2 CC(C)Cl MCULE-3190141598 [1,0,0,0,0,0|2,0,0]=3 397 B3R0.2 CC(C)F MCULE-5333357055 [1,0,0,0,0,0|2,0,0]=3 398 B3R0.2 CC(C)I MCULE-6151711033 [1,0,0,0,0,0|2,0,0]=3 399 B3R0.2 CC(C)N MCULE-1048799006 [1,0,0,0,0,0|2,0,0]=3 400 B3R0.2 CC(C)N MCULE-1125416142 [1,0,0,0,0,0|2,0,0]=3 401 B3R0.2 CC(C)N MCULE-2418429353 [1,0,0,0,0,0|2,0,0]=3 402 B3R0.2 CC(C)N MCULE-7280647435 [1,0,0,0,0,0|2,0,0]=3 403 B3R0.2 CC(C)O MCULE-6646752234 [1,0,0,0,0,0|1,0,1]=3 404 B3R0.2 CC(C)S MCULE-8283942088 [1,0,0,0,0,0|1,1,0]=3 405 B3R0.2 CC(Cl)Br MCULE-6166388747 [1,0,0,0,0,0|3,0,0]=4 406 B3R0.2 CC(Cl)Cl MCULE-2444543893 [1,0,0,0,0,0|3,0,0]=4 407 B3R0.2 CC(F)Cl MCULE-1350283946 [1,0,0,0,0,0|3,0,0]=4 408 B3R0.2 CC(F)F MCULE-1642052461 [1,0,0,0,0,0|3,0,0]=4 409 B3R0.2 CN(=O)=O MCULE-8704524604 [1,0,0,0,0,0|1,0,1]=3 410 B3R0.2 CN(C)C MCULE-5179437979 [1,0,0,0,0,0|0,0,1]=2 411 B3R0.2 CN(C)C MCULE-6816696733 [1,0,0,0,0,0|0,0,1]=2 412 B3R0.2 CN(C)C MCULE-7903544426 [1,0,0,0,0,0|0,0,1]=2 413 B3R0.2 CN(C)N MCULE-7177216911 [1,0,0,0,0,0|1,0,0]=2 414 B3R0.2 CN(C)N MCULE-8775366011 [1,0,0,0,0,0|1,0,0]=2 415 B3R0.2 CN(C)O MCULE-6572915706 [1,0,0,0,0,0|0,0,1]=2 416 B3R0.2 CN(C)O MCULE-6950647562 [1,0,0,0,0,0|0,0,1]=2 417 B3R0.2 CP(=O)C MCULE-6150886622 [1,0,0,0,0,0|0,1,0]=2 418 B3R0.2 CP(C)C MCULE-6703190251 [1,0,0,0,0,0|0,1,1]=3 419 B3R0.2 CS(=O)C MCULE-2005841258 [1,0,0,0,0,0|1,0,0]=2 420 B3R0.2 CS(=O)Cl MCULE-1292201352 [1,0,0,0,0,0|2,0,0]=3 421 B3R0.2 CS(=O)N MCULE-5162949591 [1,0,0,0,0,0|2,0,0]=3 422 B3R0.2 CS(=O)O MCULE-8711306710 [1,0,0,0,0,0|2,0,0]=3 423 B3R0.2 CS(=O)[O-] MCULE-1437194827 [1,0,0,0,0,0|2,0,0]=3 424 B3R0.2 C[Ga](C)C MCULE-6013775603 [1,0,0,0,0,0|1,0,1]=3 425 B3R0.2 C[In](C)C MCULE-1424187192 [1,0,0,0,0,0|1,0,1]=3 426 B3R0.2 C[O+](C)C MCULE-2925451414 [1,0,0,0,0,0|1,0,1]=3 427 B3R0.2 C[S+](C)Br MCULE-2734391695 [1,0,0,0,0,0|2,0,0]=3 428 B3R0.2 C[S+](C)Br MCULE-6411921824 [1,0,0,0,0,0|2,0,0]=3 429 B3R0.2 C[S+](C)C MCULE-5867625832 [1,0,0,0,0,0|1,0,1]=3 430 B3R0.2 C[S+](C)C MCULE-7678314643 [1,0,0,0,0,0|1,0,1]=3 431 B3R0.2 C[S+](C)C MCULE-8005905986 [1,0,0,0,0,0|1,0,1]=3 432 B3R0.2 C[Se](=O)C MCULE-4596040471 [1,0,0,0,0,0|1,0,0]=2 433 B3R0.2 C[Se](=O)O MCULE-5568767851 [1,0,0,0,0,0|2,0,0]=3 434 B3R0.2 NC(=O)N MCULE-3224868954 [1,0,0,0,0,0|3,0,0]=4 435 B3R0.2 NC(=O)N MCULE-8513891094 [1,0,0,0,0,0|3,0,0]=4 436 B3R0.2 NC(=O)O MCULE-1579038047 [1,0,0,0,0,0|3,0,0]=4 437 B3R0.2 NC(=O)O MCULE-3232812015 [1,0,0,0,0,0|3,0,0]=4 438 B3R0.2 O=C(Cl)[Au] MCULE-6601882022 [1,0,0,0,0,0|3,0,0]=4 439 B3R0.2 O=C(O)O MCULE-3743781291 [1,0,0,0,0,0|3,0,0]=4 440 B3R0.2 O=C(O)O MCULE-6373078171 [1,0,0,0,0,0|3,0,0]=4 441 B3R0.2 O=C([O-])O MCULE-5529655359 [1,0,0,0,0,0|3,0,0]=4 442 B3R0.2 O=C([O-])O MCULE-7293729150 [1,0,0,0,0,0|3,0,0]=4 443 B3R0.2 O=C([O-])[O-] MCULE-1092668330 [1,0,0,0,0,0|3,0,0]=4 444 B3R0.2 O=C([O-])[O-] MCULE-1095103800 [1,0,0,0,0,0|3,0,0]=4 445 B3R0.2 O=C([O-])[O-] MCULE-1597066471 [1,0,0,0,0,0|3,0,0]=4 446 B3R0.2 O=C([O-])[O-] MCULE-2005483457 [1,0,0,0,0,0|3,0,0]=4 447 B3R0.2 O=C([O-])[O-] MCULE-3299525070 [1,0,0,0,0,0|3,0,0]=4 448 B3R0.2 O=C([O-])[O-] MCULE-4074516840 [1,0,0,0,0,0|3,0,0]=4 449 B3R0.2 O=C([O-])[O-] MCULE-4180727513 [1,0,0,0,0,0|3,0,0]=4 450 B3R0.2 O=C([O-])[O-] MCULE-4294265087 [1,0,0,0,0,0|3,0,0]=4 451 B3R0.2 O=C([O-])[O-] MCULE-5127021441 [1,0,0,0,0,0|3,0,0]=4 452 B3R0.2 O=C([O-])[O-] MCULE-5345790821 [1,0,0,0,0,0|3,0,0]=4 453 B3R0.2 O=C([O-])[O-] MCULE-6214917073 [1,0,0,0,0,0|3,0,0]=4 454 B3R0.2 O=C([O-])[O-] MCULE-6757968396 [1,0,0,0,0,0|3,0,0]=4 455 B3R0.2 O=C([O-])[O-] MCULE-7714638074 [1,0,0,0,0,0|3,0,0]=4 456 B3R0.2 O=C([O-])[O-] MCULE-8731559807 [1,0,0,0,0,0|3,0,0]=4 457 B3R0.2 O=I(=O)O MCULE-6335954469 [1,0,0,0,0,0|3,0,0]=4 458 B3R0.2 O=I(=O)O MCULE-7906123102 [1,0,0,0,0,0|3,0,0]=4 459 B3R0.2 O=N(=O)=O MCULE-1959019189 [1,0,0,0,0,0|2,0,1]=4 460 B3R0.2 O=N(=O)=O MCULE-2708947237 [1,0,0,0,0,0|2,0,1]=4 461 B3R0.2 O=N(=O)=O MCULE-5271549027 [1,0,0,0,0,0|2,0,1]=4 462 B3R0.2 O=N(=O)=O MCULE-7854950179 [1,0,0,0,0,0|2,0,1]=4 463 B3R0.2 O=N(=O)=O MCULE-9135268225 [1,0,0,0,0,0|2,0,1]=4 464 B3R0.2 O=N(=O)O MCULE-5926867268 [1,0,0,0,0,0|2,0,1]=4 465 B3R0.2 O=N(=O)O MCULE-8501453871 [1,0,0,0,0,0|2,0,1]=4 466 B3R0.2 O=N(=O)[O-] MCULE-6774438996 [1,0,0,0,0,0|2,0,1]=4 467 B3R0.2 O=P(=O)O MCULE-3007887617 [1,0,0,0,0,0|2,1,0]=4 468 B3R0.2 O=P(=O)[O-] MCULE-1412944829 [1,0,0,0,0,0|2,1,0]=4 469 B3R0.2 O=P(=O)[O-] MCULE-4322560801 [1,0,0,0,0,0|2,1,0]=4 470 B3R0.2 O=P(=O)[O-] MCULE-6900289315 [1,0,0,0,0,0|2,1,0]=4 471 B3R0.2 O=P(O)O MCULE-8889145943 [1,0,0,0,0,0|2,1,0]=4 472 B3R0.2 O=P([O-])O MCULE-3773885400 [1,0,0,0,0,0|2,1,0]=4 473 B3R0.2 O=P([O-])O MCULE-6745348516 [1,0,0,0,0,0|2,1,0]=4 474 B3R0.2 O=S(=O)=O MCULE-3497956371 [1,0,0,0,0,0|3,0,0]=4 475 B3R0.2 O=S(=O)O MCULE-7070708516 [1,0,0,0,0,0|3,0,0]=4 476 B3R0.2 O=S(Br)Br MCULE-8128997630 [1,0,0,0,0,0|3,0,0]=4 477 B3R0.2 O=S(F)F MCULE-8893634369 [1,0,0,0,0,0|3,0,0]=4 478 B3R0.2 O=S(O)O MCULE-3188569799 [1,0,0,0,0,0|3,0,0]=4 479 B3R0.2 O=S(O)O MCULE-7812738469 [1,0,0,0,0,0|3,0,0]=4 480 B3R0.2 O=S([O-])[O-] MCULE-6510216426 [1,0,0,0,0,0|3,0,0]=4 481 B3R0.2 O=[Se](Cl)Cl MCULE-7426137156 [1,0,0,0,0,0|3,0,0]=4 482 B3R0.2 O=[Se](O)O MCULE-9081277469 [1,0,0,0,0,0|3,0,0]=4 483 B3R0.2 O=[Si](O)O MCULE-3228936275 [1,0,0,0,0,0|3,0,0]=4 484 B5R0.1 C#CCC(C)C MCULE-2506063278 [0,1,0,0,0,0|2,0,1]=4 485 B5R0.1 C#CCN(C)C MCULE-1589925874 [0,1,0,0,0,0|1,0,1]=3 486 B5R0.1 C/C(=C/C#N)/N MCULE-2195544039 [0,1,0,0,0,0|3,0,0]=4 487 B5R0.1 C/C(=C/CI)/I MCULE-4907089043 [0,1,0,0,0,0|3,0,0]=4 488 B5R0.1 C/C(=C/CN)/Cl MCULE-1091573118 [0,1,0,0,0,0|3,0,0]=4 489 B5R0.1 C/C(=C/CN)/Cl MCULE-8112023611 [0,1,0,0,0,0|3,0,0]=4 490 B5R0.1 C/C(=C\CCl)/Cl MCULE-6679259233 [0,1,0,0,0,0|3,0,0]=4 491 B5R0.1 C/C=C/C(=O)C MCULE-2109656516 [0,1,0,0,0,0|3,0,0]=4 492 B5R0.1 C/C=C/C(C)C MCULE-8705863155 [0,1,0,0,0,0|2,0,0]=3 493 B5R0.1 C/C=C/C(C)O MCULE-3191147789 [0,1,0,0,0,0|3,0,0]=4 494 B5R0.1 C=CC=C(C)C MCULE-7590870659 [0,1,0,0,0,0|2,0,0]=3 495 B5R0.1 C=CCC(=C)C MCULE-6294070836 [0,1,0,0,0,0|2,0,1]=4 496 B5R0.1 C=CCC(C)Br MCULE-5638987302 [0,1,0,0,0,0|3,0,0]=4 497 B5R0.1 C=CCC(C)C MCULE-4586731422 [0,1,0,0,0,0|2,0,0]=3 498 B5R0.1 C=CCC(C)N MCULE-5354228552 [0,1,0,0,0,0|3,0,0]=4 499 B5R0.1 C=CCC(C)N MCULE-9454660067 [0,1,0,0,0,0|3,0,0]=4 500 B5R0.1 C=CCC(C)O MCULE-7724200334 [0,1,0,0,0,0|3,0,0]=4 501 B5R0.1 C=CCC(C)O MCULE-9910771503 [0,1,0,0,0,0|3,0,0]=4 502 B5R0.1 C=CCN(C)C MCULE-6958853335 [0,1,0,0,0,0|1,0,0]=2 503 B5R0.1 C=CC[C@@H](C)O MCULE-1663575568 [0,1,0,0,0,0|3,0,0]=4 504 B5R0.1 C=CC[C@@H](C)O MCULE-3971480179 [0,1,0,0,0,0|3,0,0]=4 505 B5R0.1 C=CC[C@H](C)N MCULE-2398654329 [0,1,0,0,0,0|3,0,0]=4 506 B5R0.1 C=CC[C@H](C)N MCULE-5817451810 [0,1,0,0,0,0|3,0,0]=4 507 B5R0.1 C=CC[C@H](C)O MCULE-5783959808 [0,1,0,0,0,0|3,0,0]=4 508 B5R0.1 C=CC[C@H](C)O MCULE-6146696600 [0,1,0,0,0,0|3,0,0]=4 509 B5R0.1 C=CNC(=O)C MCULE-1260296806 [0,1,0,0,0,0|3,0,0]=4 510 B5R0.1 C=COC(=O)C MCULE-7626795765 [0,1,0,0,0,0|3,0,0]=4 511 B5R0.1 C=COC(C)C MCULE-6339383821 [0,1,0,0,0,0|2,0,0]=3 512 B5R0.1 CC#CC(C)C MCULE-9841369985 [0,1,0,0,0,0|2,0,1]=4 513 B5R0.1 CC(=CC#N)C MCULE-7179601066 [0,1,0,0,0,0|2,0,0]=3 514 B5R0.1 CC(=CC#N)N MCULE-7342293837 [0,1,0,0,0,0|3,0,0]=4 515 B5R0.1 CC(=CC=O)C MCULE-7002222435 [0,1,0,0,0,0|1,0,0]=2 516 B5R0.1 CC(=CC=O)Cl MCULE-2279693190 [0,1,0,0,0,0|2,0,0]=3 517 B5R0.1 CC(=CC=O)N MCULE-2659507627 [0,1,0,0,0,0|2,0,0]=3 518 B5R0.1 CC(=CCBr)C MCULE-7961276795 [0,1,0,0,0,0|2,0,0]=3 519 B5R0.1 CC(=CCCl)C MCULE-1110417103 [0,1,0,0,0,0|2,0,0]=3 520 B5R0.1 CC(=CCCl)Cl MCULE-9735045489 [0,1,0,0,0,0|3,0,0]=4 521 B5R0.1 CC(=CCI)I MCULE-4204968539 [0,1,0,0,0,0|3,0,0]=4 522 B5R0.1 CC(=CCN)C MCULE-7220252581 [0,1,0,0,0,0|2,0,0]=3 523 B5R0.1 CC(=CCN)C MCULE-8394581250 [0,1,0,0,0,0|2,0,0]=3 524 B5R0.1 CC(=CCN)Cl MCULE-1749173363 [0,1,0,0,0,0|3,0,0]=4 525 B5R0.1 CC(=CCN)Cl MCULE-5722512850 [0,1,0,0,0,0|3,0,0]=4 526 B5R0.1 CC(=CCO)C MCULE-3984123588 [0,1,0,0,0,0|1,0,1]=3 527 B5R0.1 CC(=CCO)Cl MCULE-6459066496 [0,1,0,0,0,0|2,0,1]=4 528 B5R0.1 CC(=CCO)I MCULE-4600854759 [0,1,0,0,0,0|2,0,1]=4 529 B5R0.1 CC(=CCS)C MCULE-4180446913 [0,1,0,0,0,0|1,1,0]=3 530 B5R0.1 CC(=O)/C=N/O MCULE-5424156575 [0,1,0,0,0,0|2,0,1]=4 531 B5R0.1 CC(=O)/C=N\O MCULE-9083768531 [0,1,0,0,0,0|2,0,1]=4 532 B5R0.1 CC(=O)C=C=O MCULE-4335598177 [0,1,0,0,0,0|2,0,0]=3 533 B5R0.1 CC(=O)C=NO MCULE-5513006918 [0,1,0,0,0,0|2,0,1]=4 534 B5R0.1 CC(=O)N=S=O MCULE-1420371815 [0,1,0,0,0,0|3,0,0]=4 535 B5R0.1 CC(C)/C=N/O MCULE-3201457095 [0,1,0,0,0,0|1,0,1]=3 536 B5R0.1 CC(C)C=NO MCULE-9842574696 [0,1,0,0,0,0|1,0,1]=3 537 B5R0.1 CC(C)CC#N MCULE-4346986727 [0,1,0,0,0,0|2,0,1]=4 538 B5R0.1 CC(C)CC=O MCULE-2939497534 [0,1,0,0,0,0|1,0,0]=2 539 B5R0.1 CC(C)CCBr MCULE-7163010428 [0,1,0,0,0,0|2,0,1]=4 540 B5R0.1 CC(C)CCCl MCULE-8360122696 [0,1,0,0,0,0|2,0,1]=4 541 B5R0.1 CC(C)CCCl MCULE-9017922949 [0,1,0,0,0,0|2,0,1]=4 542 B5R0.1 CC(C)CCI MCULE-4934529500 [0,1,0,0,0,0|2,0,1]=4 543 B5R0.1 CC(C)CCN MCULE-3081003576 [0,1,0,0,0,0|2,0,1]=4 544 B5R0.1 CC(C)CCN MCULE-5118782389 [0,1,0,0,0,0|2,0,1]=4 545 B5R0.1 CC(C)CCN MCULE-5217981670 [0,1,0,0,0,0|2,0,1]=4 546 B5R0.1 CC(C)CCN MCULE-6280940933 [0,1,0,0,0,0|2,0,1]=4 547 B5R0.1 CC(C)CCO MCULE-7411270401 [0,1,0,0,0,0|1,0,2]=4 548 B5R0.1 CC(C)CCS MCULE-7115473363 [0,1,0,0,0,0|1,1,1]=4 549 B5R0.1 CC(C)CNN MCULE-6797887001 [0,1,0,0,0,0|2,0,1]=4 550 B5R0.1 CC(C)CNN MCULE-9592971233 [0,1,0,0,0,0|2,0,1]=4 551 B5R0.1 CC(C)CNN MCULE-9725792452 [0,1,0,0,0,0|2,0,1]=4 552 B5R0.1 CC(C)CON MCULE-3476786246 [0,1,0,0,0,0|1,0,2]=4 553 B5R0.1 CC(C)CON MCULE-4450654727 [0,1,0,0,0,0|1,0,2]=4 554 B5R0.1 CC(C)N=C=O MCULE-8392299675 [0,1,0,0,0,0|1,0,1]=3 555 B5R0.1 CC(C)N=C=S MCULE-7689456429 [0,1,0,0,0,0|1,1,1]=4 556 B5R0.1 CC(C)N=N#N MCULE-4920057169 [0,1,0,0,0,0|3,0,0]=4 557 B5R0.1 CC(C)NC=O MCULE-1764010394 [0,1,0,0,0,0|1,0,0]=2 558 B5R0.1 CC(C)OC=O MCULE-8263698122 [0,1,0,0,0,0|1,0,0]=2 559 B5R0.1 CC(C)OCCl MCULE-3680602217 [0,1,0,0,0,0|2,0,1]=4 560 B5R0.1 CC(C)SC#N MCULE-2480992384 [0,1,0,0,0,0|2,0,1]=4 561 B5R0.1 CC(C)SCCl MCULE-3836735379 [0,1,0,0,0,0|2,0,1]=4 562 B5R0.1 CC=CC(=O)C MCULE-4826977340 [0,1,0,0,0,0|3,0,0]=4 563 B5R0.1 CC=CC(C)C MCULE-9898453837 [0,1,0,0,0,0|2,0,0]=3 564 B5R0.1 CC=CC(C)O MCULE-4806592836 [0,1,0,0,0,0|3,0,0]=4 565 B5R0.1 CC=NN(C)C MCULE-7039280578 [0,1,0,0,0,0|1,0,0]=2 566 B5R0.1 CCC=C(C)C MCULE-2405063894 [0,1,0,0,0,0|2,0,0]=3 567 B5R0.1 CCCC(C)C MCULE-9604552974 [0,1,0,0,0,0|2,0,1]=4 568 B5R0.1 CCCN(C)C MCULE-8702643596 [0,1,0,0,0,0|1,0,1]=3 569 B5R0.1 CCNC(C)C MCULE-8064118469 [0,1,0,0,0,0|2,0,1]=4 570 B5R0.1 CCOC(C)C MCULE-1934548340 [0,1,0,0,0,0|2,0,1]=4 571 B5R0.1 CCSC(C)C MCULE-3738251898 [0,1,0,0,0,0|2,0,1]=4 572 B5R0.1 CN(C)CC#N MCULE-7617361185 [0,1,0,0,0,0|1,0,1]=3 573 B5R0.1 CN(C)CC=O MCULE-1229218563 [0,1,0,0,0,0|0,0,0]=1 574 B5R0.1 CN(C)CC=O MCULE-3577561950 [0,1,0,0,0,0|0,0,0]=1 575 B5R0.1 CN(C)CC=O MCULE-4493766862 [0,1,0,0,0,0|0,0,0]=1 576 B5R0.1 CN(C)CC=O MCULE-8123455398 [0,1,0,0,0,0|0,0,0]=1 577 B5R0.1 CN(C)CCBr MCULE-4844398053 [0,1,0,0,0,0|1,0,1]=3 578 B5R0.1 CN(C)CCCl MCULE-4297554717 [0,1,0,0,0,0|1,0,1]=3 579 B5R0.1 CN(C)CCCl MCULE-4465544992 [0,1,0,0,0,0|1,0,1]=3 580 B5R0.1 CN(C)CCI MCULE-4687894526 [0,1,0,0,0,0|1,0,1]=3 581 B5R0.1 CN(C)CCI MCULE-7464680246 [0,1,0,0,0,0|1,0,1]=3 582 B5R0.1 CN(C)CCI MCULE-9051868668 [0,1,0,0,0,0|1,0,1]=3 583 B5R0.1 CN(C)CCN MCULE-6693759372 [0,1,0,0,0,0|1,0,1]=3 584 B5R0.1 CN(C)CCN MCULE-6929925748 [0,1,0,0,0,0|1,0,1]=3 585 B5R0.1 CN(C)CCN MCULE-7881547574 [0,1,0,0,0,0|1,0,1]=3 586 B5R0.1 CN(C)CCO MCULE-5715813465 [0,1,0,0,0,0|0,0,2]=3 587 B5R0.1 CN(C)CCO MCULE-7567469160 [0,1,0,0,0,0|0,0,2]=3 588 B5R0.1 CN(C)CCO MCULE-9024108074 [0,1,0,0,0,0|0,0,2]=3 589 B5R0.1 CN(C)CCS MCULE-4356815596 [0,1,0,0,0,0|0,1,1]=3 590 B5R0.1 CN(C)CCS MCULE-4611688723 [0,1,0,0,0,0|0,1,1]=3 591 B5R0.1 CN(C)CCS MCULE-6259585517 [0,1,0,0,0,0|0,1,1]=3 592 B5R0.1 CN(C)NC=O MCULE-1557896286 [0,1,0,0,0,0|0,0,0]=1 593 B5R0.1 CN(N)CCN MCULE-2782966878 [0,1,0,0,0,0|2,0,1]=4 594 B5R0.1 CN=CN(C)C MCULE-2522407175 [0,1,0,0,0,0|1,0,0]=2 595 B5R0.1 CNCC(C)C MCULE-6582386339 [0,1,0,0,0,0|2,0,1]=4 596 B5R0.1 CNCC(C)C MCULE-6856717783 [0,1,0,0,0,0|2,0,1]=4 597 B5R0.1 CNN=C(C)C MCULE-6307375856 [0,1,0,0,0,0|3,0,0]=4 598 B5R0.1 COC=C(C)C MCULE-6348538911 [0,1,0,0,0,0|1,0,1]=3 599 B5R0.1 COCN(C)C MCULE-1963225930 [0,1,0,0,0,0|0,0,2]=3 600 B5R0.1 CSC=[N+](C)C MCULE-3818988576 [0,1,0,0,0,0|0,1,1]=3 601 B5R0.1 CSC=[N+](C)C MCULE-8015580251 [0,1,0,0,0,0|0,1,1]=3 602 B5R0.1 CSCN(C)C MCULE-2931143051 [0,1,0,0,0,0|0,1,1]=3 603 B5R0.1 C[NH+](C)CCBr MCULE-4990293495 [0,1,0,0,0,0|1,0,2]=4 604 B5R0.1 C[S+](C)CCCl MCULE-1305595131 [0,1,0,0,0,0|2,0,1]=4 605 B5R0.1 C[S+](C)CCCl MCULE-9761617787 [0,1,0,0,0,0|2,0,1]=4 606 B5R0.1 N=C(N)NC=O MCULE-2702198735 [0,1,0,0,0,0|3,0,0]=4 607 B5R0.1 [NH+](=CN(C)C)C MCULE-8771175095 [0,1,0,0,0,0|1,0,0]=2 608 B5R0.3 C#CC(C)NC MCULE-6738130869 [0,1,0,0,0,0|2,0,1]=4 609 B5R0.3 C#CC(C)OC MCULE-3702592933 [0,1,0,0,0,0|2,0,1]=4 610 B5R0.3 C#CC(C)OC MCULE-3806443816 [0,1,0,0,0,0|2,0,1]=4 611 B5R0.3 C#C[C@H](C)OC MCULE-9002531152 [0,1,0,0,0,0|2,0,1]=4 612 B5R0.3 C/C(=C\Br)/C#N MCULE-5132213304 [0,1,0,0,0,0|2,0,1]=4 613 B5R0.3 C/C(=C\N)/C=O MCULE-4713460468 [0,1,0,0,0,0|1,0,1]=3 614 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [0,1,0,0,0,0|2,0,0]=3 615 B5R0.3 C/C=C(\C)/C=O MCULE-2818872726 [0,1,0,0,0,0|1,0,0]=2 616 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [0,1,0,0,0,0|2,0,0]=3 617 B5R0.3 C=C(C=O)CC MCULE-2875154067 [0,1,0,0,0,0|1,0,1]=3 618 B5R0.3 C=C/C(=C/C)/C MCULE-6445909882 [0,1,0,0,0,0|2,0,0]=3 619 B5R0.3 C=CC(=CC)C MCULE-8585683674 [0,1,0,0,0,0|2,0,0]=3 620 B5R0.3 C=CC(=O)CC MCULE-7277696617 [0,1,0,0,0,0|3,0,0]=4 621 B5R0.3 C=CC(=O)NC MCULE-5619481947 [0,1,0,0,0,0|3,0,0]=4 622 B5R0.3 C=CC(=O)OC MCULE-6010665978 [0,1,0,0,0,0|3,0,0]=4 623 B5R0.3 C=CC(C)C#N MCULE-7507500865 [0,1,0,0,0,0|2,0,1]=4 624 B5R0.3 C=CC(C)CC MCULE-8112547661 [0,1,0,0,0,0|2,0,0]=3 625 B5R0.3 C=CC(C)NC MCULE-1929679074 [0,1,0,0,0,0|2,0,0]=3 626 B5R0.3 C=CC(C)NC MCULE-6382339452 [0,1,0,0,0,0|2,0,0]=3 627 B5R0.3 C=CC(C)ON MCULE-2385478473 [0,1,0,0,0,0|3,0,0]=4 628 B5R0.3 C=CC(C)ON MCULE-3428023923 [0,1,0,0,0,0|3,0,0]=4 629 B5R0.3 C=CC(Cl)CCl MCULE-8000466907 [0,1,0,0,0,0|3,0,0]=4 630 B5R0.3 C=CC(N)CC MCULE-6270835453 [0,1,0,0,0,0|3,0,0]=4 631 B5R0.3 C=CC(N)CC MCULE-7920121163 [0,1,0,0,0,0|3,0,0]=4 632 B5R0.3 C=CC(N)CO MCULE-2457433196 [0,1,0,0,0,0|3,0,0]=4 633 B5R0.3 C=CC(N)CO MCULE-6697949182 [0,1,0,0,0,0|3,0,0]=4 634 B5R0.3 C=CC(N)CO MCULE-7137123222 [0,1,0,0,0,0|3,0,0]=4 635 B5R0.3 C=CC(N)CO MCULE-8388687355 [0,1,0,0,0,0|3,0,0]=4 636 B5R0.3 C=CC(O)CBr MCULE-3538023814 [0,1,0,0,0,0|3,0,0]=4 637 B5R0.3 C=CC(O)CC MCULE-2794806228 [0,1,0,0,0,0|3,0,0]=4 638 B5R0.3 C=CC(O)CN MCULE-3472823475 [0,1,0,0,0,0|3,0,0]=4 639 B5R0.3 C=CC(O)CO MCULE-6172654550 [0,1,0,0,0,0|3,0,0]=4 640 B5R0.3 C=C[C@@H](N)CO MCULE-1000343618 [0,1,0,0,0,0|3,0,0]=4 641 B5R0.3 C=C[C@@H](N)CO MCULE-1074988940 [0,1,0,0,0,0|3,0,0]=4 642 B5R0.3 C=C[C@@H](N)CO MCULE-3685491078 [0,1,0,0,0,0|3,0,0]=4 643 B5R0.3 C=C[C@@H](N)CO MCULE-4969611575 [0,1,0,0,0,0|3,0,0]=4 644 B5R0.3 C=C[C@@H](O)CO MCULE-5957455616 [0,1,0,0,0,0|3,0,0]=4 645 B5R0.3 C=C[C@H](N)CO MCULE-2834725512 [0,1,0,0,0,0|3,0,0]=4 646 B5R0.3 C=C[C@H](N)CO MCULE-3281738311 [0,1,0,0,0,0|3,0,0]=4 647 B5R0.3 C=C[C@H](N)CO MCULE-3551585090 [0,1,0,0,0,0|3,0,0]=4 648 B5R0.3 C=C[C@H](N)CO MCULE-9055556349 [0,1,0,0,0,0|3,0,0]=4 649 B5R0.3 C=C[C@H](O)CO MCULE-6068203844 [0,1,0,0,0,0|3,0,0]=4 650 B5R0.3 C=C[C@H](O)CO MCULE-9367072182 [0,1,0,0,0,0|3,0,0]=4 651 B5R0.3 CC(=CBr)C#N MCULE-9263455697 [0,1,0,0,0,0|2,0,1]=4 652 B5R0.3 CC(=CCl)CCl MCULE-2732105685 [0,1,0,0,0,0|2,0,0]=3 653 B5R0.3 CC(=CI)CI MCULE-3347686188 [0,1,0,0,0,0|2,0,0]=3 654 B5R0.3 CC(=CI)CO MCULE-8491569199 [0,1,0,0,0,0|2,0,0]=3 655 B5R0.3 CC(=CN)C=O MCULE-5507488903 [0,1,0,0,0,0|1,0,1]=3 656 B5R0.3 CC(=NO)CS MCULE-9694340512 [0,1,0,0,0,0|2,0,1]=4 657 B5R0.3 CC(C#N)CCl MCULE-9290621020 [0,1,0,0,0,0|2,0,1]=4 658 B5R0.3 CC(C#N)CN MCULE-8151367276 [0,1,0,0,0,0|2,0,1]=4 659 B5R0.3 CC(C#N)CO MCULE-1644391554 [0,1,0,0,0,0|2,0,1]=4 660 B5R0.3 CC(CBr)CBr MCULE-7586113999 [0,1,0,0,0,0|2,0,1]=4 661 B5R0.3 CC(CCl)CBr MCULE-5101754687 [0,1,0,0,0,0|2,0,1]=4 662 B5R0.3 CC(CCl)CCl MCULE-1169456620 [0,1,0,0,0,0|2,0,1]=4 663 B5R0.3 CC(CI)CI MCULE-4568725580 [0,1,0,0,0,0|2,0,1]=4 664 B5R0.3 CC(CN)CCl MCULE-2423692318 [0,1,0,0,0,0|2,0,1]=4 665 B5R0.3 CC(CN)CCl MCULE-8419541212 [0,1,0,0,0,0|2,0,1]=4 666 B5R0.3 CC(CN)CN MCULE-1464804013 [0,1,0,0,0,0|2,0,1]=4 667 B5R0.3 CC(CN)CN MCULE-3273307813 [0,1,0,0,0,0|2,0,1]=4 668 B5R0.3 CC(CN)CO MCULE-5880795484 [0,1,0,0,0,0|1,0,2]=4 669 B5R0.3 CC(CN)CO MCULE-8083007887 [0,1,0,0,0,0|1,0,2]=4 670 B5R0.3 CC(CO)CBr MCULE-3815333295 [0,1,0,0,0,0|1,0,2]=4 671 B5R0.3 CC(CO)CBr MCULE-5695891877 [0,1,0,0,0,0|1,0,2]=4 672 B5R0.3 CC(CO)CO MCULE-2340730326 [0,1,0,0,0,0|1,0,2]=4 673 B5R0.3 CC(CO)CS MCULE-1990992504 [0,1,0,0,0,0|1,0,2]=4 674 B5R0.3 CC(CO)NN MCULE-3362748538 [0,1,0,0,0,0|3,0,0]=4 675 B5R0.3 CC(CO)NN MCULE-4440318216 [0,1,0,0,0,0|3,0,0]=4 676 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [0,1,0,0,0,0|2,0,1]=4 677 B5R0.3 CC=C(Br)C=O MCULE-4703333701 [0,1,0,0,0,0|2,0,0]=3 678 B5R0.3 CC=C(C)C#N MCULE-4009455127 [0,1,0,0,0,0|2,0,1]=4 679 B5R0.3 CC=C(C)C=O MCULE-9453566957 [0,1,0,0,0,0|1,0,0]=2 680 B5R0.3 CC=C(C)CC MCULE-5790494157 [0,1,0,0,0,0|2,0,0]=3 681 B5R0.3 CC=C(C)CCl MCULE-2444762050 [0,1,0,0,0,0|2,0,0]=3 682 B5R0.3 CCC(=NO)C MCULE-1859652505 [0,1,0,0,0,0|2,0,1]=4 683 B5R0.3 CCC(Br)C=O MCULE-3064952987 [0,1,0,0,0,0|2,0,0]=3 684 B5R0.3 CCC(C)C#N MCULE-6204122967 [0,1,0,0,0,0|2,0,1]=4 685 B5R0.3 CCC(C)C=O MCULE-2523669899 [0,1,0,0,0,0|1,0,0]=2 686 B5R0.3 CCC(C)CBr MCULE-5451416952 [0,1,0,0,0,0|2,0,1]=4 687 B5R0.3 CCC(C)CC MCULE-2542807917 [0,1,0,0,0,0|2,0,1]=4 688 B5R0.3 CCC(C)CCl MCULE-7450386476 [0,1,0,0,0,0|2,0,1]=4 689 B5R0.3 CCC(C)CI MCULE-5444509280 [0,1,0,0,0,0|2,0,1]=4 690 B5R0.3 CCC(C)CN MCULE-2777327284 [0,1,0,0,0,0|2,0,1]=4 691 B5R0.3 CCC(C)CN MCULE-7014901600 [0,1,0,0,0,0|2,0,1]=4 692 B5R0.3 CCC(C)CO MCULE-6521026296 [0,1,0,0,0,0|1,0,2]=4 693 B5R0.3 CCC(C)CS MCULE-7795095685 [0,1,0,0,0,0|1,1,1]=4 694 B5R0.3 CCC(C)NC MCULE-2676584804 [0,1,0,0,0,0|2,0,1]=4 695 B5R0.3 CCC(C)NC MCULE-6158046887 [0,1,0,0,0,0|2,0,1]=4 696 B5R0.3 CCC(C)NN MCULE-6074476998 [0,1,0,0,0,0|3,0,0]=4 697 B5R0.3 CCC(C)NN MCULE-8130021960 [0,1,0,0,0,0|3,0,0]=4 698 B5R0.3 CCC(C)NN MCULE-8519369369 [0,1,0,0,0,0|3,0,0]=4 699 B5R0.3 CCC(C)NO MCULE-1247092627 [0,1,0,0,0,0|2,0,1]=4 700 B5R0.3 CCC(C)NO MCULE-6169819668 [0,1,0,0,0,0|2,0,1]=4 701 B5R0.3 CCC(C)OC MCULE-7354431606 [0,1,0,0,0,0|2,0,1]=4 702 B5R0.3 CCC(C)ON MCULE-2907890438 [0,1,0,0,0,0|3,0,0]=4 703 B5R0.3 CCC(C)ON MCULE-4364205813 [0,1,0,0,0,0|3,0,0]=4 704 B5R0.3 CCC(Cl)C=O MCULE-5238776091 [0,1,0,0,0,0|2,0,0]=3 705 B5R0.3 CCN(C)C#N MCULE-1247613129 [0,1,0,0,0,0|1,0,1]=3 706 B5R0.3 CCN(C)C=O MCULE-2308681384 [0,1,0,0,0,0|0,0,0]=1 707 B5R0.3 CCN(C)CC MCULE-7207964917 [0,1,0,0,0,0|1,0,1]=3 708 B5R0.3 CCN(N)CC MCULE-9853386945 [0,1,0,0,0,0|2,0,1]=4 709 B5R0.3 CCN(N)CC MCULE-9962617398 [0,1,0,0,0,0|2,0,1]=4 710 B5R0.3 CCN(O)CC MCULE-6022935768 [0,1,0,0,0,0|2,0,1]=4 711 B5R0.3 CC[C@@H](C)CBr MCULE-5675886072 [0,1,0,0,0,0|2,0,1]=4 712 B5R0.3 CC[C@@H](C)CN MCULE-7612408107 [0,1,0,0,0,0|2,0,1]=4 713 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [0,1,0,0,0,0|1,0,2]=4 714 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [0,1,0,0,0,0|1,0,2]=4 715 B5R0.3 CC[C@H](C)C#N MCULE-9118306872 [0,1,0,0,0,0|2,0,1]=4 716 B5R0.3 CC[C@H](C)CBr MCULE-3263714447 [0,1,0,0,0,0|2,0,1]=4 717 B5R0.3 CC[C@H](C)CBr MCULE-3384648570 [0,1,0,0,0,0|2,0,1]=4 718 B5R0.3 CC[C@H](C)CCl MCULE-6795758745 [0,1,0,0,0,0|2,0,1]=4 719 B5R0.3 CC[C@H](C)CCl MCULE-8147276830 [0,1,0,0,0,0|2,0,1]=4 720 B5R0.3 CC[C@H](C)CI MCULE-9690776923 [0,1,0,0,0,0|2,0,1]=4 721 B5R0.3 CC[C@H](C)CN MCULE-1380819951 [0,1,0,0,0,0|2,0,1]=4 722 B5R0.3 CC[C@H](C)CN MCULE-1396096112 [0,1,0,0,0,0|2,0,1]=4 723 B5R0.3 CC[C@H](C)CN MCULE-2971933862 [0,1,0,0,0,0|2,0,1]=4 724 B5R0.3 CC[C@H](C)CN MCULE-3698084674 [0,1,0,0,0,0|2,0,1]=4 725 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [0,1,0,0,0,0|1,0,2]=4 726 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [0,1,0,0,0,0|1,0,2]=4 727 B5R0.3 CN(C#N)C#N MCULE-8327333743 [0,1,0,0,0,0|1,0,2]=4 728 B5R0.3 CN(C=O)C=O MCULE-7774435044 [0,1,0,0,0,0|0,0,1]=2 729 B5R0.3 CNC(C)C#N MCULE-6126262950 [0,1,0,0,0,0|2,0,1]=4 730 B5R0.3 CNC(C)C#N MCULE-8508083404 [0,1,0,0,0,0|2,0,1]=4 731 B5R0.3 CNC(C)CN MCULE-1599162912 [0,1,0,0,0,0|2,0,1]=4 732 B5R0.3 CNC(C)CN MCULE-1637391260 [0,1,0,0,0,0|2,0,1]=4 733 B5R0.3 CNC(C)CO MCULE-3841057780 [0,1,0,0,0,0|1,0,2]=4 734 B5R0.3 CNC(C)CO MCULE-6474892275 [0,1,0,0,0,0|1,0,2]=4 735 B5R0.3 CN[C@@H](C)CO MCULE-1633741835 [0,1,0,0,0,0|1,0,2]=4 736 B5R0.3 CN[C@@H](C)CO MCULE-6736108875 [0,1,0,0,0,0|1,0,2]=4 737 B5R0.3 CN[C@@H](C)CO MCULE-7554801630 [0,1,0,0,0,0|1,0,2]=4 738 B5R0.3 CN[C@@H](C)CO MCULE-9312521497 [0,1,0,0,0,0|1,0,2]=4 739 B5R0.3 CN[C@H](C)CO MCULE-2402322400 [0,1,0,0,0,0|1,0,2]=4 740 B5R0.3 CN[C@H](C)CO MCULE-4362091386 [0,1,0,0,0,0|1,0,2]=4 741 B5R0.3 CN[C@H](C)CO MCULE-5426855707 [0,1,0,0,0,0|1,0,2]=4 742 B5R0.3 CN[C@H](C)CO MCULE-9777995604 [0,1,0,0,0,0|1,0,2]=4 743 B5R0.3 COC(=O)C=O MCULE-2685327079 [0,1,0,0,0,0|2,0,0]=3 744 B5R0.3 COC(C)C#N MCULE-7716445717 [0,1,0,0,0,0|2,0,1]=4 745 B5R0.3 COC(C)CBr MCULE-6831960550 [0,1,0,0,0,0|2,0,1]=4 746 B5R0.3 COC(C)CCl MCULE-6614968111 [0,1,0,0,0,0|2,0,1]=4 747 B5R0.3 COC(C)CI MCULE-9561627722 [0,1,0,0,0,0|2,0,1]=4 748 B5R0.3 COC(C)CN MCULE-1378513525 [0,1,0,0,0,0|2,0,1]=4 749 B5R0.3 COC(C)CN MCULE-6114730248 [0,1,0,0,0,0|2,0,1]=4 750 B5R0.3 COC(C)CN MCULE-7516064224 [0,1,0,0,0,0|2,0,1]=4 751 B5R0.3 COC(C)CN MCULE-8277408054 [0,1,0,0,0,0|2,0,1]=4 752 B5R0.3 COC(C)CO MCULE-5269990702 [0,1,0,0,0,0|1,0,2]=4 753 B5R0.3 COC(C)CO MCULE-7173093332 [0,1,0,0,0,0|1,0,2]=4 754 B5R0.3 COC(C)OC MCULE-8241616143 [0,1,0,0,0,0|3,0,0]=4 755 B5R0.3 CON(C)C=O MCULE-6743121315 [0,1,0,0,0,0|0,0,0]=1 756 B5R0.3 CO[C@@H](C)C#N MCULE-1453263443 [0,1,0,0,0,0|2,0,1]=4 757 B5R0.3 CO[C@@H](C)CN MCULE-1448950160 [0,1,0,0,0,0|2,0,1]=4 758 B5R0.3 CO[C@@H](C)CN MCULE-3784073249 [0,1,0,0,0,0|2,0,1]=4 759 B5R0.3 CO[C@@H](C)CN MCULE-6073633931 [0,1,0,0,0,0|2,0,1]=4 760 B5R0.3 CO[C@@H](C)CN MCULE-9516756218 [0,1,0,0,0,0|2,0,1]=4 761 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [0,1,0,0,0,0|1,0,2]=4 762 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [0,1,0,0,0,0|1,0,2]=4 763 B5R0.3 CO[C@H](C)CN MCULE-4143562009 [0,1,0,0,0,0|2,0,1]=4 764 B5R0.3 CO[C@H](C)CN MCULE-4184510827 [0,1,0,0,0,0|2,0,1]=4 765 B5R0.3 CO[C@H](C)CN MCULE-9625722424 [0,1,0,0,0,0|2,0,1]=4 766 B5R0.3 CO[C@H](C)CN MCULE-9882567615 [0,1,0,0,0,0|2,0,1]=4 767 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [0,1,0,0,0,0|1,0,2]=4 768 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [0,1,0,0,0,0|1,0,2]=4 769 B5R0.3 CS/C(=N/O)/C MCULE-8496912522 [0,1,0,0,0,0|2,0,1]=4 770 B5R0.3 CSC(=NO)C MCULE-1500524467 [0,1,0,0,0,0|2,0,1]=4 771 B5R0.3 CSC(C)CN MCULE-8841622109 [0,1,0,0,0,0|2,0,1]=4 772 B5R0.3 CSC(C)CO MCULE-4646435737 [0,1,0,0,0,0|1,0,2]=4 773 B5R0.3 C[C@@H](CN)CO MCULE-4662215148 [0,1,0,0,0,0|1,0,2]=4 774 B5R0.3 C[C@@H](CN)CO MCULE-7870198689 [0,1,0,0,0,0|1,0,2]=4 775 B5R0.3 C[C@@H](CO)CBr MCULE-3691541800 [0,1,0,0,0,0|1,0,2]=4 776 B5R0.3 C[C@@H](CO)CBr MCULE-4447849056 [0,1,0,0,0,0|1,0,2]=4 777 B5R0.3 C[C@H](CO)CBr MCULE-4031825779 [0,1,0,0,0,0|1,0,2]=4 778 B5R0.3 C[C@H](CO)CBr MCULE-6846167456 [0,1,0,0,0,0|1,0,2]=4 779 B5R0.3 Cl/C=C(\Cl)/CCl MCULE-8945457634 [0,1,0,0,0,0|3,0,0]=4 780 B5R0.3 ClC=C(Cl)CCl MCULE-5187224514 [0,1,0,0,0,0|3,0,0]=4 781 B5R0.3 N#CC(Br)C=O MCULE-3951653048 [0,1,0,0,0,0|2,0,1]=4 782 B5R0.3 N#CC(Cl)C=O MCULE-3516957476 [0,1,0,0,0,0|2,0,1]=4 783 B5R0.3 O=CC(=CO)Br MCULE-8777401868 [0,1,0,0,0,0|2,0,1]=4 784 B5R0.3 O=CC(=C[O-])F MCULE-8068241665 [0,1,0,0,0,0|2,0,1]=4 785 B5R0.3 O=CC(=C[O-])F MCULE-9099292239 [0,1,0,0,0,0|2,0,1]=4 786 B5R0.3 O=CC(=O)CO MCULE-7273475675 [0,1,0,0,0,0|2,0,0]=3 787 B5R0.3 O=CC(Br)C=O MCULE-4387864308 [0,1,0,0,0,0|2,0,1]=4 788 B5R0.3 O=CC(Cl)C=O MCULE-4927811862 [0,1,0,0,0,0|2,0,1]=4 789 B5R0.3 O=CC(O)CO MCULE-9581740191 [0,1,0,0,0,0|2,0,0]=3 790 B5R0.3 O=C[C@@H](O)CO MCULE-3883857491 [0,1,0,0,0,0|2,0,0]=3 791 B5R0.3 O=C[C@@H](O)CO MCULE-7852783182 [0,1,0,0,0,0|2,0,0]=3 792 B5R0.3 O=C[C@H](O)CO MCULE-4574984840 [0,1,0,0,0,0|2,0,0]=3 793 B5R0.4 C#CC(C)(C)Br MCULE-7564666708 [0,1,0,0,0,0|2,0,1]=4 794 B5R0.4 C#CC(C)(C)C MCULE-9881326433 [0,1,0,0,0,0|2,0,1]=4 795 B5R0.4 C#CC(C)(C)Cl MCULE-2301504796 [0,1,0,0,0,0|2,0,1]=4 796 B5R0.4 C#CC(C)(C)N MCULE-3908309106 [0,1,0,0,0,0|2,0,1]=4 797 B5R0.4 C#CC(C)(C)N MCULE-4795277170 [0,1,0,0,0,0|2,0,1]=4 798 B5R0.4 C#CC(C)(C)O MCULE-7045265182 [0,1,0,0,0,0|2,0,1]=4 799 B5R0.4 C#C[Si](C)(C)C MCULE-1913176313 [0,1,0,0,0,0|2,0,1]=4 800 B5R0.4 C=CC(C)(C)C MCULE-9118431864 [0,1,0,0,0,0|2,0,0]=3 801 B5R0.4 C=CC(C)(C)Cl MCULE-4502558407 [0,1,0,0,0,0|2,0,0]=3 802 B5R0.4 C=CC(C)(C)N MCULE-2016559865 [0,1,0,0,0,0|2,0,0]=3 803 B5R0.4 C=CC(C)(C)N MCULE-2690537002 [0,1,0,0,0,0|2,0,0]=3 804 B5R0.4 C=CC(C)(C)O MCULE-5809739830 [0,1,0,0,0,0|2,0,0]=3 805 B5R0.4 C=CC(C)(Cl)Cl MCULE-7431364327 [0,1,0,0,0,0|3,0,0]=4 806 B5R0.4 C=CS(=O)(=O)C MCULE-9709633620 [0,1,0,0,0,0|3,0,0]=4 807 B5R0.4 C=C[N+](C)(C)C MCULE-1874033627 [0,1,0,0,0,0|1,0,1]=3 808 B5R0.4 C=C[N+](C)(C)C MCULE-3871229486 [0,1,0,0,0,0|1,0,1]=3 809 B5R0.4 C=C[Si](C)(C)C MCULE-1884850322 [0,1,0,0,0,0|2,0,0]=3 810 B5R0.4 C=C[Si](C)(C)Cl MCULE-3962013421 [0,1,0,0,0,0|2,0,0]=3 811 B5R0.4 C=C[Si](C)(Cl)Cl MCULE-7977866277 [0,1,0,0,0,0|3,0,0]=4 812 B5R0.4 CC(C)(Br)C#N MCULE-3037751424 [0,1,0,0,0,0|2,0,1]=4 813 B5R0.4 CC(C)(Br)C=O MCULE-8695321251 [0,1,0,0,0,0|1,0,0]=2 814 B5R0.4 CC(C)(Br)CBr MCULE-2393829265 [0,1,0,0,0,0|2,0,1]=4 815 B5R0.4 CC(C)(Br)CCl MCULE-4498591413 [0,1,0,0,0,0|2,0,1]=4 816 B5R0.4 CC(C)(Br)CN MCULE-3220115637 [0,1,0,0,0,0|2,0,1]=4 817 B5R0.4 CC(C)(Br)CN MCULE-3391853433 [0,1,0,0,0,0|2,0,1]=4 818 B5R0.4 CC(C)(Br)CN MCULE-3819869078 [0,1,0,0,0,0|2,0,1]=4 819 B5R0.4 CC(C)(Br)CO MCULE-5949221311 [0,1,0,0,0,0|1,0,2]=4 820 B5R0.4 CC(C)(C)C#N MCULE-9460858712 [0,1,0,0,0,0|2,0,1]=4 821 B5R0.4 CC(C)(C)C=O MCULE-6866358966 [0,1,0,0,0,0|1,0,0]=2 822 B5R0.4 CC(C)(C)CBr MCULE-7545541733 [0,1,0,0,0,0|2,0,1]=4 823 B5R0.4 CC(C)(C)CCl MCULE-1595599055 [0,1,0,0,0,0|2,0,1]=4 824 B5R0.4 CC(C)(C)CI MCULE-6879787789 [0,1,0,0,0,0|2,0,1]=4 825 B5R0.4 CC(C)(C)CN MCULE-1062894260 [0,1,0,0,0,0|2,0,1]=4 826 B5R0.4 CC(C)(C)CN MCULE-2736289460 [0,1,0,0,0,0|2,0,1]=4 827 B5R0.4 CC(C)(C)CN MCULE-5919012916 [0,1,0,0,0,0|2,0,1]=4 828 B5R0.4 CC(C)(C)CN MCULE-6772338754 [0,1,0,0,0,0|2,0,1]=4 829 B5R0.4 CC(C)(C)CN MCULE-8882959753 [0,1,0,0,0,0|2,0,1]=4 830 B5R0.4 CC(C)(C)CO MCULE-4399535684 [0,1,0,0,0,0|1,0,2]=4 831 B5R0.4 CC(C)(C)CS MCULE-7279455818 [0,1,0,0,0,0|1,1,1]=4 832 B5R0.4 CC(C)(C)N=O MCULE-9098145731 [0,1,0,0,0,0|2,0,0]=3 833 B5R0.4 CC(C)(C)NN MCULE-5464543607 [0,1,0,0,0,0|3,0,0]=4 834 B5R0.4 CC(C)(C)NN MCULE-7962318499 [0,1,0,0,0,0|3,0,0]=4 835 B5R0.4 CC(C)(C)NO MCULE-4676405280 [0,1,0,0,0,0|2,0,1]=4 836 B5R0.4 CC(C)(C)NO MCULE-6482556352 [0,1,0,0,0,0|2,0,1]=4 837 B5R0.4 CC(C)(C)NO MCULE-7368313644 [0,1,0,0,0,0|2,0,1]=4 838 B5R0.4 CC(C)(C)ON MCULE-4114810129 [0,1,0,0,0,0|3,0,0]=4 839 B5R0.4 CC(C)(C)ON MCULE-8439583419 [0,1,0,0,0,0|3,0,0]=4 840 B5R0.4 CC(C)(C)OO MCULE-2835127745 [0,1,0,0,0,0|2,0,1]=4 841 B5R0.4 CC(C)(C)O[NH3+] MCULE-3812247399 [0,1,0,0,0,0|3,0,0]=4 842 B5R0.4 CC(C)(C)O[NH3+] MCULE-9310624088 [0,1,0,0,0,0|3,0,0]=4 843 B5R0.4 CC(C)(Cl)CCl MCULE-3251179033 [0,1,0,0,0,0|2,0,1]=4 844 B5R0.4 CC(C)(F)C=O MCULE-4323838362 [0,1,0,0,0,0|1,0,0]=2 845 B5R0.4 CC(C)(F)CBr MCULE-3412419931 [0,1,0,0,0,0|2,0,1]=4 846 B5R0.4 CC(C)(F)CI MCULE-8224019070 [0,1,0,0,0,0|2,0,1]=4 847 B5R0.4 CC(C)(F)CN MCULE-3150098249 [0,1,0,0,0,0|2,0,1]=4 848 B5R0.4 CC(C)(F)CN MCULE-8647719519 [0,1,0,0,0,0|2,0,1]=4 849 B5R0.4 CC(C)(F)CO MCULE-1700621997 [0,1,0,0,0,0|1,0,2]=4 850 B5R0.4 CC(C)(I)C#N MCULE-4123663068 [0,1,0,0,0,0|2,0,1]=4 851 B5R0.4 CC(C)(N)C#N MCULE-4837687196 [0,1,0,0,0,0|2,0,1]=4 852 B5R0.4 CC(C)(N)C#N MCULE-7947575054 [0,1,0,0,0,0|2,0,1]=4 853 B5R0.4 CC(C)(N)CCl MCULE-2098848089 [0,1,0,0,0,0|2,0,1]=4 854 B5R0.4 CC(C)(N)CCl MCULE-2847180011 [0,1,0,0,0,0|2,0,1]=4 855 B5R0.4 CC(C)(N)CF MCULE-3102233948 [0,1,0,0,0,0|2,0,1]=4 856 B5R0.4 CC(C)(N)CF MCULE-9737357598 [0,1,0,0,0,0|2,0,1]=4 857 B5R0.4 CC(C)(N)CN MCULE-4218187677 [0,1,0,0,0,0|2,0,1]=4 858 B5R0.4 CC(C)(N)CN MCULE-6476068080 [0,1,0,0,0,0|2,0,1]=4 859 B5R0.4 CC(C)(N)CO MCULE-4072416202 [0,1,0,0,0,0|1,0,2]=4 860 B5R0.4 CC(C)(N)CO MCULE-4209651459 [0,1,0,0,0,0|1,0,2]=4 861 B5R0.4 CC(C)(N)CO MCULE-6047079177 [0,1,0,0,0,0|1,0,2]=4 862 B5R0.4 CC(C)(O)C#N MCULE-7494613383 [0,1,0,0,0,0|2,0,1]=4 863 B5R0.4 CC(C)(O)C=O MCULE-2581637282 [0,1,0,0,0,0|1,0,0]=2 864 B5R0.4 CC(C)(O)CBr MCULE-6366129174 [0,1,0,0,0,0|2,0,1]=4 865 B5R0.4 CC(C)(O)CCl MCULE-3118028441 [0,1,0,0,0,0|2,0,1]=4 866 B5R0.4 CC(C)(O)CF MCULE-6616447132 [0,1,0,0,0,0|2,0,1]=4 867 B5R0.4 CC(C)(O)CI MCULE-5132198363 [0,1,0,0,0,0|2,0,1]=4 868 B5R0.4 CC(C)(O)CN MCULE-5270413077 [0,1,0,0,0,0|2,0,1]=4 869 B5R0.4 CC(C)(O)CN MCULE-7438555366 [0,1,0,0,0,0|2,0,1]=4 870 B5R0.4 CC(C)(O)CO MCULE-6797456030 [0,1,0,0,0,0|1,0,2]=4 871 B5R0.4 CC(C)(O)CS MCULE-2370088388 [0,1,0,0,0,0|1,1,1]=4 872 B5R0.4 CC(C)(S)CN MCULE-4256015369 [0,1,0,0,0,0|2,0,1]=4 873 B5R0.4 CC(C)(S)CN MCULE-8836856580 [0,1,0,0,0,0|2,0,1]=4 874 B5R0.4 CC(C)(S)CO MCULE-6119329508 [0,1,0,0,0,0|1,0,2]=4 875 B5R0.4 CCC(C)(C)Br MCULE-8895489875 [0,1,0,0,0,0|2,0,1]=4 876 B5R0.4 CCC(C)(C)C MCULE-3388707671 [0,1,0,0,0,0|2,0,1]=4 877 B5R0.4 CCC(C)(C)Cl MCULE-9597829372 [0,1,0,0,0,0|2,0,1]=4 878 B5R0.4 CCC(C)(C)I MCULE-3678105747 [0,1,0,0,0,0|2,0,1]=4 879 B5R0.4 CCC(C)(C)N MCULE-5538333672 [0,1,0,0,0,0|2,0,1]=4 880 B5R0.4 CCC(C)(C)O MCULE-7894262803 [0,1,0,0,0,0|2,0,1]=4 881 B5R0.4 CC[N+](C)(C)C MCULE-6470651588 [0,1,0,0,0,0|1,0,2]=4 882 B5R0.4 CC[N+](C)(C)C MCULE-9796203912 [0,1,0,0,0,0|1,0,2]=4 883 B5R0.4 CC[Si](C)(C)C MCULE-3153744967 [0,1,0,0,0,0|2,0,1]=4 884 B5R0.4 CC[Si](C)(C)Cl MCULE-8119153773 [0,1,0,0,0,0|2,0,1]=4 885 B5R0.4 CNC(C)(C)C MCULE-7155937642 [0,1,0,0,0,0|3,0,0]=4 886 B5R0.4 COC(C)(C)C MCULE-5235179974 [0,1,0,0,0,0|3,0,0]=4 887 B5R0.4 CO[Si](C)(C)C MCULE-3437971703 [0,1,0,0,0,0|3,0,0]=4 888 B5R0.4 CO[Si](C)(C)Cl MCULE-8192258104 [0,1,0,0,0,0|3,0,0]=4 889 B5R0.4 CP(=O)(C)CCl MCULE-8860798375 [0,1,0,0,0,0|1,1,1]=4 890 B5R0.4 CSC(C)(C)C MCULE-8798542499 [0,1,0,0,0,0|3,0,0]=4 891 B5R0.4 CS[Si](C)(C)C MCULE-6652592545 [0,1,0,0,0,0|3,0,0]=4 892 B5R0.4 C[N+](C)(C)CI MCULE-7732841606 [0,1,0,0,0,0|1,0,2]=4 893 B5R0.4 C[N+](C)(C)CI MCULE-9989677070 [0,1,0,0,0,0|1,0,2]=4 894 B5R0.4 C[Si](C)(C)C#N MCULE-1689454635 [0,1,0,0,0,0|2,0,1]=4 895 B5R0.4 C[Si](C)(C)CBr MCULE-6919339761 [0,1,0,0,0,0|2,0,1]=4 896 B5R0.4 C[Si](C)(C)CCl MCULE-5533913994 [0,1,0,0,0,0|2,0,1]=4 897 B5R0.4 C[Si](C)(C)CI MCULE-6651926938 [0,1,0,0,0,0|2,0,1]=4 898 B5R0.4 C[Si](C)(C)CN MCULE-1731145216 [0,1,0,0,0,0|2,0,1]=4 899 B5R0.4 C[Si](C)(C)CO MCULE-7434746060 [0,1,0,0,0,0|1,0,2]=4 900 B5R0.4 C[Si](C)(C)ON MCULE-6539782748 [0,1,0,0,0,0|3,0,0]=4 901 B5R0.4 C[Si](C)(Cl)CBr MCULE-5460214135 [0,1,0,0,0,0|2,0,1]=4 902 B5R0.4 C[Si](C)(Cl)CCl MCULE-3370239990 [0,1,0,0,0,0|2,0,1]=4 903 B5R0.4 O=CC(Br)(Br)Br MCULE-5990521436 [0,1,0,0,0,0|3,0,0]=4 904 B5R0.4 O=CC(Cl)(Cl)Cl MCULE-5840193226 [0,1,0,0,0,0|3,0,0]=4 905 B5R0.4 O=CC(F)(F)F MCULE-4938131324 [0,1,0,0,0,0|3,0,0]=4 906 B5R0.4 [Li]C[Si](C)(C)C MCULE-2829151657 [0,1,0,0,0,0|2,0,1]=4 907 B5R0.5 C=C(Br)C(=O)O MCULE-2068246942 [0,1,0,0,0,0|2,0,1]=4 908 B5R0.5 C=C(C)C(=C)C MCULE-6799765242 [0,1,0,0,0,0|2,0,1]=4 909 B5R0.5 C=C(C)C(=O)C MCULE-5872425076 [0,1,0,0,0,0|1,0,1]=3 910 B5R0.5 C=C(C)C(=O)Cl MCULE-9163474336 [0,1,0,0,0,0|1,0,1]=3 911 B5R0.5 C=C(C)C(=O)N MCULE-3416322097 [0,1,0,0,0,0|1,0,1]=3 912 B5R0.5 C=C(C)C(=O)O MCULE-9899621926 [0,1,0,0,0,0|1,0,1]=3 913 B5R0.5 C=C(C)C(=O)[O-] MCULE-5299174444 [0,1,0,0,0,0|1,0,1]=3 914 B5R0.5 C=C(C)C(=O)[O-] MCULE-7320418926 [0,1,0,0,0,0|1,0,1]=3 915 B5R0.5 C=C(C)C(=O)[O-] MCULE-7347881815 [0,1,0,0,0,0|1,0,1]=3 916 B5R0.5 C=C(C)C(C)C MCULE-2535284443 [0,1,0,0,0,0|2,0,0]=3 917 B5R0.5 C=C(C)C(C)Cl MCULE-5294924458 [0,1,0,0,0,0|3,0,0]=4 918 B5R0.5 C=C(C)C(C)O MCULE-3768810742 [0,1,0,0,0,0|3,0,0]=4 919 B5R0.5 C=C(Cl)C(=O)O MCULE-8316225208 [0,1,0,0,0,0|2,0,1]=4 920 B5R0.5 C=C(F)C(=O)Cl MCULE-6769824615 [0,1,0,0,0,0|2,0,1]=4 921 B5R0.5 C=C(F)C(=O)O MCULE-7137929861 [0,1,0,0,0,0|2,0,1]=4 922 B5R0.5 C=C(F)C(=O)[O-] MCULE-1806853701 [0,1,0,0,0,0|2,0,1]=4 923 B5R0.5 CC(=C(C)Br)C MCULE-2244219065 [0,1,0,0,0,0|2,0,0]=3 924 B5R0.5 CC(=C(C)C)C MCULE-2888318026 [0,1,0,0,0,0|2,0,0]=3 925 B5R0.5 CC(=O)C(=O)C MCULE-5742661187 [0,1,0,0,0,0|2,0,0]=3 926 B5R0.5 CC(=O)C(=O)Cl MCULE-3413498860 [0,1,0,0,0,0|2,0,0]=3 927 B5R0.5 CC(=O)C(=O)N MCULE-6804734996 [0,1,0,0,0,0|2,0,0]=3 928 B5R0.5 CC(=O)C(=O)O MCULE-8587144313 [0,1,0,0,0,0|2,0,0]=3 929 B5R0.5 CC(=O)C(=O)[O-] MCULE-2773521709 [0,1,0,0,0,0|2,0,0]=3 930 B5R0.5 CC(=O)C(=O)[O-] MCULE-7007482346 [0,1,0,0,0,0|2,0,0]=3 931 B5R0.5 CC(=O)C(=O)[O-] MCULE-8344520452 [0,1,0,0,0,0|2,0,0]=3 932 B5R0.5 CC(=O)C(=S)N MCULE-3142518834 [0,1,0,0,0,0|2,1,0]=4 933 B5R0.5 CC(=O)C(C)Br MCULE-3764525199 [0,1,0,0,0,0|2,0,0]=3 934 B5R0.5 CC(=O)C(C)C MCULE-5982732938 [0,1,0,0,0,0|1,0,0]=2 935 B5R0.5 CC(=O)C(C)Cl MCULE-5065840606 [0,1,0,0,0,0|2,0,0]=3 936 B5R0.5 CC(=O)C(C)F MCULE-2129925918 [0,1,0,0,0,0|2,0,0]=3 937 B5R0.5 CC(=O)C(C)N MCULE-5716124999 [0,1,0,0,0,0|2,0,0]=3 938 B5R0.5 CC(=O)C(C)N MCULE-9248002534 [0,1,0,0,0,0|2,0,0]=3 939 B5R0.5 CC(=O)C(C)O MCULE-5374414264 [0,1,0,0,0,0|2,0,0]=3 940 B5R0.5 CC(=O)C(C)S MCULE-2716722148 [0,1,0,0,0,0|2,0,0]=3 941 B5R0.5 CC(=O)C(Cl)Cl MCULE-9043899746 [0,1,0,0,0,0|3,0,0]=4 942 B5R0.5 CC(=O)C(F)F MCULE-9206168077 [0,1,0,0,0,0|3,0,0]=4 943 B5R0.5 CC(=O)N(C)C MCULE-4256511309 [0,1,0,0,0,0|0,0,0]=1 944 B5R0.5 CC(=O)N(C)N MCULE-2447375293 [0,1,0,0,0,0|1,0,0]=2 945 B5R0.5 CC(=O)[C@H](C)N MCULE-2609095078 [0,1,0,0,0,0|2,0,0]=3 946 B5R0.5 CC(=O)[C@H](C)N MCULE-6039921944 [0,1,0,0,0,0|2,0,0]=3 947 B5R0.5 CC(=O)[C@H](C)N MCULE-6387613992 [0,1,0,0,0,0|2,0,0]=3 948 B5R0.5 CC(=O)[C@H](C)N MCULE-7052375323 [0,1,0,0,0,0|2,0,0]=3 949 B5R0.5 CC(=S)N(C)C MCULE-6797990305 [0,1,0,0,0,0|0,1,0]=2 950 B5R0.5 CC(Br)C(=O)Br MCULE-2400047844 [0,1,0,0,0,0|2,0,0]=3 951 B5R0.5 CC(Br)C(=O)Cl MCULE-7431871683 [0,1,0,0,0,0|2,0,0]=3 952 B5R0.5 CC(Br)C(=O)N MCULE-9226586148 [0,1,0,0,0,0|2,0,0]=3 953 B5R0.5 CC(Br)C(=O)O MCULE-3935837943 [0,1,0,0,0,0|2,0,0]=3 954 B5R0.5 CC(Br)C(=O)O MCULE-6068441065 [0,1,0,0,0,0|2,0,0]=3 955 B5R0.5 CC(C)B(O)O MCULE-1255589444 [0,1,0,0,0,0|2,0,1]=4 956 B5R0.5 CC(C)C(=N)N MCULE-2464075086 [0,1,0,0,0,0|2,0,0]=3 957 B5R0.5 CC(C)C(=N)N MCULE-6743996580 [0,1,0,0,0,0|2,0,0]=3 958 B5R0.5 CC(C)C(=O)Br MCULE-3679003896 [0,1,0,0,0,0|1,0,0]=2 959 B5R0.5 CC(C)C(=O)Cl MCULE-6582236331 [0,1,0,0,0,0|1,0,0]=2 960 B5R0.5 CC(C)C(=O)N MCULE-9773835068 [0,1,0,0,0,0|1,0,0]=2 961 B5R0.5 CC(C)C(=O)O MCULE-7783770647 [0,1,0,0,0,0|1,0,0]=2 962 B5R0.5 CC(C)C(=O)S MCULE-9552406593 [0,1,0,0,0,0|1,0,0]=2 963 B5R0.5 CC(C)C(=S)N MCULE-3546856315 [0,1,0,0,0,0|1,1,0]=3 964 B5R0.5 CC(C)C(C)Br MCULE-8934980523 [0,1,0,0,0,0|2,0,1]=4 965 B5R0.5 CC(C)C(C)C MCULE-7887644548 [0,1,0,0,0,0|2,0,1]=4 966 B5R0.5 CC(C)C(C)I MCULE-7528764320 [0,1,0,0,0,0|2,0,1]=4 967 B5R0.5 CC(C)C(C)N MCULE-1630754475 [0,1,0,0,0,0|2,0,1]=4 968 B5R0.5 CC(C)C(C)N MCULE-1801901816 [0,1,0,0,0,0|2,0,1]=4 969 B5R0.5 CC(C)C(C)N MCULE-3544463874 [0,1,0,0,0,0|2,0,1]=4 970 B5R0.5 CC(C)C(C)N MCULE-4774844065 [0,1,0,0,0,0|2,0,1]=4 971 B5R0.5 CC(C)C(C)O MCULE-4829392845 [0,1,0,0,0,0|1,0,2]=4 972 B5R0.5 CC(C)C(C)S MCULE-7489203323 [0,1,0,0,0,0|1,1,1]=4 973 B5R0.5 CC(C)C(I)I MCULE-6684789578 [0,1,0,0,0,0|2,0,1]=4 974 B5R0.5 CC(C)N(=O)=O MCULE-8418443353 [0,1,0,0,0,0|2,0,0]=3 975 B5R0.5 CC(C)N(C)C MCULE-1993251030 [0,1,0,0,0,0|1,0,1]=3 976 B5R0.5 CC(C)S(=O)N MCULE-8425110407 [0,1,0,0,0,0|2,0,0]=3 977 B5R0.5 CC(C)S(=O)O MCULE-5200056082 [0,1,0,0,0,0|2,0,0]=3 978 B5R0.5 CC(C)S(=O)[O-] MCULE-2354817364 [0,1,0,0,0,0|2,0,0]=3 979 B5R0.5 CC(C)[C@@H](C)N MCULE-1953734886 [0,1,0,0,0,0|2,0,1]=4 980 B5R0.5 CC(C)[C@@H](C)N MCULE-3105334197 [0,1,0,0,0,0|2,0,1]=4 981 B5R0.5 CC(C)[C@@H](C)N MCULE-9470429569 [0,1,0,0,0,0|2,0,1]=4 982 B5R0.5 CC(C)[C@@H](C)O MCULE-3565458505 [0,1,0,0,0,0|1,0,2]=4 983 B5R0.5 CC(C)[C@H](C)N MCULE-2859174363 [0,1,0,0,0,0|2,0,1]=4 984 B5R0.5 CC(C)[C@H](C)N MCULE-3034457659 [0,1,0,0,0,0|2,0,1]=4 985 B5R0.5 CC(C)[C@H](C)N MCULE-5904658917 [0,1,0,0,0,0|2,0,1]=4 986 B5R0.5 CC(C)[C@H](C)O MCULE-1553214756 [0,1,0,0,0,0|1,0,2]=4 987 B5R0.5 CC(C)[C@H](C)O MCULE-8141633445 [0,1,0,0,0,0|1,0,2]=4 988 B5R0.5 CC(Cl)C(=N)N MCULE-2357555185 [0,1,0,0,0,0|3,0,0]=4 989 B5R0.5 CC(Cl)C(=N)N MCULE-5302250002 [0,1,0,0,0,0|3,0,0]=4 990 B5R0.5 CC(Cl)C(=O)Cl MCULE-6547241717 [0,1,0,0,0,0|2,0,0]=3 991 B5R0.5 CC(Cl)C(=O)N MCULE-5322078211 [0,1,0,0,0,0|2,0,0]=3 992 B5R0.5 CC(Cl)C(=O)O MCULE-3597230803 [0,1,0,0,0,0|2,0,0]=3 993 B5R0.5 CC(Cl)C(=O)O MCULE-5449120618 [0,1,0,0,0,0|2,0,0]=3 994 B5R0.5 CC(F)C(=O)O MCULE-7334922730 [0,1,0,0,0,0|2,0,0]=3 995 B5R0.5 CC(I)C(=O)N MCULE-8608495554 [0,1,0,0,0,0|2,0,0]=3 996 B5R0.5 CC(N)C(=O)N MCULE-1264398810 [0,1,0,0,0,0|2,0,0]=3 997 B5R0.5 CC(N)C(=O)N MCULE-2251123672 [0,1,0,0,0,0|2,0,0]=3 998 B5R0.5 CC(N)C(=O)N MCULE-2273926073 [0,1,0,0,0,0|2,0,0]=3 999 B5R0.5 CC(N)C(=O)N MCULE-5340923071 [0,1,0,0,0,0|2,0,0]=3 1000 B5R0.5 CC(N)C(=O)N MCULE-6061233032 [0,1,0,0,0,0|2,0,0]=3 1001 B5R0.5 CC(N)C(=O)N MCULE-9273221837 [0,1,0,0,0,0|2,0,0]=3 1002 B5R0.5 CC(N)C(=O)O MCULE-3498369789 [0,1,0,0,0,0|2,0,0]=3 1003 B5R0.5 CC(N)C(=O)O MCULE-3809839392 [0,1,0,0,0,0|2,0,0]=3 1004 B5R0.5 CC(N)C(=O)O MCULE-4751903561 [0,1,0,0,0,0|2,0,0]=3 1005 B5R0.5 CC(N)C(=O)O MCULE-6963397848 [0,1,0,0,0,0|2,0,0]=3 1006 B5R0.5 CC(O)C(=N)N MCULE-4358846536 [0,1,0,0,0,0|3,0,0]=4 1007 B5R0.5 CC(O)C(=N)N MCULE-5644516205 [0,1,0,0,0,0|3,0,0]=4 1008 B5R0.5 CC(O)C(=O)N MCULE-6247123668 [0,1,0,0,0,0|2,0,0]=3 1009 B5R0.5 CC(O)C(=O)N MCULE-7823792358 [0,1,0,0,0,0|2,0,0]=3 1010 B5R0.5 CC(O)C(=O)O MCULE-3922256529 [0,1,0,0,0,0|2,0,0]=3 1011 B5R0.5 CC(O)C(=O)O MCULE-5387110670 [0,1,0,0,0,0|2,0,0]=3 1012 B5R0.5 CC(O)C(=O)[O-] MCULE-1056716990 [0,1,0,0,0,0|2,0,0]=3 1013 B5R0.5 CC(O)C(=O)[O-] MCULE-8184872865 [0,1,0,0,0,0|2,0,0]=3 1014 B5R0.5 CC(O)C(=O)[O-] MCULE-8730993694 [0,1,0,0,0,0|2,0,0]=3 1015 B5R0.5 CC(S)C(=O)N MCULE-1465182001 [0,1,0,0,0,0|2,0,0]=3 1016 B5R0.5 CC(S)C(=O)O MCULE-6944738352 [0,1,0,0,0,0|2,0,0]=3 1017 B5R0.5 CN(C)C(=N)N MCULE-6863213372 [0,1,0,0,0,0|1,0,0]=2 1018 B5R0.5 CN(C)C(=N)N MCULE-7950775799 [0,1,0,0,0,0|1,0,0]=2 1019 B5R0.5 CN(C)C(=N)N MCULE-8265374681 [0,1,0,0,0,0|1,0,0]=2 1020 B5R0.5 CN(C)C(=N)N MCULE-9153833571 [0,1,0,0,0,0|1,0,0]=2 1021 B5R0.5 CN(C)C(=O)Cl MCULE-1738506605 [0,1,0,0,0,0|0,0,0]=1 1022 B5R0.5 CN(C)C(=O)N MCULE-3142720631 [0,1,0,0,0,0|0,0,0]=1 1023 B5R0.5 CN(C)C(=O)O MCULE-1039144559 [0,1,0,0,0,0|0,0,0]=1 1024 B5R0.5 CN(C)C(=O)[O-] MCULE-5405204721 [0,1,0,0,0,0|0,0,0]=1 1025 B5R0.5 CN(C)C(=S)Cl MCULE-5232126468 [0,1,0,0,0,0|0,1,0]=2 1026 B5R0.5 CN(C)C(=S)N MCULE-6937388954 [0,1,0,0,0,0|0,1,0]=2 1027 B5R0.5 CN(C)C(=S)S MCULE-4296425055 [0,1,0,0,0,0|0,1,0]=2 1028 B5R0.5 CN(C)C(=S)S MCULE-5159570847 [0,1,0,0,0,0|0,1,0]=2 1029 B5R0.5 CN(C)C(=S)[S-] MCULE-6390941151 [0,1,0,0,0,0|0,1,0]=2 1030 B5R0.5 CN(C)C(=S)[S-] MCULE-7709633048 [0,1,0,0,0,0|0,1,0]=2 1031 B5R0.5 CN(C)N(C)C MCULE-1054866442 [0,1,0,0,0,0|2,0,0]=3 1032 B5R0.5 CN(C)P(Cl)Cl MCULE-1449952756 [0,1,0,0,0,0|2,0,0]=3 1033 B5R0.5 CN(N)C(=O)N MCULE-9114734246 [0,1,0,0,0,0|1,0,0]=2 1034 B5R0.5 CN(N)C(=S)N MCULE-8674598291 [0,1,0,0,0,0|1,1,0]=3 1035 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8303539222 [0,1,0,0,0,0|2,0,0]=3 1036 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8530283309 [0,1,0,0,0,0|2,0,0]=3 1037 B5R0.5 C[C@@H](Cl)C(=O)Cl MCULE-3579498695 [0,1,0,0,0,0|2,0,0]=3 1038 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-6578788045 [0,1,0,0,0,0|2,0,0]=3 1039 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-8314108697 [0,1,0,0,0,0|2,0,0]=3 1040 B5R0.5 C[C@@H](F)C(=O)N MCULE-1505685009 [0,1,0,0,0,0|2,0,0]=3 1041 B5R0.5 C[C@@H](N)C(=O)N MCULE-4677983549 [0,1,0,0,0,0|2,0,0]=3 1042 B5R0.5 C[C@@H](N)C(=O)N MCULE-6112443507 [0,1,0,0,0,0|2,0,0]=3 1043 B5R0.5 C[C@@H](N)C(=O)N MCULE-7940270709 [0,1,0,0,0,0|2,0,0]=3 1044 B5R0.5 C[C@@H](N)C(=O)N MCULE-8482332558 [0,1,0,0,0,0|2,0,0]=3 1045 B5R0.5 C[C@@H](N)C(=O)O MCULE-3571488623 [0,1,0,0,0,0|2,0,0]=3 1046 B5R0.5 C[C@@H](N)C(=O)O MCULE-9756365751 [0,1,0,0,0,0|2,0,0]=3 1047 B5R0.5 C[C@@H](O)C(=N)N MCULE-1498978023 [0,1,0,0,0,0|3,0,0]=4 1048 B5R0.5 C[C@@H](O)C(=N)N MCULE-6124491136 [0,1,0,0,0,0|3,0,0]=4 1049 B5R0.5 C[C@@H](O)C(=N)N MCULE-7410387081 [0,1,0,0,0,0|3,0,0]=4 1050 B5R0.5 C[C@@H](O)C(=N)N MCULE-9566288141 [0,1,0,0,0,0|3,0,0]=4 1051 B5R0.5 C[C@@H](O)C(=O)N MCULE-2026557726 [0,1,0,0,0,0|2,0,0]=3 1052 B5R0.5 C[C@@H](O)C(=O)N MCULE-8056291801 [0,1,0,0,0,0|2,0,0]=3 1053 B5R0.5 C[C@@H](O)C(=O)O MCULE-4625208788 [0,1,0,0,0,0|2,0,0]=3 1054 B5R0.5 C[C@@H](O)C(=O)O MCULE-9141235095 [0,1,0,0,0,0|2,0,0]=3 1055 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-5673591667 [0,1,0,0,0,0|2,0,0]=3 1056 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-8146434340 [0,1,0,0,0,0|2,0,0]=3 1057 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-9026662277 [0,1,0,0,0,0|2,0,0]=3 1058 B5R0.5 C[C@H](Br)C(=O)Cl MCULE-2960953088 [0,1,0,0,0,0|2,0,0]=3 1059 B5R0.5 C[C@H](Br)C(=O)O MCULE-4788730445 [0,1,0,0,0,0|2,0,0]=3 1060 B5R0.5 C[C@H](Br)C(=O)O MCULE-9354978281 [0,1,0,0,0,0|2,0,0]=3 1061 B5R0.5 C[C@H](Cl)C(=O)O MCULE-4816831649 [0,1,0,0,0,0|2,0,0]=3 1062 B5R0.5 C[C@H](Cl)C(=O)O MCULE-8389122613 [0,1,0,0,0,0|2,0,0]=3 1063 B5R0.5 C[C@H](F)C(=O)N MCULE-7457242428 [0,1,0,0,0,0|2,0,0]=3 1064 B5R0.5 C[C@H](N)C(=O)N MCULE-4716963408 [0,1,0,0,0,0|2,0,0]=3 1065 B5R0.5 C[C@H](N)C(=O)N MCULE-6879702251 [0,1,0,0,0,0|2,0,0]=3 1066 B5R0.5 C[C@H](N)C(=O)N MCULE-7090555441 [0,1,0,0,0,0|2,0,0]=3 1067 B5R0.5 C[C@H](N)C(=O)N MCULE-7293369315 [0,1,0,0,0,0|2,0,0]=3 1068 B5R0.5 C[C@H](N)C(=O)N MCULE-7341432132 [0,1,0,0,0,0|2,0,0]=3 1069 B5R0.5 C[C@H](N)C(=O)N MCULE-7556063213 [0,1,0,0,0,0|2,0,0]=3 1070 B5R0.5 C[C@H](N)C(=O)N MCULE-8320991932 [0,1,0,0,0,0|2,0,0]=3 1071 B5R0.5 C[C@H](N)C(=O)N MCULE-8491573930 [0,1,0,0,0,0|2,0,0]=3 1072 B5R0.5 C[C@H](N)C(=O)O MCULE-4916719758 [0,1,0,0,0,0|2,0,0]=3 1073 B5R0.5 C[C@H](N)C(=O)O MCULE-5261590548 [0,1,0,0,0,0|2,0,0]=3 1074 B5R0.5 C[C@H](N)C(=O)O MCULE-7791919887 [0,1,0,0,0,0|2,0,0]=3 1075 B5R0.5 C[C@H](N)C(=O)O MCULE-8724854497 [0,1,0,0,0,0|2,0,0]=3 1076 B5R0.5 C[C@H](O)C(=O)N MCULE-8400190365 [0,1,0,0,0,0|2,0,0]=3 1077 B5R0.5 C[C@H](O)C(=O)O MCULE-5695391344 [0,1,0,0,0,0|2,0,0]=3 1078 B5R0.5 C[C@H](O)C(=O)O MCULE-8864689875 [0,1,0,0,0,0|2,0,0]=3 1079 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-1034285072 [0,1,0,0,0,0|2,0,0]=3 1080 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-3598405830 [0,1,0,0,0,0|2,0,0]=3 1081 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-7525689298 [0,1,0,0,0,0|2,0,0]=3 1082 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8057429776 [0,1,0,0,0,0|2,0,0]=3 1083 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8729310894 [0,1,0,0,0,0|2,0,0]=3 1084 B5R0.5 C[N+](=C(Cl)Cl)C MCULE-8024225536 [0,1,0,0,0,0|1,0,1]=3 1085 B5R0.5 C[N+](=C(Cl)Cl)C MCULE-9306949257 [0,1,0,0,0,0|1,0,1]=3 1086 B5R0.5 N=C(N)N(N)N MCULE-6225047839 [0,1,0,0,0,0|3,0,0]=4 1087 B5R0.5 N=C(N)N(N)N MCULE-8407507713 [0,1,0,0,0,0|3,0,0]=4 1088 B5R0.5 NC(=O)C(=O)N MCULE-9024594322 [0,1,0,0,0,0|3,0,0]=4 1089 B5R0.5 NC(=O)C(=O)O MCULE-4442165428 [0,1,0,0,0,0|3,0,0]=4 1090 B5R0.5 NC(=O)C(=O)[O-] MCULE-6520154385 [0,1,0,0,0,0|3,0,0]=4 1091 B5R0.5 NC(=O)C(=O)[O-] MCULE-9489956613 [0,1,0,0,0,0|3,0,0]=4 1092 B5R0.5 NC(=O)C(Cl)Br MCULE-9082770089 [0,1,0,0,0,0|3,0,0]=4 1093 B5R0.5 NC(=O)C(Cl)Cl MCULE-3389337354 [0,1,0,0,0,0|3,0,0]=4 1094 B5R0.5 NC(=O)C(F)Br MCULE-8795303515 [0,1,0,0,0,0|3,0,0]=4 1095 B5R0.5 NC(=O)C(F)Cl MCULE-4267127037 [0,1,0,0,0,0|3,0,0]=4 1096 B5R0.5 NC(=O)C(F)F MCULE-7881392368 [0,1,0,0,0,0|3,0,0]=4 1097 B5R0.5 NC(=O)C(F)I MCULE-6067421301 [0,1,0,0,0,0|3,0,0]=4 1098 B5R0.5 NC(O)C(=O)O MCULE-6546070388 [0,1,0,0,0,0|3,0,0]=4 1099 B5R0.5 O=C(Br)C(=O)Br MCULE-6502494359 [0,1,0,0,0,0|3,0,0]=4 1100 B5R0.5 O=C(Cl)C(=O)Cl MCULE-7263932124 [0,1,0,0,0,0|3,0,0]=4 1101 B5R0.5 O=C(Cl)C(Cl)Cl MCULE-2883143305 [0,1,0,0,0,0|3,0,0]=4 1102 B5R0.5 O=C(Cl)C(F)Cl MCULE-1579940277 [0,1,0,0,0,0|3,0,0]=4 1103 B5R0.5 O=C(Cl)C(F)F MCULE-6700400389 [0,1,0,0,0,0|3,0,0]=4 1104 B5R0.5 O=C(F)C(F)F MCULE-6722746663 [0,1,0,0,0,0|3,0,0]=4 1105 B5R0.5 O=C(O)C(=O)O MCULE-2859436444 [0,1,0,0,0,0|3,0,0]=4 1106 B5R0.5 O=C(O)C(=O)O MCULE-3054574273 [0,1,0,0,0,0|3,0,0]=4 1107 B5R0.5 O=C(O)C(=O)O MCULE-4285591204 [0,1,0,0,0,0|3,0,0]=4 1108 B5R0.5 O=C(O)C(=O)O MCULE-4461843798 [0,1,0,0,0,0|3,0,0]=4 1109 B5R0.5 O=C(O)C(=O)O MCULE-6031758101 [0,1,0,0,0,0|3,0,0]=4 1110 B5R0.5 O=C(O)C(=O)O MCULE-6647815245 [0,1,0,0,0,0|3,0,0]=4 1111 B5R0.5 O=C(O)C(=O)O MCULE-7895971003 [0,1,0,0,0,0|3,0,0]=4 1112 B5R0.5 O=C(O)C(=O)O MCULE-8046063377 [0,1,0,0,0,0|3,0,0]=4 1113 B5R0.5 O=C(O)C(=O)O MCULE-8198551041 [0,1,0,0,0,0|3,0,0]=4 1114 B5R0.5 O=C(O)C(=O)O MCULE-8472527874 [0,1,0,0,0,0|3,0,0]=4 1115 B5R0.5 O=C(O)C(=O)O MCULE-9701145416 [0,1,0,0,0,0|3,0,0]=4 1116 B5R0.5 O=C(O)C(Br)Br MCULE-4908900588 [0,1,0,0,0,0|3,0,0]=4 1117 B5R0.5 O=C(O)C(Cl)Br MCULE-4569127340 [0,1,0,0,0,0|3,0,0]=4 1118 B5R0.5 O=C(O)C(Cl)Cl MCULE-1246638159 [0,1,0,0,0,0|3,0,0]=4 1119 B5R0.5 O=C(O)C(F)Br MCULE-5639771935 [0,1,0,0,0,0|3,0,0]=4 1120 B5R0.5 O=C(O)C(F)Cl MCULE-8791727704 [0,1,0,0,0,0|3,0,0]=4 1121 B5R0.5 O=C(O)C(F)F MCULE-9791449975 [0,1,0,0,0,0|3,0,0]=4 1122 B5R0.5 O=C(O)C(F)I MCULE-2596137309 [0,1,0,0,0,0|3,0,0]=4 1123 B5R0.5 O=C(O)C(O)O MCULE-8045135900 [0,1,0,0,0,0|3,0,0]=4 1124 B5R0.5 O=C(O)[C@@H](F)Cl MCULE-9934674808 [0,1,0,0,0,0|3,0,0]=4 1125 B5R0.5 O=C(O)[C@H](F)Cl MCULE-8184552815 [0,1,0,0,0,0|3,0,0]=4 1126 B5R0.5 O=C([O-])C(=O)[O-] MCULE-1850167183 [0,1,0,0,0,0|3,0,0]=4 1127 B5R0.5 O=C([O-])C(=O)[O-] MCULE-2102182772 [0,1,0,0,0,0|3,0,0]=4 1128 B5R0.5 O=C([O-])C(=O)[O-] MCULE-2594600365 [0,1,0,0,0,0|3,0,0]=4 1129 B5R0.5 O=C([O-])C(=O)[O-] MCULE-2876490980 [0,1,0,0,0,0|3,0,0]=4 1130 B5R0.5 O=C([O-])C(=O)[O-] MCULE-4875218588 [0,1,0,0,0,0|3,0,0]=4 1131 B5R0.5 O=C([O-])C(=O)[O-] MCULE-6598296804 [0,1,0,0,0,0|3,0,0]=4 1132 B5R0.5 O=C([O-])C(=O)[O-] MCULE-6729461006 [0,1,0,0,0,0|3,0,0]=4 1133 B5R0.5 O=C([O-])C(=O)[O-] MCULE-7607695802 [0,1,0,0,0,0|3,0,0]=4 1134 B5R0.5 O=C([O-])C(F)Br MCULE-3214706920 [0,1,0,0,0,0|3,0,0]=4 1135 B5R0.5 O=C([O-])C(F)Cl MCULE-6121365584 [0,1,0,0,0,0|3,0,0]=4 1136 B5R0.5 O=C([O-])C(F)I MCULE-5263796115 [0,1,0,0,0,0|3,0,0]=4 1137 B5R0.5 [C@@H](C)(O)C(=O)N MCULE-6953360641 [0,1,0,0,0,0|2,0,0]=3 1138 B5R0.5 [NH2+]=C(Cl)N(C)C MCULE-1016641329 [0,1,0,0,0,0|1,0,0]=2 1139 B5R0.5 [NH2+]=C(Cl)N(C)C MCULE-1067760866 [0,1,0,0,0,0|1,0,0]=2 1140 B5R1.2 BrC1=CCC1 MCULE-7839710306 [0,0,0,1,0,0|3,0,0]=4 1141 B5R1.2 CC1CCN1 MCULE-7952714343 [0,0,0,1,0,0|3,0,0]=4 1142 B5R1.2 CC1CCN1 MCULE-9084374728 [0,0,0,1,0,0|3,0,0]=4 1143 B5R1.2 CC1CNC1 MCULE-3977066574 [0,0,0,1,0,0|2,0,1]=4 1144 B5R1.2 CC1CNC1 MCULE-7868611457 [0,0,0,1,0,0|2,0,1]=4 1145 B5R1.2 C[C@@H]1CCN1 MCULE-1326888606 [0,0,0,1,0,0|3,0,0]=4 1146 B5R1.2 C[C@@H]1CCN1 MCULE-4242598105 [0,0,0,1,0,0|3,0,0]=4 1147 B5R1.2 C[C@@H]1CCN1 MCULE-7982357684 [0,0,0,1,0,0|3,0,0]=4 1148 B5R1.2 C[C@@H]1CCN1 MCULE-9443505478 [0,0,0,1,0,0|3,0,0]=4 1149 B5R1.2 C[C@H]1CCN1 MCULE-3178162849 [0,0,0,1,0,0|3,0,0]=4 1150 B5R1.2 C[C@H]1CCN1 MCULE-4001397038 [0,0,0,1,0,0|3,0,0]=4 1151 B5R1.2 C[C@H]1CCN1 MCULE-4361200248 [0,0,0,1,0,0|3,0,0]=4 1152 B5R1.2 C[C@H]1CCN1 MCULE-6534579029 [0,0,0,1,0,0|3,0,0]=4 1153 B5R1.2 NN1CCC1 MCULE-8176731673 [0,0,0,1,0,0|2,0,1]=4 1154 B5R1.2 NN1CCC1 MCULE-8382619719 [0,0,0,1,0,0|2,0,1]=4 1155 B5R1.3 BrCC1CC1 MCULE-6057571576 [0,0,0,1,0,0|2,0,1]=4 1156 B5R1.3 C#CC1CC1 MCULE-8413731516 [0,0,0,1,0,0|2,0,1]=4 1157 B5R1.3 C=CC1CC1 MCULE-4323158851 [0,0,0,1,0,0|2,0,0]=3 1158 B5R1.3 C=CC1CO1 MCULE-1428696186 [0,0,0,1,0,0|3,0,0]=4 1159 B5R1.3 CNC1CC1 MCULE-4055097650 [0,0,0,1,0,0|3,0,0]=4 1160 B5R1.3 CNC1CC1 MCULE-8040280524 [0,0,0,1,0,0|3,0,0]=4 1161 B5R1.3 ClCC1CC1 MCULE-3906493674 [0,0,0,1,0,0|2,0,1]=4 1162 B5R1.3 FNC1CC1 MCULE-4155496114 [0,0,0,1,0,0|3,0,0]=4 1163 B5R1.3 ICC1CC1 MCULE-2390979991 [0,0,0,1,0,0|2,0,1]=4 1164 B5R1.3 N#CC1CC1 MCULE-1838359731 [0,0,0,1,0,0|2,0,1]=4 1165 B5R1.3 NCC1CC1 MCULE-5832294538 [0,0,0,1,0,0|2,0,1]=4 1166 B5R1.3 NCC1CC1 MCULE-9914994928 [0,0,0,1,0,0|2,0,1]=4 1167 B5R1.3 NNC1CC1 MCULE-3522729516 [0,0,0,1,0,0|3,0,0]=4 1168 B5R1.3 NNC1CC1 MCULE-7121199703 [0,0,0,1,0,0|3,0,0]=4 1169 B5R1.3 NNC1CC1 MCULE-8598538666 [0,0,0,1,0,0|3,0,0]=4 1170 B5R1.3 NOC1CC1 MCULE-5379816123 [0,0,0,1,0,0|3,0,0]=4 1171 B5R1.3 O=CC1CC1 MCULE-9773190262 [0,0,0,1,0,0|1,0,0]=2 1172 B5R1.3 OCC1CC1 MCULE-4492474357 [0,0,0,1,0,0|1,0,2]=4 1173 B5R1.3 SCC1CC1 MCULE-9557919804 [0,0,0,1,0,0|1,1,1]=4 1174 B5R1.3 [C@@H]1(CO1)C=C MCULE-9776744095 [0,0,0,1,0,0|3,0,0]=4 1175 B5R1.3 [C@H]1(CO1)C=C MCULE-7934901088 [0,0,0,1,0,0|3,0,0]=4 1176 B5R1.4 CC1CC1N MCULE-4472318973 [0,0,0,1,0,0|2,0,1]=4 1177 B5R1.4 CC1CC1N MCULE-8037315228 [0,0,0,1,0,0|2,0,1]=4 1178 B5R1.4 CC1CC1O MCULE-2006758475 [0,0,0,1,0,0|1,0,2]=4 1179 B5R1.4 C[C@@H]1C[C@@H]1N MCULE-6282896395 [0,0,0,1,0,0|2,0,1]=4 1180 B5R1.4 C[C@@H]1C[C@H]1N MCULE-1526017761 [0,0,0,1,0,0|2,0,1]=4 1181 B5R1.4 C[C@@H]1C[C@H]1N MCULE-7111745511 [0,0,0,1,0,0|2,0,1]=4 1182 B5R1.4 C[C@@H]1C[C@H]1N MCULE-7879046644 [0,0,0,1,0,0|2,0,1]=4 1183 B5R1.4 C[C@@H]1C[C@H]1N MCULE-9805986423 [0,0,0,1,0,0|2,0,1]=4 1184 B5R1.4 C[C@H]1C[C@@H]1N MCULE-9525222696 [0,0,0,1,0,0|2,0,1]=4 1185 B5R1.4 C[C@H]1C[C@@H]1N MCULE-9658987958 [0,0,0,1,0,0|2,0,1]=4 1186 B5R1.4 C[C@H]1C[C@H]1N MCULE-4953477750 [0,0,0,1,0,0|2,0,1]=4 1187 B5R1.4 C[C@H]1C[C@H]1N MCULE-6429810931 [0,0,0,1,0,0|2,0,1]=4 1188 B5R1.5 CC1(CN1)C MCULE-8452595493 [0,0,0,1,0,0|2,0,1]=4 1189 B5R1.5 CC1(CO1)C MCULE-4247049920 [0,0,0,1,0,0|1,0,2]=4 1190 B5R1.5 CC1(CS1)C MCULE-7579931452 [0,0,0,1,0,0|1,1,1]=4 1191 B2R0.1 C#CC MCULE-8346460782 [2,0,0,0,0,0|1,0,1]=4 1192 B2R0.1 C=C=C MCULE-2040872097 [2,0,0,0,0,0|1,0,1]=4 1193 B2R0.1 C=CBr MCULE-1481946455 [2,0,0,0,0,0|1,0,1]=4 1194 B2R0.1 C=CC MCULE-5223715076 [2,0,0,0,0,0|1,0,0]=3 1195 B2R0.1 C=CCl MCULE-9678046268 [2,0,0,0,0,0|1,0,1]=4 1196 B2R0.1 C=CI MCULE-2939062322 [2,0,0,0,0,0|1,0,1]=4 1197 B2R0.1 C=CO MCULE-8167566239 [2,0,0,0,0,0|0,0,2]=4 1198 B2R0.1 C=NN MCULE-4427606079 [2,0,0,0,0,0|1,0,1]=4 1199 B2R0.1 C=NO MCULE-1312312591 [2,0,0,0,0,0|1,0,1]=4 1200 B2R0.1 C=NO MCULE-7599902650 [2,0,0,0,0,0|1,0,1]=4 1201 B2R0.1 CC#N MCULE-8803543318 [2,0,0,0,0,0|1,0,1]=4 1202 B2R0.1 CC=O MCULE-6002254510 [2,0,0,0,0,0|0,0,0]=2 1203 B2R0.1 CC=O MCULE-6800925955 [2,0,0,0,0,0|0,0,0]=2 1204 B2R0.1 CCBr MCULE-9840669634 [2,0,0,0,0,0|1,0,1]=4 1205 B2R0.1 CCC MCULE-7179517367 [2,0,0,0,0,0|1,0,0]=3 1206 B2R0.1 CCCl MCULE-8087909182 [2,0,0,0,0,0|1,0,1]=4 1207 B2R0.1 CCI MCULE-9405436513 [2,0,0,0,0,0|1,0,1]=4 1208 B2R0.1 CCN MCULE-1774065508 [2,0,0,0,0,0|1,0,1]=4 1209 B2R0.1 CCN MCULE-5999638632 [2,0,0,0,0,0|1,0,1]=4 1210 B2R0.1 CCN MCULE-6233823811 [2,0,0,0,0,0|1,0,1]=4 1211 B2R0.1 CCN MCULE-6444557204 [2,0,0,0,0,0|1,0,1]=4 1212 B2R0.1 CCO MCULE-8818474596 [2,0,0,0,0,0|0,0,2]=4 1213 B2R0.1 CCS MCULE-5717309901 [2,0,0,0,0,0|0,1,1]=4 1214 B2R0.1 CNC MCULE-2809467532 [2,0,0,0,0,0|0,0,0]=2 1215 B2R0.1 CNN MCULE-6163742401 [2,0,0,0,0,0|1,0,0]=3 1216 B2R0.1 CNN MCULE-7217348217 [2,0,0,0,0,0|1,0,0]=3 1217 B2R0.1 CNN MCULE-9086529736 [2,0,0,0,0,0|1,0,0]=3 1218 B2R0.1 CNO MCULE-5310203084 [2,0,0,0,0,0|0,0,1]=3 1219 B2R0.1 CNO MCULE-7072005453 [2,0,0,0,0,0|0,0,1]=3 1220 B2R0.1 COC MCULE-4385003255 [2,0,0,0,0,0|1,0,0]=3 1221 B2R0.1 CON MCULE-1068458971 [2,0,0,0,0,0|2,0,0]=4 1222 B2R0.1 CON MCULE-8687558307 [2,0,0,0,0,0|2,0,0]=4 1223 B2R0.1 CO[NH3+] MCULE-6631452734 [2,0,0,0,0,0|2,0,0]=4 1224 B2R0.1 CO[NH3+] MCULE-9975010969 [2,0,0,0,0,0|2,0,0]=4 1225 B2R0.1 CSC MCULE-4525381422 [2,0,0,0,0,0|1,0,0]=3 1226 B2R0.1 C[Se]C MCULE-5369504805 [2,0,0,0,0,0|1,0,0]=3 1227 B2R0.1 N#CN MCULE-9026610515 [2,0,0,0,0,0|1,0,1]=4 1228 B2R0.1 N=C=O MCULE-6805056266 [2,0,0,0,0,0|0,0,2]=4 1229 B2R0.1 N=CN MCULE-3312866825 [2,0,0,0,0,0|1,0,0]=3 1230 B2R0.1 N=CN MCULE-4184922761 [2,0,0,0,0,0|1,0,0]=3 1231 B2R0.1 N=CN MCULE-8637660949 [2,0,0,0,0,0|1,0,0]=3 1232 B2R0.1 NC=O MCULE-1633954643 [2,0,0,0,0,0|0,0,0]=2 1233 B2R0.1 NC=O MCULE-4202420620 [2,0,0,0,0,0|0,0,0]=2 1234 B2R0.1 NC=S MCULE-9004645073 [2,0,0,0,0,0|0,1,0]=3 1235 B2R0.1 NC=[NH2+] MCULE-1491590547 [2,0,0,0,0,0|1,0,0]=3 1236 B2R0.1 NCN MCULE-1911584441 [2,0,0,0,0,0|1,0,1]=4 1237 B2R0.1 NCN MCULE-5032116024 [2,0,0,0,0,0|1,0,1]=4 1238 B2R0.1 O=BO MCULE-1752281859 [2,0,0,0,0,0|2,0,0]=4 1239 B2R0.1 O=CO MCULE-7175589186 [2,0,0,0,0,0|1,0,0]=3 1240 B2R0.1 O=C[O-] MCULE-2970986504 [2,0,0,0,0,0|1,0,0]=3 1241 B2R0.1 O=C[O-] MCULE-3867870864 [2,0,0,0,0,0|1,0,0]=3 1242 B2R0.1 O=C[O-] MCULE-4029930501 [2,0,0,0,0,0|1,0,0]=3 1243 B2R0.1 O=NO MCULE-6927518919 [2,0,0,0,0,0|1,0,1]=4 1244 B2R0.1 O=N[O-] MCULE-3257981536 [2,0,0,0,0,0|1,0,1]=4 1245 B2R0.1 O=N[O-] MCULE-7337131268 [2,0,0,0,0,0|1,0,1]=4 1246 B2R0.1 O=PO MCULE-5287418544 [2,0,0,0,0,0|1,1,0]=4 1247 B2R0.1 O=P[O-] MCULE-3840413517 [2,0,0,0,0,0|1,1,0]=4 1248 B2R0.1 O=P[O-] MCULE-8243944513 [2,0,0,0,0,0|1,1,0]=4 1249 B2R0.1 O=S=O MCULE-5418662043 [2,0,0,0,0,0|2,0,0]=4 1250 B2R0.1 O=[Ge]=O MCULE-2024233522 [2,0,0,0,0,0|1,1,0]=4 1251 B2R0.1 O=[N+]=O MCULE-8164521024 [2,0,0,0,0,0|1,0,1]=4 1252 B2R0.1 O=[Se]=O MCULE-7119785212 [2,0,0,0,0,0|2,0,0]=4 1253 B2R0.1 O=[Si]=O MCULE-2341844083 [2,0,0,0,0,0|1,1,0]=4 1254 B2R0.1 O=[Te]=O MCULE-4837785402 [2,0,0,0,0,0|2,0,0]=4 1255 B4R0.2 BrC=CCBr MCULE-1480697982 [1,1,0,0,0,0|2,0,0]=4 1256 B4R0.2 C#CC=CC MCULE-9741359131 [1,1,0,0,0,0|2,0,0]=4 1257 B4R0.2 C#CCNC MCULE-9758975590 [1,1,0,0,0,0|1,0,1]=4 1258 B4R0.2 C/C=C/C#N MCULE-2754343103 [1,1,0,0,0,0|2,0,0]=4 1259 B4R0.2 C/C=C/C=O MCULE-9924705308 [1,1,0,0,0,0|1,0,0]=3 1260 B4R0.2 C/C=C/CCl MCULE-9977493525 [1,1,0,0,0,0|2,0,0]=4 1261 B4R0.2 C/C=C/CO MCULE-2383161163 [1,1,0,0,0,0|1,0,1]=4 1262 B4R0.2 C/C=C/OC MCULE-3906920304 [1,1,0,0,0,0|1,0,1]=4 1263 B4R0.2 C/C=C\CO MCULE-5924662327 [1,1,0,0,0,0|1,0,1]=4 1264 B4R0.2 C=C=CCC MCULE-6123315571 [1,1,0,0,0,0|2,0,0]=4 1265 B4R0.2 C=CC=CC MCULE-4452516287 [1,1,0,0,0,0|2,0,0]=4 1266 B4R0.2 C=CCCBr MCULE-2890129103 [1,1,0,0,0,0|2,0,0]=4 1267 B4R0.2 C=CCCC MCULE-8386546337 [1,1,0,0,0,0|2,0,0]=4 1268 B4R0.2 C=CCCCl MCULE-5903789900 [1,1,0,0,0,0|2,0,0]=4 1269 B4R0.2 C=CCCI MCULE-1055671394 [1,1,0,0,0,0|2,0,0]=4 1270 B4R0.2 C=CCCN MCULE-2471716627 [1,1,0,0,0,0|2,0,0]=4 1271 B4R0.2 C=CCCN MCULE-2881108697 [1,1,0,0,0,0|2,0,0]=4 1272 B4R0.2 C=CCCO MCULE-4582400839 [1,1,0,0,0,0|2,0,0]=4 1273 B4R0.2 C=CCNC MCULE-3335720336 [1,1,0,0,0,0|1,0,0]=3 1274 B4R0.2 C=CCNN MCULE-2550690274 [1,1,0,0,0,0|2,0,0]=4 1275 B4R0.2 C=CCNN MCULE-3554567414 [1,1,0,0,0,0|2,0,0]=4 1276 B4R0.2 C=CCNN MCULE-8741523989 [1,1,0,0,0,0|2,0,0]=4 1277 B4R0.2 C=CCOC MCULE-3321225771 [1,1,0,0,0,0|2,0,0]=4 1278 B4R0.2 C=CCSC MCULE-4452023915 [1,1,0,0,0,0|2,0,0]=4 1279 B4R0.2 C=CNC=O MCULE-8403928899 [1,1,0,0,0,0|0,0,1]=3 1280 B4R0.2 C=COCC MCULE-2569047033 [1,1,0,0,0,0|2,0,0]=4 1281 B4R0.2 C=CSCC MCULE-8927374165 [1,1,0,0,0,0|2,0,0]=4 1282 B4R0.2 CC#CC=O MCULE-9270622693 [1,1,0,0,0,0|1,0,0]=3 1283 B4R0.2 CC=CC#N MCULE-5062019142 [1,1,0,0,0,0|2,0,0]=4 1284 B4R0.2 CC=CC=O MCULE-2497362981 [1,1,0,0,0,0|1,0,0]=3 1285 B4R0.2 CC=CCBr MCULE-7855581866 [1,1,0,0,0,0|2,0,0]=4 1286 B4R0.2 CC=CCC MCULE-5931905453 [1,1,0,0,0,0|2,0,0]=4 1287 B4R0.2 CC=CCCl MCULE-3941962217 [1,1,0,0,0,0|2,0,0]=4 1288 B4R0.2 CC=CCO MCULE-7490725844 [1,1,0,0,0,0|1,0,1]=4 1289 B4R0.2 CC=COC MCULE-6712403535 [1,1,0,0,0,0|1,0,1]=4 1290 B4R0.2 CC=CSC MCULE-5921906156 [1,1,0,0,0,0|1,1,0]=4 1291 B4R0.2 CCC=CBr MCULE-4471551501 [1,1,0,0,0,0|2,0,0]=4 1292 B4R0.2 CCC=NO MCULE-9457280654 [1,1,0,0,0,0|1,0,1]=4 1293 B4R0.2 CCCC=O MCULE-8530391347 [1,1,0,0,0,0|1,0,0]=3 1294 B4R0.2 CCCNC MCULE-2266616259 [1,1,0,0,0,0|1,0,1]=4 1295 B4R0.2 CCCNC MCULE-7722796872 [1,1,0,0,0,0|1,0,1]=4 1296 B4R0.2 CCN=C=O MCULE-6522145601 [1,1,0,0,0,0|0,0,2]=4 1297 B4R0.2 CCNC=O MCULE-9309926274 [1,1,0,0,0,0|0,0,0]=2 1298 B4R0.2 CCNCC MCULE-3395060353 [1,1,0,0,0,0|1,0,1]=4 1299 B4R0.2 CCNCC MCULE-4374609736 [1,1,0,0,0,0|1,0,1]=4 1300 B4R0.2 CCNCC MCULE-4555901025 [1,1,0,0,0,0|1,0,1]=4 1301 B4R0.2 CCNCC MCULE-6895602113 [1,1,0,0,0,0|1,0,1]=4 1302 B4R0.2 CCNOC MCULE-4797714235 [1,1,0,0,0,0|1,0,1]=4 1303 B4R0.2 CCNOC MCULE-6486167423 [1,1,0,0,0,0|1,0,1]=4 1304 B4R0.2 CCOC=N MCULE-5321655909 [1,1,0,0,0,0|2,0,0]=4 1305 B4R0.2 CCOC=N MCULE-8158357614 [1,1,0,0,0,0|2,0,0]=4 1306 B4R0.2 CCOC=O MCULE-6245072161 [1,1,0,0,0,0|1,0,0]=3 1307 B4R0.2 CCONC MCULE-5446312516 [1,1,0,0,0,0|1,0,1]=4 1308 B4R0.2 CCONC MCULE-7976027802 [1,1,0,0,0,0|1,0,1]=4 1309 B4R0.2 CNCC#N MCULE-1233170363 [1,1,0,0,0,0|1,0,1]=4 1310 B4R0.2 CNCC#N MCULE-4334159739 [1,1,0,0,0,0|1,0,1]=4 1311 B4R0.2 CNCC#N MCULE-8267124503 [1,1,0,0,0,0|1,0,1]=4 1312 B4R0.2 CNCCBr MCULE-3708780806 [1,1,0,0,0,0|1,0,1]=4 1313 B4R0.2 CNCCBr MCULE-6840755559 [1,1,0,0,0,0|1,0,1]=4 1314 B4R0.2 CNCCCl MCULE-1666345560 [1,1,0,0,0,0|1,0,1]=4 1315 B4R0.2 CNCCCl MCULE-8215813413 [1,1,0,0,0,0|1,0,1]=4 1316 B4R0.2 CNCCF MCULE-3719880423 [1,1,0,0,0,0|1,0,1]=4 1317 B4R0.2 CNCCF MCULE-3751701745 [1,1,0,0,0,0|1,0,1]=4 1318 B4R0.2 CNCCI MCULE-7026781832 [1,1,0,0,0,0|1,0,1]=4 1319 B4R0.2 CNCCI MCULE-8892686580 [1,1,0,0,0,0|1,0,1]=4 1320 B4R0.2 CNCCN MCULE-2881688448 [1,1,0,0,0,0|1,0,1]=4 1321 B4R0.2 CNCCN MCULE-7199403269 [1,1,0,0,0,0|1,0,1]=4 1322 B4R0.2 CNCCO MCULE-7051900771 [1,1,0,0,0,0|0,0,2]=4 1323 B4R0.2 CNCCO MCULE-7934732981 [1,1,0,0,0,0|0,0,2]=4 1324 B4R0.2 CNCCS MCULE-6430516369 [1,1,0,0,0,0|0,1,1]=4 1325 B4R0.2 COCC=O MCULE-9427361019 [1,1,0,0,0,0|1,0,0]=3 1326 B4R0.2 Cl/C=C/CCl MCULE-4516188972 [1,1,0,0,0,0|2,0,0]=4 1327 B4R0.2 ClC/C=C/Br MCULE-1061414929 [1,1,0,0,0,0|2,0,0]=4 1328 B4R0.2 ClC=CCCl MCULE-4655672652 [1,1,0,0,0,0|2,0,0]=4 1329 B4R0.2 N/C=C/C=O MCULE-2444951625 [1,1,0,0,0,0|1,0,1]=4 1330 B4R0.2 NC=CC=O MCULE-4070918342 [1,1,0,0,0,0|1,0,1]=4 1331 B4R0.2 O=C=NCCl MCULE-7751104052 [1,1,0,0,0,0|0,0,2]=4 1332 B4R0.2 O=CCCBr MCULE-4107157458 [1,1,0,0,0,0|1,0,0]=3 1333 B4R0.2 O=CCCCl MCULE-5863929313 [1,1,0,0,0,0|1,0,0]=3 1334 B4R0.2 O=CCCI MCULE-9771140462 [1,1,0,0,0,0|1,0,0]=3 1335 B4R0.2 O=CCCO MCULE-1685289763 [1,1,0,0,0,0|1,0,0]=3 1336 B4R0.2 O=CNC=O MCULE-3098379420 [1,1,0,0,0,0|0,0,1]=3 1337 B4R0.2 O=COC=O MCULE-6311384332 [1,1,0,0,0,0|1,0,1]=4 1338 B4R0.2 O=C[N-]C=O MCULE-4923470284 [1,1,0,0,0,0|0,0,2]=4 1339 B4R0.2 OC=CCCl MCULE-4750991393 [1,1,0,0,0,0|1,0,1]=4 1340 B4R0.2 OCC=CBr MCULE-4636104289 [1,1,0,0,0,0|2,0,0]=4 1341 B4R0.2 OCC=CCl MCULE-2110127594 [1,1,0,0,0,0|2,0,0]=4 1342 B4R0.3 C=N(C)(C)Cl MCULE-3152663998 [1,1,0,0,0,0|0,0,1]=3 1343 B4R0.3 CC(C)(Br)Br MCULE-5323692926 [1,1,0,0,0,0|2,0,0]=4 1344 B4R0.3 CC(C)(C)Br MCULE-7499182970 [1,1,0,0,0,0|1,0,1]=4 1345 B4R0.3 CC(C)(C)Cl MCULE-3289240398 [1,1,0,0,0,0|1,0,1]=4 1346 B4R0.3 CC(C)(C)I MCULE-4526513944 [1,1,0,0,0,0|1,0,1]=4 1347 B4R0.3 CC(C)(C)N MCULE-6304532422 [1,1,0,0,0,0|1,0,1]=4 1348 B4R0.3 CC(C)(C)N MCULE-7949511330 [1,1,0,0,0,0|1,0,1]=4 1349 B4R0.3 CC(C)(C)O MCULE-2451492095 [1,1,0,0,0,0|1,0,1]=4 1350 B4R0.3 CC(C)(C)P MCULE-7154081259 [1,1,0,0,0,0|1,0,1]=4 1351 B4R0.3 CC(C)(C)S MCULE-6147507012 [1,1,0,0,0,0|1,0,1]=4 1352 B4R0.3 CC(C)(Cl)Cl MCULE-4748939799 [1,1,0,0,0,0|2,0,0]=4 1353 B4R0.3 CC(C)(F)F MCULE-5872625782 [1,1,0,0,0,0|2,0,0]=4 1354 B4R0.3 CN(=O)(C)C MCULE-5376400909 [1,1,0,0,0,0|0,0,1]=3 1355 B4R0.3 CP(=O)(C)C MCULE-2802987054 [1,1,0,0,0,0|0,1,0]=3 1356 B4R0.3 CP(=O)(C)Cl MCULE-7288561548 [1,1,0,0,0,0|0,1,0]=3 1357 B4R0.3 CP(=O)(C)O MCULE-6213882061 [1,1,0,0,0,0|0,1,0]=3 1358 B4R0.3 CP(=O)(Cl)Cl MCULE-3354163551 [1,1,0,0,0,0|1,1,0]=4 1359 B4R0.3 CP(=O)(O)O MCULE-1998702544 [1,1,0,0,0,0|1,1,0]=4 1360 B4R0.3 CP(=S)(C)Cl MCULE-3277835198 [1,1,0,0,0,0|0,2,0]=4 1361 B4R0.3 CS(=N)(=O)C MCULE-2258256823 [1,1,0,0,0,0|1,0,0]=3 1362 B4R0.3 CS(=N)(=O)C MCULE-9753633994 [1,1,0,0,0,0|1,0,0]=3 1363 B4R0.3 CS(=O)(=O)C MCULE-3320409932 [1,1,0,0,0,0|1,0,0]=3 1364 B4R0.3 CS(=O)(=O)Cl MCULE-2152421757 [1,1,0,0,0,0|2,0,0]=4 1365 B4R0.3 CS(=O)(=O)N MCULE-3286513976 [1,1,0,0,0,0|2,0,0]=4 1366 B4R0.3 CS(=O)(=O)O MCULE-3859614034 [1,1,0,0,0,0|2,0,0]=4 1367 B4R0.3 CS(=O)(=O)O MCULE-6572487779 [1,1,0,0,0,0|2,0,0]=4 1368 B4R0.3 CS(=O)(=O)O MCULE-9395657013 [1,1,0,0,0,0|2,0,0]=4 1369 B4R0.3 CS(=O)(=O)S MCULE-8894274858 [1,1,0,0,0,0|2,0,0]=4 1370 B4R0.3 CS(=O)(=O)[O-] MCULE-1087186932 [1,1,0,0,0,0|2,0,0]=4 1371 B4R0.3 CS(=O)(=O)[O-] MCULE-3893369887 [1,1,0,0,0,0|2,0,0]=4 1372 B4R0.3 CS(=O)(=S)[O-] MCULE-9870858882 [1,1,0,0,0,0|2,0,0]=4 1373 B4R0.3 CS(C)(Br)Br MCULE-4451528936 [1,1,0,0,0,0|2,0,0]=4 1374 B4R0.3 C[As](=O)(C)O MCULE-8596669108 [1,1,0,0,0,0|0,1,0]=3 1375 B4R0.3 C[As](=O)(O)O MCULE-7801777602 [1,1,0,0,0,0|1,1,0]=4 1376 B4R0.3 C[Ge](C)(C)Br MCULE-5550620894 [1,1,0,0,0,0|1,0,1]=4 1377 B4R0.3 C[Ge](C)(C)C MCULE-3960669880 [1,1,0,0,0,0|1,0,1]=4 1378 B4R0.3 C[Ge](C)(C)Cl MCULE-1572821903 [1,1,0,0,0,0|1,0,1]=4 1379 B4R0.3 C[Ge](C)(Cl)Cl MCULE-9440927104 [1,1,0,0,0,0|2,0,0]=4 1380 B4R0.3 C[N+](C)(C)C MCULE-1342262392 [1,1,0,0,0,0|0,0,2]=4 1381 B4R0.3 C[N+](C)(C)C MCULE-1837366554 [1,1,0,0,0,0|0,0,2]=4 1382 B4R0.3 C[N+](C)(C)C MCULE-3114633078 [1,1,0,0,0,0|0,0,2]=4 1383 B4R0.3 C[N+](C)(C)C MCULE-8602528678 [1,1,0,0,0,0|0,0,2]=4 1384 B4R0.3 C[N+](C)(C)C MCULE-8758631770 [1,1,0,0,0,0|0,0,2]=4 1385 B4R0.3 C[N+](C)(C)C MCULE-9749836604 [1,1,0,0,0,0|0,0,2]=4 1386 B4R0.3 C[N+](C)(C)N MCULE-2241507629 [1,1,0,0,0,0|0,0,2]=4 1387 B4R0.3 C[N+](C)(C)N MCULE-8001746254 [1,1,0,0,0,0|0,0,2]=4 1388 B4R0.3 C[N+](C)(C)[O-] MCULE-7128782190 [1,1,0,0,0,0|0,0,2]=4 1389 B4R0.3 C[P+](C)(C)C MCULE-1640858311 [1,1,0,0,0,0|0,1,1]=4 1390 B4R0.3 C[P+](C)(C)C MCULE-6694954822 [1,1,0,0,0,0|0,1,1]=4 1391 B4R0.3 C[P+](C)(C)C MCULE-9710389170 [1,1,0,0,0,0|0,1,1]=4 1392 B4R0.3 C[S+](=O)(C)C MCULE-2814839338 [1,1,0,0,0,0|1,0,0]=3 1393 B4R0.3 C[S+](=O)(C)C MCULE-6233776311 [1,1,0,0,0,0|1,0,0]=3 1394 B4R0.3 C[S+](=O)(C)C MCULE-8597659521 [1,1,0,0,0,0|1,0,0]=3 1395 B4R0.3 C[S+](=O)(C)C MCULE-8812954810 [1,1,0,0,0,0|1,0,0]=3 1396 B4R0.3 C[Si](C)(C)Br MCULE-4585744872 [1,1,0,0,0,0|1,0,1]=4 1397 B4R0.3 C[Si](C)(C)C MCULE-6525916858 [1,1,0,0,0,0|1,0,1]=4 1398 B4R0.3 C[Si](C)(C)Cl MCULE-6300422765 [1,1,0,0,0,0|1,0,1]=4 1399 B4R0.3 C[Si](C)(C)I MCULE-5974866799 [1,1,0,0,0,0|1,0,1]=4 1400 B4R0.3 C[Si](C)(C)O MCULE-7661125809 [1,1,0,0,0,0|1,0,1]=4 1401 B4R0.3 C[Si](C)(Cl)Cl MCULE-9942976055 [1,1,0,0,0,0|2,0,0]=4 1402 B4R0.3 C[Si](C)(F)F MCULE-8972526873 [1,1,0,0,0,0|2,0,0]=4 1403 B4R0.3 C[Sn](C)(C)C MCULE-1160619415 [1,1,0,0,0,0|1,0,1]=4 1404 B6R0.1 C#CCN(C)CC MCULE-4046146529 [0,2,0,0,0,0|1,0,1]=4 1405 B6R0.1 C#CCN(C)CC MCULE-6846440848 [0,2,0,0,0,0|1,0,1]=4 1406 B6R0.1 C=C=CC(C)CO MCULE-4111632331 [0,2,0,0,0,0|2,0,0]=4 1407 B6R0.1 C=CC(C)CCC MCULE-2692803387 [0,2,0,0,0,0|2,0,0]=4 1408 B6R0.1 C=CC(C)CCO MCULE-2890369298 [0,2,0,0,0,0|2,0,0]=4 1409 B6R0.1 C=CCC(C)C=O MCULE-3981206051 [0,2,0,0,0,0|1,0,0]=3 1410 B6R0.1 C=CCC(C)CC MCULE-8680856865 [0,2,0,0,0,0|2,0,0]=4 1411 B6R0.1 C=CCC(C)CO MCULE-9174943108 [0,2,0,0,0,0|2,0,0]=4 1412 B6R0.1 C=CC[C@H](C)C=O MCULE-6968117309 [0,2,0,0,0,0|1,0,0]=3 1413 B6R0.1 CC(=CCBr)CBr MCULE-6875050264 [0,2,0,0,0,0|2,0,0]=4 1414 B6R0.1 CC(=CCBr)CCl MCULE-3390489656 [0,2,0,0,0,0|2,0,0]=4 1415 B6R0.1 CC(=CN=O)NO MCULE-1780424821 [0,2,0,0,0,0|2,0,0]=4 1416 B6R0.1 CC/C=C(\C)/C=O MCULE-6692882718 [0,2,0,0,0,0|1,0,0]=3 1417 B6R0.1 CCC(=CCO)C MCULE-5264054153 [0,2,0,0,0,0|1,0,1]=4 1418 B6R0.1 CCC(C)C=NO MCULE-2829500970 [0,2,0,0,0,0|1,0,1]=4 1419 B6R0.1 CCC(C)CC=O MCULE-9143756592 [0,2,0,0,0,0|1,0,0]=3 1420 B6R0.1 CCC(C)N=C=O MCULE-4771945289 [0,2,0,0,0,0|1,0,1]=4 1421 B6R0.1 CCC(C)NC=O MCULE-2197007756 [0,2,0,0,0,0|1,0,0]=3 1422 B6R0.1 CCC(C)OC=O MCULE-9361787208 [0,2,0,0,0,0|1,0,0]=3 1423 B6R0.1 CCC=C(C)C=O MCULE-1636090264 [0,2,0,0,0,0|1,0,0]=3 1424 B6R0.1 CCCC(C)C=O MCULE-9756444218 [0,2,0,0,0,0|1,0,0]=3 1425 B6R0.1 CCN(C)CCCl MCULE-4264927085 [0,2,0,0,0,0|1,0,1]=4 1426 B6R0.1 CCN(C)CCCl MCULE-8125659652 [0,2,0,0,0,0|1,0,1]=4 1427 B6R0.1 CCN(C)CCN MCULE-9503910262 [0,2,0,0,0,0|1,0,1]=4 1428 B6R0.1 CCN(C)CCO MCULE-5519271145 [0,2,0,0,0,0|0,0,2]=4 1429 B6R0.1 CCN(C)CCS MCULE-9974758531 [0,2,0,0,0,0|0,1,1]=4 1430 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [0,2,0,0,0,0|2,0,0]=4 1431 B6R0.1 CN(C=O)CCO MCULE-3588371476 [0,2,0,0,0,0|0,0,0]=2 1432 B6R0.1 CN(CCO)N=O MCULE-3975606321 [0,2,0,0,0,0|1,0,0]=3 1433 B6R0.1 CNN(C)CCN MCULE-3863653213 [0,2,0,0,0,0|1,0,1]=4 1434 B6R0.1 COC(=O)CC=O MCULE-6624474559 [0,2,0,0,0,0|2,0,0]=4 1435 B6R0.1 COC(=O)NC=O MCULE-9852632340 [0,2,0,0,0,0|2,0,0]=4 1436 B6R0.1 COC(C)CC=O MCULE-7243333697 [0,2,0,0,0,0|1,0,0]=3 1437 B6R0.1 COCC(C)C=O MCULE-7679332713 [0,2,0,0,0,0|1,0,0]=3 1438 B6R0.1 CON(C)CCN MCULE-9318319159 [0,2,0,0,0,0|1,0,1]=4 1439 B6R0.1 CSC(C)CC=O MCULE-9433914892 [0,2,0,0,0,0|1,0,0]=3 1440 B6R0.1 O=CC[C@H](O)CCl MCULE-6385696769 [0,2,0,0,0,0|2,0,0]=4 1441 B6R0.2 C=C(C)C=C(C)C MCULE-1842732141 [0,2,0,0,0,0|2,0,0]=4 1442 B6R0.2 C=C(C)CC(=O)C MCULE-3534735279 [0,2,0,0,0,0|1,0,1]=4 1443 B6R0.2 C=C(C)CC(=O)O MCULE-5404023928 [0,2,0,0,0,0|1,0,1]=4 1444 B6R0.2 C=C(C)CC(C)C MCULE-5553118538 [0,2,0,0,0,0|2,0,0]=4 1445 B6R0.2 C=C(C)OC(=O)C MCULE-9345377025 [0,2,0,0,0,0|1,0,1]=4 1446 B6R0.2 CC(=CB(O)O)C MCULE-5305023524 [0,2,0,0,0,0|1,0,1]=4 1447 B6R0.2 CC(=CC(=O)Cl)C MCULE-7644585609 [0,2,0,0,0,0|1,0,0]=3 1448 B6R0.2 CC(=CC(=O)N)C MCULE-6264319579 [0,2,0,0,0,0|1,0,0]=3 1449 B6R0.2 CC(=CC(=O)O)C MCULE-4772426340 [0,2,0,0,0,0|1,0,0]=3 1450 B6R0.2 CC(=CC(=O)O)Cl MCULE-7503760292 [0,2,0,0,0,0|2,0,0]=4 1451 B6R0.2 CC(=CC(=O)O)I MCULE-2652373771 [0,2,0,0,0,0|2,0,0]=4 1452 B6R0.2 CC(=CC(=O)O)N MCULE-5894724848 [0,2,0,0,0,0|2,0,0]=4 1453 B6R0.2 CC(=CC(C)C)C MCULE-5460531772 [0,2,0,0,0,0|2,0,0]=4 1454 B6R0.2 CC(=CC(C)O)C MCULE-5270694894 [0,2,0,0,0,0|1,0,1]=4 1455 B6R0.2 CC(=CN(=O)=O)C MCULE-7745125648 [0,2,0,0,0,0|1,0,0]=3 1456 B6R0.2 CC(=C[N+](=O)[O-])[O-] MCULE-1079281493 [0,2,0,0,0,0|2,0,0]=4 1457 B6R0.2 CC(=C[N+](=O)[O-])[O-] MCULE-4355961794 [0,2,0,0,0,0|2,0,0]=4 1458 B6R0.2 CC(=N)CC(=O)C MCULE-4678643052 [0,2,0,0,0,0|2,0,0]=4 1459 B6R0.2 CC(=NC(C)C)C MCULE-4174313497 [0,2,0,0,0,0|2,0,0]=4 1460 B6R0.2 CC(=NN(C)C)C MCULE-6010928278 [0,2,0,0,0,0|1,0,0]=3 1461 B6R0.2 CC(=O)/C=C(/C)\N MCULE-1235186190 [0,2,0,0,0,0|2,0,0]=4 1462 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-3445340105 [0,2,0,0,0,0|2,0,0]=4 1463 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-7833799417 [0,2,0,0,0,0|2,0,0]=4 1464 B6R0.2 CC(=O)/C=C(\C)/N MCULE-6412393370 [0,2,0,0,0,0|2,0,0]=4 1465 B6R0.2 CC(=O)C=C(C)C MCULE-4922478422 [0,2,0,0,0,0|1,0,0]=3 1466 B6R0.2 CC(=O)C=C(C)N MCULE-2247743178 [0,2,0,0,0,0|2,0,0]=4 1467 B6R0.2 CC(=O)C=C(C)O MCULE-7345258397 [0,2,0,0,0,0|2,0,0]=4 1468 B6R0.2 CC(=O)C=C(C)[O-] MCULE-7733093724 [0,2,0,0,0,0|2,0,0]=4 1469 B6R0.2 CC(=O)CC(=O)C MCULE-6481204381 [0,2,0,0,0,0|2,0,0]=4 1470 B6R0.2 CC(=O)CC(=O)N MCULE-1618058771 [0,2,0,0,0,0|2,0,0]=4 1471 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [0,2,0,0,0,0|2,0,0]=4 1472 B6R0.2 CC(=O)CC(=O)[O-] MCULE-6317885864 [0,2,0,0,0,0|2,0,0]=4 1473 B6R0.2 CC(=O)CC(=O)[O-] MCULE-8448177875 [0,2,0,0,0,0|2,0,0]=4 1474 B6R0.2 CC(=O)CC(C)C MCULE-2172909634 [0,2,0,0,0,0|1,0,0]=3 1475 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [0,2,0,0,0,0|2,0,0]=4 1476 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [0,2,0,0,0,0|2,0,0]=4 1477 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [0,2,0,0,0,0|2,0,0]=4 1478 B6R0.2 CC(=O)CN(C)C MCULE-8561521241 [0,2,0,0,0,0|0,0,0]=2 1479 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [0,2,0,0,0,0|2,0,0]=4 1480 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [0,2,0,0,0,0|2,0,0]=4 1481 B6R0.2 CC(=O)NC(=O)C MCULE-3040534108 [0,2,0,0,0,0|2,0,0]=4 1482 B6R0.2 CC(=O)NC(=O)N MCULE-8999775359 [0,2,0,0,0,0|2,0,0]=4 1483 B6R0.2 CC(=O)NC(C)C MCULE-2095134698 [0,2,0,0,0,0|1,0,0]=3 1484 B6R0.2 CC(=O)NN(C)C MCULE-3444969121 [0,2,0,0,0,0|0,0,0]=2 1485 B6R0.2 CC(=O)NN(C)C MCULE-5383938091 [0,2,0,0,0,0|0,0,0]=2 1486 B6R0.2 CC(=O)OC(=O)C MCULE-9184217748 [0,2,0,0,0,0|2,0,0]=4 1487 B6R0.2 CC(=O)OC(C)Br MCULE-6494616843 [0,2,0,0,0,0|2,0,0]=4 1488 B6R0.2 CC(=O)OC(C)C MCULE-6152257819 [0,2,0,0,0,0|1,0,0]=3 1489 B6R0.2 CC(=O)OC(C)Cl MCULE-3738479003 [0,2,0,0,0,0|2,0,0]=4 1490 B6R0.2 CC(=O)SC(=O)C MCULE-5749449964 [0,2,0,0,0,0|2,0,0]=4 1491 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-4855074933 [0,2,0,0,0,0|2,0,0]=4 1492 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-6905854247 [0,2,0,0,0,0|2,0,0]=4 1493 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [0,2,0,0,0,0|2,0,0]=4 1494 B6R0.2 CC(C)CC(=N)N MCULE-1578322850 [0,2,0,0,0,0|2,0,0]=4 1495 B6R0.2 CC(C)CC(=N)N MCULE-1643115412 [0,2,0,0,0,0|2,0,0]=4 1496 B6R0.2 CC(C)CC(=N)N MCULE-9650824038 [0,2,0,0,0,0|2,0,0]=4 1497 B6R0.2 CC(C)CC(=O)Cl MCULE-8821231794 [0,2,0,0,0,0|1,0,0]=3 1498 B6R0.2 CC(C)CC(=O)N MCULE-7790849976 [0,2,0,0,0,0|1,0,0]=3 1499 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [0,2,0,0,0,0|1,0,0]=3 1500 B6R0.2 CC(C)CC(=S)N MCULE-7704222819 [0,2,0,0,0,0|1,1,0]=4 1501 B6R0.2 CC(C)CN(=O)=O MCULE-1357840093 [0,2,0,0,0,0|1,0,1]=4 1502 B6R0.2 CC(C)CS(=O)[O-] MCULE-3716652382 [0,2,0,0,0,0|1,0,1]=4 1503 B6R0.2 CC(C)CS(=O)[O-] MCULE-7111094918 [0,2,0,0,0,0|1,0,1]=4 1504 B6R0.2 CC(C)NC(=N)N MCULE-4913172476 [0,2,0,0,0,0|2,0,0]=4 1505 B6R0.2 CC(C)NC(=N)N MCULE-4959976198 [0,2,0,0,0,0|2,0,0]=4 1506 B6R0.2 CC(C)NC(=N)N MCULE-5602505573 [0,2,0,0,0,0|2,0,0]=4 1507 B6R0.2 CC(C)NC(=N)N MCULE-8448870710 [0,2,0,0,0,0|2,0,0]=4 1508 B6R0.2 CC(C)NC(=O)N MCULE-2725741897 [0,2,0,0,0,0|1,0,0]=3 1509 B6R0.2 CC(C)NC(=S)N MCULE-9243939729 [0,2,0,0,0,0|1,1,0]=4 1510 B6R0.2 CC(C)OC(=N)N MCULE-3607061697 [0,2,0,0,0,0|2,0,0]=4 1511 B6R0.2 CC(C)OC(=N)N MCULE-6662387960 [0,2,0,0,0,0|2,0,0]=4 1512 B6R0.2 CC(C)OC(=O)Cl MCULE-3303340398 [0,2,0,0,0,0|1,0,0]=3 1513 B6R0.2 CC(C)OC(=O)N MCULE-9996500963 [0,2,0,0,0,0|1,0,0]=3 1514 B6R0.2 CC(C)OC(=S)[S-] MCULE-2902588510 [0,2,0,0,0,0|1,1,0]=4 1515 B6R0.2 CC(C)OC(=S)[S-] MCULE-9078070002 [0,2,0,0,0,0|1,1,0]=4 1516 B6R0.2 CC(C)OC(=S)[S-] MCULE-9949285618 [0,2,0,0,0,0|1,1,0]=4 1517 B6R0.2 CC(C)ON(=O)=O MCULE-8820340461 [0,2,0,0,0,0|2,0,0]=4 1518 B6R0.2 CC(C)SC(=N)N MCULE-1974434339 [0,2,0,0,0,0|2,0,0]=4 1519 B6R0.2 CC(C)SC(=N)N MCULE-3570639733 [0,2,0,0,0,0|2,0,0]=4 1520 B6R0.2 CC(C)SC(=O)Cl MCULE-9803882280 [0,2,0,0,0,0|1,0,0]=3 1521 B6R0.2 CC(Cl)CC(=O)Cl MCULE-3323045052 [0,2,0,0,0,0|2,0,0]=4 1522 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [0,2,0,0,0,0|2,0,0]=4 1523 B6R0.2 CC(Cl)CN(C)C MCULE-6738916847 [0,2,0,0,0,0|1,0,1]=4 1524 B6R0.2 CC(Cl)CN(C)C MCULE-7074789151 [0,2,0,0,0,0|1,0,1]=4 1525 B6R0.2 CC(Cl)OC(=O)Cl MCULE-8020850544 [0,2,0,0,0,0|2,0,0]=4 1526 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [0,2,0,0,0,0|2,0,0]=4 1527 B6R0.2 CC(N)CC(=O)N MCULE-8604112274 [0,2,0,0,0,0|2,0,0]=4 1528 B6R0.2 CC(N)CC(=O)N MCULE-8651032460 [0,2,0,0,0,0|2,0,0]=4 1529 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [0,2,0,0,0,0|2,0,0]=4 1530 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [0,2,0,0,0,0|2,0,0]=4 1531 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [0,2,0,0,0,0|2,0,0]=4 1532 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [0,2,0,0,0,0|2,0,0]=4 1533 B6R0.2 CC(N)CN(C)C MCULE-4834268309 [0,2,0,0,0,0|1,0,1]=4 1534 B6R0.2 CC(N)CN(C)C MCULE-9601630435 [0,2,0,0,0,0|1,0,1]=4 1535 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [0,2,0,0,0,0|2,0,0]=4 1536 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [0,2,0,0,0,0|2,0,0]=4 1537 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [0,2,0,0,0,0|2,0,0]=4 1538 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [0,2,0,0,0,0|2,0,0]=4 1539 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [0,2,0,0,0,0|2,0,0]=4 1540 B6R0.2 CC(O)CN(C)C MCULE-6531222530 [0,2,0,0,0,0|0,0,2]=4 1541 B6R0.2 CC(O)CN(C)C MCULE-7127620454 [0,2,0,0,0,0|0,0,2]=4 1542 B6R0.2 CN(C)CC(=O)Cl MCULE-2168217529 [0,2,0,0,0,0|0,0,0]=2 1543 B6R0.2 CN(C)CC(=O)Cl MCULE-6810056185 [0,2,0,0,0,0|0,0,0]=2 1544 B6R0.2 CN(C)CC(=O)N MCULE-3894706713 [0,2,0,0,0,0|0,0,0]=2 1545 B6R0.2 CN(C)CC(=O)O MCULE-2303978039 [0,2,0,0,0,0|0,0,0]=2 1546 B6R0.2 CN(C)CC(=O)O MCULE-3368936600 [0,2,0,0,0,0|0,0,0]=2 1547 B6R0.2 CN(C)CC(=O)[O-] MCULE-3077067854 [0,2,0,0,0,0|0,0,0]=2 1548 B6R0.2 CN(C)CC(=S)N MCULE-3863789639 [0,2,0,0,0,0|0,1,0]=3 1549 B6R0.2 CN(C)CC(=S)N MCULE-8756068308 [0,2,0,0,0,0|0,1,0]=3 1550 B6R0.2 CN(C)CN(C)C MCULE-3005702067 [0,2,0,0,0,0|1,0,1]=4 1551 B6R0.2 CN(C)NC(=O)N MCULE-4462686977 [0,2,0,0,0,0|0,0,0]=2 1552 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [0,2,0,0,0,0|2,0,0]=4 1553 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [0,2,0,0,0,0|2,0,0]=4 1554 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [0,2,0,0,0,0|2,0,0]=4 1555 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [0,2,0,0,0,0|2,0,0]=4 1556 B6R0.2 C[C@@H](N)CN(C)C MCULE-2034828409 [0,2,0,0,0,0|1,0,1]=4 1557 B6R0.2 C[C@@H](N)CN(C)C MCULE-2147556460 [0,2,0,0,0,0|1,0,1]=4 1558 B6R0.2 C[C@@H](N)CN(C)C MCULE-6097836560 [0,2,0,0,0,0|1,0,1]=4 1559 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [0,2,0,0,0,0|2,0,0]=4 1560 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [0,2,0,0,0,0|2,0,0]=4 1561 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [0,2,0,0,0,0|2,0,0]=4 1562 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [0,2,0,0,0,0|2,0,0]=4 1563 B6R0.2 C[C@@H](O)CN(C)C MCULE-3114172439 [0,2,0,0,0,0|0,0,2]=4 1564 B6R0.2 C[C@@H](O)CN(C)C MCULE-9927679143 [0,2,0,0,0,0|0,0,2]=4 1565 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [0,2,0,0,0,0|2,0,0]=4 1566 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [0,2,0,0,0,0|2,0,0]=4 1567 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [0,2,0,0,0,0|2,0,0]=4 1568 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [0,2,0,0,0,0|2,0,0]=4 1569 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [0,2,0,0,0,0|2,0,0]=4 1570 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [0,2,0,0,0,0|2,0,0]=4 1571 B6R0.2 C[C@H](N)CN(C)C MCULE-2526118342 [0,2,0,0,0,0|1,0,1]=4 1572 B6R0.2 C[C@H](N)CN(C)C MCULE-3902055308 [0,2,0,0,0,0|1,0,1]=4 1573 B6R0.2 C[C@H](N)CN(C)C MCULE-4292583182 [0,2,0,0,0,0|1,0,1]=4 1574 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [0,2,0,0,0,0|2,0,0]=4 1575 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [0,2,0,0,0,0|2,0,0]=4 1576 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [0,2,0,0,0,0|2,0,0]=4 1577 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [0,2,0,0,0,0|2,0,0]=4 1578 B6R0.2 C[C@H](O)CN(C)C MCULE-4542650002 [0,2,0,0,0,0|0,0,2]=4 1579 B6R0.2 C[C@H](O)CN(C)C MCULE-4717676519 [0,2,0,0,0,0|0,0,2]=4 1580 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-1975585935 [0,2,0,0,0,0|1,0,0]=3 1581 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-7679949306 [0,2,0,0,0,0|1,0,0]=3 1582 B6R0.2 P(=O)([O-])OC(C)C MCULE-5865480150 [0,2,0,0,0,0|2,0,0]=4 1583 B6R0.2 P(=O)([O-])OC(C)C MCULE-7393903455 [0,2,0,0,0,0|2,0,0]=4 1584 B6R0.3 C#CC(=O)C(C)C MCULE-9471281560 [0,2,0,0,0,0|1,0,0]=3 1585 B6R0.3 C#CC(=O)N(C)C MCULE-6032188951 [0,2,0,0,0,0|0,0,0]=2 1586 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [0,2,0,0,0,0|1,0,0]=3 1587 B6R0.3 C(N)(CO)C(=O)N MCULE-5512645571 [0,2,0,0,0,0|2,0,0]=4 1588 B6R0.3 C(N)(CO)C(=O)N MCULE-5852943337 [0,2,0,0,0,0|2,0,0]=4 1589 B6R0.3 C/C=C(/C)\C(=O)O MCULE-2116066534 [0,2,0,0,0,0|1,0,0]=3 1590 B6R0.3 C/C=C(\Br)/C(=O)O MCULE-5940308548 [0,2,0,0,0,0|2,0,0]=4 1591 B6R0.3 C/C=C(\C)/C(=O)O MCULE-4890719796 [0,2,0,0,0,0|1,0,0]=3 1592 B6R0.3 C/C=C(\O)/C(=O)O MCULE-9596699660 [0,2,0,0,0,0|2,0,0]=4 1593 B6R0.3 C=C(C#N)N(C)C MCULE-2299870069 [0,2,0,0,0,0|1,0,0]=3 1594 B6R0.3 C=C(C)C(=O)NC MCULE-9515227181 [0,2,0,0,0,0|1,0,1]=4 1595 B6R0.3 C=C(C)C(=O)NN MCULE-5114453960 [0,2,0,0,0,0|1,0,1]=4 1596 B6R0.3 C=C(C)C(=O)OC MCULE-9286083206 [0,2,0,0,0,0|1,0,1]=4 1597 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [0,2,0,0,0,0|2,0,0]=4 1598 B6R0.3 C=C(CBr)C(=O)O MCULE-7257367588 [0,2,0,0,0,0|1,0,1]=4 1599 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [0,2,0,0,0,0|1,0,1]=4 1600 B6R0.3 C=C(CO)C(=O)O MCULE-9731648602 [0,2,0,0,0,0|1,0,1]=4 1601 B6R0.3 C=C(I)C(C)CI MCULE-8558127481 [0,2,0,0,0,0|2,0,0]=4 1602 B6R0.3 C=C(I)[C@H](C)CI MCULE-1089285398 [0,2,0,0,0,0|2,0,0]=4 1603 B6R0.3 C=C(I)[C@H](C)CI MCULE-5444456468 [0,2,0,0,0,0|2,0,0]=4 1604 B6R0.3 C=C(OC)C(=O)O MCULE-9965334560 [0,2,0,0,0,0|1,0,1]=4 1605 B6R0.3 C=CC(=O)C(C)C MCULE-8577593172 [0,2,0,0,0,0|1,0,0]=3 1606 B6R0.3 C=CC(=O)N(C)C MCULE-3105693382 [0,2,0,0,0,0|0,0,0]=2 1607 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [0,2,0,0,0,0|1,0,1]=4 1608 B6R0.3 C=CC(C)C(C)C MCULE-4461669612 [0,2,0,0,0,0|2,0,0]=4 1609 B6R0.3 C=CC(C)C(C)O MCULE-5639096655 [0,2,0,0,0,0|2,0,0]=4 1610 B6R0.3 C=CC(O)C(C)C MCULE-2504249276 [0,2,0,0,0,0|2,0,0]=4 1611 B6R0.3 C=CN(C)C(=O)C MCULE-2418332000 [0,2,0,0,0,0|0,0,1]=3 1612 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [0,2,0,0,0,0|1,0,1]=4 1613 B6R0.3 C=C[C@@H](C)[C@@H](C)O MCULE-1946110265 [0,2,0,0,0,0|2,0,0]=4 1614 B6R0.3 C=C[C@@H](C)[C@@H](C)O MCULE-2042493608 [0,2,0,0,0,0|2,0,0]=4 1615 B6R0.3 C=C[C@@H](C)[C@H](C)O MCULE-1482556738 [0,2,0,0,0,0|2,0,0]=4 1616 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [0,2,0,0,0,0|1,0,1]=4 1617 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [0,2,0,0,0,0|1,0,1]=4 1618 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [0,2,0,0,0,0|1,0,1]=4 1619 B6R0.3 C=C[C@H](C)[C@@H](C)O MCULE-4591189626 [0,2,0,0,0,0|2,0,0]=4 1620 B6R0.3 C=C[C@H](C)[C@H](C)O MCULE-2180884086 [0,2,0,0,0,0|2,0,0]=4 1621 B6R0.3 C=C[C@H](C)[C@H](C)O MCULE-2347920403 [0,2,0,0,0,0|2,0,0]=4 1622 B6R0.3 CC(=C(Br)CBr)C MCULE-2575044530 [0,2,0,0,0,0|2,0,0]=4 1623 B6R0.3 CC(=C(Br)CN)C MCULE-2433306744 [0,2,0,0,0,0|2,0,0]=4 1624 B6R0.3 CC(=C(C)CO)C MCULE-2852322197 [0,2,0,0,0,0|1,0,1]=4 1625 B6R0.3 CC(=C(F)CN)C MCULE-8503104664 [0,2,0,0,0,0|2,0,0]=4 1626 B6R0.3 CC(=C(F)CN)C MCULE-8932417146 [0,2,0,0,0,0|2,0,0]=4 1627 B6R0.3 CC(=C(F)CO)C MCULE-3552996593 [0,2,0,0,0,0|1,0,1]=4 1628 B6R0.3 CC(=CBr)C(=O)O MCULE-3682516046 [0,2,0,0,0,0|1,0,1]=4 1629 B6R0.3 CC(=N)N(C)C#N MCULE-6981931328 [0,2,0,0,0,0|1,0,1]=4 1630 B6R0.3 CC(=NO)C(=O)O MCULE-8264934008 [0,2,0,0,0,0|2,0,0]=4 1631 B6R0.3 CC(=O)/C(=N/O)/C MCULE-2017881701 [0,2,0,0,0,0|2,0,0]=4 1632 B6R0.3 CC(=O)/C(=N\O)/C MCULE-6814264333 [0,2,0,0,0,0|2,0,0]=4 1633 B6R0.3 CC(=O)C(=NO)C MCULE-3626428375 [0,2,0,0,0,0|2,0,0]=4 1634 B6R0.3 CC(=O)C(=O)CBr MCULE-8560925164 [0,2,0,0,0,0|2,0,0]=4 1635 B6R0.3 CC(=O)C(=O)CCl MCULE-2778551811 [0,2,0,0,0,0|2,0,0]=4 1636 B6R0.3 CC(=O)C(Br)C=O MCULE-6904531970 [0,2,0,0,0,0|2,0,0]=4 1637 B6R0.3 CC(=O)C(C)C#N MCULE-3849364002 [0,2,0,0,0,0|1,0,1]=4 1638 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [0,2,0,0,0,0|1,0,0]=3 1639 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [0,2,0,0,0,0|1,0,0]=3 1640 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [0,2,0,0,0,0|2,0,0]=4 1641 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [0,2,0,0,0,0|2,0,0]=4 1642 B6R0.3 CC(C#N)C(=O)N MCULE-2138676966 [0,2,0,0,0,0|1,0,1]=4 1643 B6R0.3 CC(C#N)C(=O)O MCULE-3302580561 [0,2,0,0,0,0|1,0,1]=4 1644 B6R0.3 CC(C#N)N(C)C MCULE-5893415129 [0,2,0,0,0,0|1,0,1]=4 1645 B6R0.3 CC(C)/C(=N/O)/Cl MCULE-8655360746 [0,2,0,0,0,0|1,0,1]=4 1646 B6R0.3 CC(C)/C(=N/O)/N MCULE-4474697690 [0,2,0,0,0,0|1,0,1]=4 1647 B6R0.3 CC(C)C(=N)NN MCULE-9932640155 [0,2,0,0,0,0|2,0,0]=4 1648 B6R0.3 CC(C)C(=N)NO MCULE-9934498877 [0,2,0,0,0,0|1,0,1]=4 1649 B6R0.3 CC(C)C(=O)CBr MCULE-5913227185 [0,2,0,0,0,0|1,0,0]=3 1650 B6R0.3 CC(C)C(=O)CCl MCULE-4093256141 [0,2,0,0,0,0|1,0,0]=3 1651 B6R0.3 CC(C)C(=O)CN MCULE-6091425997 [0,2,0,0,0,0|1,0,0]=3 1652 B6R0.3 CC(C)C(=O)CN MCULE-7368122425 [0,2,0,0,0,0|1,0,0]=3 1653 B6R0.3 CC(C)C(=O)CO MCULE-8746789873 [0,2,0,0,0,0|1,0,0]=3 1654 B6R0.3 CC(C)C(=O)NN MCULE-1262854337 [0,2,0,0,0,0|1,0,0]=3 1655 B6R0.3 CC(C)C(Br)C=O MCULE-2054791376 [0,2,0,0,0,0|1,0,0]=3 1656 B6R0.3 CC(C)N(C)N=O MCULE-3797884338 [0,2,0,0,0,0|1,0,0]=3 1657 B6R0.3 CC(C)[C@H](N)C=O MCULE-6686967175 [0,2,0,0,0,0|1,0,0]=3 1658 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [0,2,0,0,0,0|1,0,0]=3 1659 B6R0.3 CC(CCl)N(C)C MCULE-1058476958 [0,2,0,0,0,0|1,0,1]=4 1660 B6R0.3 CC(CCl)N(C)C MCULE-3515287037 [0,2,0,0,0,0|1,0,1]=4 1661 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [0,2,0,0,0,0|1,0,0]=3 1662 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [0,2,0,0,0,0|1,0,0]=3 1663 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [0,2,0,0,0,0|1,0,0]=3 1664 B6R0.3 CC(CN)N(C)C MCULE-1383449400 [0,2,0,0,0,0|1,0,1]=4 1665 B6R0.3 CC(CN)N(C)C MCULE-9891789912 [0,2,0,0,0,0|1,0,1]=4 1666 B6R0.3 CC(CN)S(=O)C MCULE-9048112625 [0,2,0,0,0,0|2,0,0]=4 1667 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [0,2,0,0,0,0|1,0,0]=3 1668 B6R0.3 CC(CO)C(=O)[O-] MCULE-6956620176 [0,2,0,0,0,0|1,0,0]=3 1669 B6R0.3 CC(CO)N(=O)=O MCULE-5856696728 [0,2,0,0,0,0|2,0,0]=4 1670 B6R0.3 CC(CO)N(C)C MCULE-7300076854 [0,2,0,0,0,0|0,0,2]=4 1671 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [0,2,0,0,0,0|1,0,0]=3 1672 B6R0.3 CC(O)C(=O)NN MCULE-4510079670 [0,2,0,0,0,0|2,0,0]=4 1673 B6R0.3 CC(ON)C(=O)O MCULE-1969235976 [0,2,0,0,0,0|2,0,0]=4 1674 B6R0.3 CC(ON)C(=O)O MCULE-4318537884 [0,2,0,0,0,0|2,0,0]=4 1675 B6R0.3 CC(ON)C(=O)O MCULE-4455753863 [0,2,0,0,0,0|2,0,0]=4 1676 B6R0.3 CC(ON)C(=O)O MCULE-8893009712 [0,2,0,0,0,0|2,0,0]=4 1677 B6R0.3 CC=C(Br)C(=O)O MCULE-5368794596 [0,2,0,0,0,0|2,0,0]=4 1678 B6R0.3 CC=C(C)C(=O)C MCULE-8950290711 [0,2,0,0,0,0|1,0,0]=3 1679 B6R0.3 CC=C(C)C(=O)Cl MCULE-2974704783 [0,2,0,0,0,0|1,0,0]=3 1680 B6R0.3 CC=C(C)C(=O)O MCULE-2390677360 [0,2,0,0,0,0|1,0,0]=3 1681 B6R0.3 CC=C(C)C(C)C MCULE-4070109813 [0,2,0,0,0,0|2,0,0]=4 1682 B6R0.3 CC=C(Cl)C(=O)O MCULE-5827690088 [0,2,0,0,0,0|2,0,0]=4 1683 B6R0.3 CC=C(F)C(=O)O MCULE-5053310707 [0,2,0,0,0,0|2,0,0]=4 1684 B6R0.3 CC=C(O)C(=O)O MCULE-7886990963 [0,2,0,0,0,0|2,0,0]=4 1685 B6R0.3 CCC(=C(C)C)C MCULE-7258057243 [0,2,0,0,0,0|2,0,0]=4 1686 B6R0.3 CCC(=O)C(=O)C MCULE-3065014067 [0,2,0,0,0,0|2,0,0]=4 1687 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [0,2,0,0,0,0|2,0,0]=4 1688 B6R0.3 CCC(=O)C(=O)[O-] MCULE-7571698792 [0,2,0,0,0,0|2,0,0]=4 1689 B6R0.3 CCC(=O)C(C)Br MCULE-2803556971 [0,2,0,0,0,0|2,0,0]=4 1690 B6R0.3 CCC(=O)C(C)C MCULE-9576230007 [0,2,0,0,0,0|1,0,0]=3 1691 B6R0.3 CCC(=O)C(C)Cl MCULE-8346980404 [0,2,0,0,0,0|2,0,0]=4 1692 B6R0.3 CCC(=O)C(C)N MCULE-5434634349 [0,2,0,0,0,0|2,0,0]=4 1693 B6R0.3 CCC(=O)C(C)N MCULE-8408562669 [0,2,0,0,0,0|2,0,0]=4 1694 B6R0.3 CCC(=O)C(C)O MCULE-4144791660 [0,2,0,0,0,0|2,0,0]=4 1695 B6R0.3 CCC(=O)C(C)S MCULE-3934356624 [0,2,0,0,0,0|2,0,0]=4 1696 B6R0.3 CCC(=O)N(C)C MCULE-1734001200 [0,2,0,0,0,0|0,0,0]=2 1697 B6R0.3 CCC(=S)N(C)C MCULE-7026282622 [0,2,0,0,0,0|0,1,0]=3 1698 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [0,2,0,0,0,0|2,0,0]=4 1699 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [0,2,0,0,0,0|2,0,0]=4 1700 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [0,2,0,0,0,0|2,0,0]=4 1701 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [0,2,0,0,0,0|2,0,0]=4 1702 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [0,2,0,0,0,0|2,0,0]=4 1703 B6R0.3 CCC(C)C(=N)N MCULE-4070060089 [0,2,0,0,0,0|2,0,0]=4 1704 B6R0.3 CCC(C)C(=N)N MCULE-7020524406 [0,2,0,0,0,0|2,0,0]=4 1705 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [0,2,0,0,0,0|1,0,0]=3 1706 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [0,2,0,0,0,0|1,0,0]=3 1707 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [0,2,0,0,0,0|1,0,0]=3 1708 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [0,2,0,0,0,0|1,0,0]=3 1709 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [0,2,0,0,0,0|1,0,0]=3 1710 B6R0.3 CCC(C)C(=S)N MCULE-9682279721 [0,2,0,0,0,0|1,1,0]=4 1711 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [0,2,0,0,0,0|2,0,0]=4 1712 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [0,2,0,0,0,0|2,0,0]=4 1713 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [0,2,0,0,0,0|2,0,0]=4 1714 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [0,2,0,0,0,0|2,0,0]=4 1715 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [0,2,0,0,0,0|2,0,0]=4 1716 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [0,2,0,0,0,0|2,0,0]=4 1717 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [0,2,0,0,0,0|2,0,0]=4 1718 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [0,2,0,0,0,0|2,0,0]=4 1719 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [0,2,0,0,0,0|2,0,0]=4 1720 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [0,2,0,0,0,0|2,0,0]=4 1721 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [0,2,0,0,0,0|2,0,0]=4 1722 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [0,2,0,0,0,0|2,0,0]=4 1723 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [0,2,0,0,0,0|2,0,0]=4 1724 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [0,2,0,0,0,0|2,0,0]=4 1725 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [0,2,0,0,0,0|2,0,0]=4 1726 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [0,2,0,0,0,0|2,0,0]=4 1727 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [0,2,0,0,0,0|2,0,0]=4 1728 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [0,2,0,0,0,0|2,0,0]=4 1729 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [0,2,0,0,0,0|2,0,0]=4 1730 B6R0.3 CCN(C)C(=N)N MCULE-1941465818 [0,2,0,0,0,0|1,0,0]=3 1731 B6R0.3 CCN(C)C(=O)C MCULE-6881823095 [0,2,0,0,0,0|0,0,0]=2 1732 B6R0.3 CCN(C)C(=O)Cl MCULE-3697487267 [0,2,0,0,0,0|0,0,0]=2 1733 B6R0.3 CCN(N)C(=O)N MCULE-8674876262 [0,2,0,0,0,0|1,0,0]=3 1734 B6R0.3 CCN(O)C(=O)C MCULE-8547381969 [0,2,0,0,0,0|1,0,0]=3 1735 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [0,2,0,0,0,0|2,0,0]=4 1736 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [0,2,0,0,0,0|2,0,0]=4 1737 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [0,2,0,0,0,0|1,0,0]=3 1738 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [0,2,0,0,0,0|1,0,0]=3 1739 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [0,2,0,0,0,0|1,0,0]=3 1740 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [0,2,0,0,0,0|1,0,0]=3 1741 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [0,2,0,0,0,0|2,0,0]=4 1742 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [0,2,0,0,0,0|2,0,0]=4 1743 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [0,2,0,0,0,0|2,0,0]=4 1744 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [0,2,0,0,0,0|2,0,0]=4 1745 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [0,2,0,0,0,0|2,0,0]=4 1746 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [0,2,0,0,0,0|2,0,0]=4 1747 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [0,2,0,0,0,0|2,0,0]=4 1748 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [0,2,0,0,0,0|2,0,0]=4 1749 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [0,2,0,0,0,0|2,0,0]=4 1750 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [0,2,0,0,0,0|2,0,0]=4 1751 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [0,2,0,0,0,0|2,0,0]=4 1752 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [0,2,0,0,0,0|2,0,0]=4 1753 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [0,2,0,0,0,0|2,0,0]=4 1754 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [0,2,0,0,0,0|2,0,0]=4 1755 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [0,2,0,0,0,0|1,0,0]=3 1756 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [0,2,0,0,0,0|1,0,0]=3 1757 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [0,2,0,0,0,0|2,0,0]=4 1758 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [0,2,0,0,0,0|2,0,0]=4 1759 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [0,2,0,0,0,0|2,0,0]=4 1760 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [0,2,0,0,0,0|2,0,0]=4 1761 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [0,2,0,0,0,0|2,0,0]=4 1762 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [0,2,0,0,0,0|2,0,0]=4 1763 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [0,2,0,0,0,0|2,0,0]=4 1764 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [0,2,0,0,0,0|2,0,0]=4 1765 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [0,2,0,0,0,0|2,0,0]=4 1766 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [0,2,0,0,0,0|2,0,0]=4 1767 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [0,2,0,0,0,0|2,0,0]=4 1768 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [0,2,0,0,0,0|2,0,0]=4 1769 B6R0.3 CN(C)/C(=N/O)/N MCULE-3547286812 [0,2,0,0,0,0|0,0,1]=3 1770 B6R0.3 CN(C)/C(=N\O)/N MCULE-4834817007 [0,2,0,0,0,0|0,0,1]=3 1771 B6R0.3 CN(C)C(=O)CBr MCULE-8318415267 [0,2,0,0,0,0|0,0,0]=2 1772 B6R0.3 CN(C)C(=O)CCl MCULE-7153641042 [0,2,0,0,0,0|0,0,0]=2 1773 B6R0.3 CN(C)C(=O)CI MCULE-4437173749 [0,2,0,0,0,0|0,0,0]=2 1774 B6R0.3 CN(C)C(=O)CN MCULE-2195526798 [0,2,0,0,0,0|0,0,0]=2 1775 B6R0.3 CN(C)C(=O)CN MCULE-4999236521 [0,2,0,0,0,0|0,0,0]=2 1776 B6R0.3 CN(C)C(=O)CN MCULE-7091962350 [0,2,0,0,0,0|0,0,0]=2 1777 B6R0.3 CN(C)C(=O)CO MCULE-8470749078 [0,2,0,0,0,0|0,0,0]=2 1778 B6R0.3 CN(C)C(=O)CS MCULE-2815493030 [0,2,0,0,0,0|0,0,0]=2 1779 B6R0.3 CN(C)C(=O)NN MCULE-1456206497 [0,2,0,0,0,0|0,0,0]=2 1780 B6R0.3 CN(C)C(=O)NO MCULE-7406409363 [0,2,0,0,0,0|0,0,0]=2 1781 B6R0.3 CN(C)C(=S)NN MCULE-8404262806 [0,2,0,0,0,0|0,1,0]=3 1782 B6R0.3 CN(N)C(=O)NO MCULE-9258932516 [0,2,0,0,0,0|1,0,0]=3 1783 B6R0.3 CN(N=O)C(=O)N MCULE-7683488639 [0,2,0,0,0,0|1,0,0]=3 1784 B6R0.3 CN(O)C(=O)CN MCULE-6904940710 [0,2,0,0,0,0|1,0,0]=3 1785 B6R0.3 CN(O)C(=O)CN MCULE-7352809793 [0,2,0,0,0,0|1,0,0]=3 1786 B6R0.3 CNC(=O)C(=O)O MCULE-5436132271 [0,2,0,0,0,0|2,0,0]=4 1787 B6R0.3 CNC(=O)C(C)Br MCULE-8111267694 [0,2,0,0,0,0|2,0,0]=4 1788 B6R0.3 CNC(=O)C(C)C MCULE-9646758802 [0,2,0,0,0,0|1,0,0]=3 1789 B6R0.3 CNC(=O)C(C)Cl MCULE-6524637023 [0,2,0,0,0,0|2,0,0]=4 1790 B6R0.3 CNC(=O)C(C)N MCULE-2283707986 [0,2,0,0,0,0|2,0,0]=4 1791 B6R0.3 CNC(=O)C(C)N MCULE-2976078375 [0,2,0,0,0,0|2,0,0]=4 1792 B6R0.3 CNC(=O)C(C)N MCULE-5544490576 [0,2,0,0,0,0|2,0,0]=4 1793 B6R0.3 CNC(=O)C(C)N MCULE-8815196909 [0,2,0,0,0,0|2,0,0]=4 1794 B6R0.3 CNC(=O)C(C)O MCULE-4714977257 [0,2,0,0,0,0|2,0,0]=4 1795 B6R0.3 CNC(=O)N(C)C MCULE-3799320827 [0,2,0,0,0,0|0,0,0]=2 1796 B6R0.3 CNC(=O)[C@@H](C)N MCULE-4498032248 [0,2,0,0,0,0|2,0,0]=4 1797 B6R0.3 CNC(=O)[C@@H](C)N MCULE-6909082129 [0,2,0,0,0,0|2,0,0]=4 1798 B6R0.3 CNC(=O)[C@@H](C)N MCULE-7642558844 [0,2,0,0,0,0|2,0,0]=4 1799 B6R0.3 CNC(=O)[C@@H](C)N MCULE-8543898121 [0,2,0,0,0,0|2,0,0]=4 1800 B6R0.3 CNC(=O)[C@@H](C)O MCULE-8955033466 [0,2,0,0,0,0|2,0,0]=4 1801 B6R0.3 CNC(=O)[C@H](C)N MCULE-5297375743 [0,2,0,0,0,0|2,0,0]=4 1802 B6R0.3 CNC(=O)[C@H](C)N MCULE-6807150828 [0,2,0,0,0,0|2,0,0]=4 1803 B6R0.3 CNC(=O)[C@H](C)N MCULE-8365508630 [0,2,0,0,0,0|2,0,0]=4 1804 B6R0.3 CNC(=O)[C@H](C)N MCULE-9773818316 [0,2,0,0,0,0|2,0,0]=4 1805 B6R0.3 CNC(=O)[C@H](C)O MCULE-8015727044 [0,2,0,0,0,0|2,0,0]=4 1806 B6R0.3 CNC(=S)N(C)C MCULE-5004489808 [0,2,0,0,0,0|0,1,0]=3 1807 B6R0.3 CNC(=S)N(C)N MCULE-5065441902 [0,2,0,0,0,0|1,1,0]=4 1808 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [0,2,0,0,0,0|1,0,0]=3 1809 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [0,2,0,0,0,0|1,0,0]=3 1810 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [0,2,0,0,0,0|1,0,0]=3 1811 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [0,2,0,0,0,0|1,0,0]=3 1812 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [0,2,0,0,0,0|1,0,0]=3 1813 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [0,2,0,0,0,0|1,0,0]=3 1814 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [0,2,0,0,0,0|1,0,0]=3 1815 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [0,2,0,0,0,0|1,0,0]=3 1816 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [0,2,0,0,0,0|1,0,0]=3 1817 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [0,2,0,0,0,0|1,0,0]=3 1818 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [0,2,0,0,0,0|1,0,0]=3 1819 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [0,2,0,0,0,0|1,0,0]=3 1820 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [0,2,0,0,0,0|1,0,0]=3 1821 B6R0.3 COC(=N)C(C)C MCULE-2061399513 [0,2,0,0,0,0|1,0,1]=4 1822 B6R0.3 COC(=N)C(C)C MCULE-9270611186 [0,2,0,0,0,0|1,0,1]=4 1823 B6R0.3 COC(=O)C(=O)C MCULE-5423483210 [0,2,0,0,0,0|2,0,0]=4 1824 B6R0.3 COC(=O)C(=O)Cl MCULE-1380456689 [0,2,0,0,0,0|2,0,0]=4 1825 B6R0.3 COC(=O)C(=O)O MCULE-8527842270 [0,2,0,0,0,0|2,0,0]=4 1826 B6R0.3 COC(=O)C(=O)[O-] MCULE-5187907456 [0,2,0,0,0,0|2,0,0]=4 1827 B6R0.3 COC(=O)C(C)Br MCULE-8218697195 [0,2,0,0,0,0|2,0,0]=4 1828 B6R0.3 COC(=O)C(C)C MCULE-8740211817 [0,2,0,0,0,0|1,0,0]=3 1829 B6R0.3 COC(=O)C(C)Cl MCULE-5874523100 [0,2,0,0,0,0|2,0,0]=4 1830 B6R0.3 COC(=O)C(C)Cl MCULE-7725109837 [0,2,0,0,0,0|2,0,0]=4 1831 B6R0.3 COC(=O)C(C)F MCULE-2381396302 [0,2,0,0,0,0|2,0,0]=4 1832 B6R0.3 COC(=O)C(C)N MCULE-6823731158 [0,2,0,0,0,0|2,0,0]=4 1833 B6R0.3 COC(=O)C(C)N MCULE-7003387212 [0,2,0,0,0,0|2,0,0]=4 1834 B6R0.3 COC(=O)C(C)N MCULE-8331503444 [0,2,0,0,0,0|2,0,0]=4 1835 B6R0.3 COC(=O)C(C)N MCULE-8860467123 [0,2,0,0,0,0|2,0,0]=4 1836 B6R0.3 COC(=O)C(C)O MCULE-7040827393 [0,2,0,0,0,0|2,0,0]=4 1837 B6R0.3 COC(=O)C(C)O MCULE-7872489483 [0,2,0,0,0,0|2,0,0]=4 1838 B6R0.3 COC(=O)C(C)S MCULE-8499044680 [0,2,0,0,0,0|2,0,0]=4 1839 B6R0.3 COC(=O)N(C)C MCULE-7772743169 [0,2,0,0,0,0|0,0,0]=2 1840 B6R0.3 COC(=O)N(C)N MCULE-4131925989 [0,2,0,0,0,0|1,0,0]=3 1841 B6R0.3 COC(=O)[C@@H](C)Br MCULE-8118895575 [0,2,0,0,0,0|2,0,0]=4 1842 B6R0.3 COC(=O)[C@@H](C)Cl MCULE-1037727130 [0,2,0,0,0,0|2,0,0]=4 1843 B6R0.3 COC(=O)[C@@H](C)F MCULE-4776326501 [0,2,0,0,0,0|2,0,0]=4 1844 B6R0.3 COC(=O)[C@@H](C)F MCULE-8049982812 [0,2,0,0,0,0|2,0,0]=4 1845 B6R0.3 COC(=O)[C@@H](C)N MCULE-6142127864 [0,2,0,0,0,0|2,0,0]=4 1846 B6R0.3 COC(=O)[C@@H](C)N MCULE-6606835410 [0,2,0,0,0,0|2,0,0]=4 1847 B6R0.3 COC(=O)[C@@H](C)N MCULE-7979979694 [0,2,0,0,0,0|2,0,0]=4 1848 B6R0.3 COC(=O)[C@@H](C)N MCULE-9290287586 [0,2,0,0,0,0|2,0,0]=4 1849 B6R0.3 COC(=O)[C@@H](C)O MCULE-5441095431 [0,2,0,0,0,0|2,0,0]=4 1850 B6R0.3 COC(=O)[C@@H](C)O MCULE-6924152779 [0,2,0,0,0,0|2,0,0]=4 1851 B6R0.3 COC(=O)[C@H](C)Cl MCULE-1009662992 [0,2,0,0,0,0|2,0,0]=4 1852 B6R0.3 COC(=O)[C@H](C)Cl MCULE-7624485295 [0,2,0,0,0,0|2,0,0]=4 1853 B6R0.3 COC(=O)[C@H](C)N MCULE-1665306037 [0,2,0,0,0,0|2,0,0]=4 1854 B6R0.3 COC(=O)[C@H](C)N MCULE-2941352505 [0,2,0,0,0,0|2,0,0]=4 1855 B6R0.3 COC(=O)[C@H](C)N MCULE-5314047552 [0,2,0,0,0,0|2,0,0]=4 1856 B6R0.3 COC(=O)[C@H](C)N MCULE-7930428859 [0,2,0,0,0,0|2,0,0]=4 1857 B6R0.3 COC(=O)[C@H](C)O MCULE-2590929895 [0,2,0,0,0,0|2,0,0]=4 1858 B6R0.3 COC(=O)[C@H](C)O MCULE-3292709954 [0,2,0,0,0,0|2,0,0]=4 1859 B6R0.3 COC(Br)C(=O)C MCULE-1220922171 [0,2,0,0,0,0|2,0,0]=4 1860 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [0,2,0,0,0,0|2,0,0]=4 1861 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [0,2,0,0,0,0|1,0,0]=3 1862 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [0,2,0,0,0,0|1,0,0]=3 1863 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [0,2,0,0,0,0|1,0,0]=3 1864 B6R0.3 COC(C)C(=S)N MCULE-6827196665 [0,2,0,0,0,0|1,1,0]=4 1865 B6R0.3 CON(C)C(=O)C MCULE-8559238750 [0,2,0,0,0,0|0,0,0]=2 1866 B6R0.3 CON(C)C(=O)Cl MCULE-7217619495 [0,2,0,0,0,0|0,0,0]=2 1867 B6R0.3 CO[C@@H](C)C(=O)Cl MCULE-9335923061 [0,2,0,0,0,0|1,0,0]=3 1868 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [0,2,0,0,0,0|1,0,0]=3 1869 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [0,2,0,0,0,0|1,0,0]=3 1870 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [0,2,0,0,0,0|1,0,0]=3 1871 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [0,2,0,0,0,0|1,0,0]=3 1872 B6R0.3 CSC(=O)C(C)C MCULE-3533547228 [0,2,0,0,0,0|1,0,0]=3 1873 B6R0.3 CSC(=S)N(C)C MCULE-5137103210 [0,2,0,0,0,0|0,1,0]=3 1874 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [0,2,0,0,0,0|1,0,0]=3 1875 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [0,2,0,0,0,0|1,0,0]=3 1876 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [0,2,0,0,0,0|1,0,0]=3 1877 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [0,2,0,0,0,0|1,0,0]=3 1878 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [0,2,0,0,0,0|1,0,0]=3 1879 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [0,2,0,0,0,0|1,0,0]=3 1880 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [0,2,0,0,0,0|1,0,0]=3 1881 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [0,2,0,0,0,0|1,0,0]=3 1882 B6R0.3 C[C@@H](CO)N(C)C MCULE-4388248602 [0,2,0,0,0,0|0,0,2]=4 1883 B6R0.3 C[C@@H](CS)N(C)C MCULE-7111398165 [0,2,0,0,0,0|0,1,1]=4 1884 B6R0.3 C[C@@H](ON)C(=O)O MCULE-1538722507 [0,2,0,0,0,0|2,0,0]=4 1885 B6R0.3 C[C@@H](ON)C(=O)O MCULE-3835402446 [0,2,0,0,0,0|2,0,0]=4 1886 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [0,2,0,0,0,0|1,0,0]=3 1887 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [0,2,0,0,0,0|1,0,0]=3 1888 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [0,2,0,0,0,0|1,0,0]=3 1889 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [0,2,0,0,0,0|1,0,0]=3 1890 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [0,2,0,0,0,0|1,0,0]=3 1891 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [0,2,0,0,0,0|1,0,0]=3 1892 B6R0.3 C[C@H](CO)C(=O)[O-] MCULE-5733737039 [0,2,0,0,0,0|1,0,0]=3 1893 B6R0.3 C[C@H](N)C(=O)CCl MCULE-1387458909 [0,2,0,0,0,0|2,0,0]=4 1894 B6R0.3 C[C@H](N)C(=O)CCl MCULE-3307546885 [0,2,0,0,0,0|2,0,0]=4 1895 B6R0.3 C[C@H](ON)C(=O)O MCULE-3327889540 [0,2,0,0,0,0|2,0,0]=4 1896 B6R0.3 C[C@H](ON)C(=O)O MCULE-4523264650 [0,2,0,0,0,0|2,0,0]=4 1897 B6R0.3 NC(=O)C(Br)CBr MCULE-3438242131 [0,2,0,0,0,0|2,0,0]=4 1898 B6R0.3 NC(=O)C(Cl)CCl MCULE-9549750186 [0,2,0,0,0,0|2,0,0]=4 1899 B6R0.3 NC(=O)C(N)CO MCULE-4842751232 [0,2,0,0,0,0|2,0,0]=4 1900 B6R0.3 NC(=O)C(N)CO MCULE-6854366147 [0,2,0,0,0,0|2,0,0]=4 1901 B6R0.3 NC(=O)C(N)CS MCULE-3144051628 [0,2,0,0,0,0|2,0,0]=4 1902 B6R0.3 NC(=O)C(N)CS MCULE-7739536595 [0,2,0,0,0,0|2,0,0]=4 1903 B6R0.3 NC(=O)[C@@H](N)CO MCULE-2185844038 [0,2,0,0,0,0|2,0,0]=4 1904 B6R0.3 NC(=O)[C@@H](N)CO MCULE-3623516041 [0,2,0,0,0,0|2,0,0]=4 1905 B6R0.3 NC(=O)[C@@H](N)CO MCULE-6218638108 [0,2,0,0,0,0|2,0,0]=4 1906 B6R0.3 NC(=O)[C@@H](N)CS MCULE-9790378691 [0,2,0,0,0,0|2,0,0]=4 1907 B6R0.3 NC(=O)[C@H](N)CO MCULE-2061645482 [0,2,0,0,0,0|2,0,0]=4 1908 B6R0.3 NC(=O)[C@H](N)CO MCULE-5920366137 [0,2,0,0,0,0|2,0,0]=4 1909 B6R0.3 NC(=O)[C@H](N)CO MCULE-7612340519 [0,2,0,0,0,0|2,0,0]=4 1910 B6R0.3 NC(=O)[C@H](N)CO MCULE-7734326153 [0,2,0,0,0,0|2,0,0]=4 1911 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [0,2,0,0,0,0|2,0,0]=4 1912 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [0,2,0,0,0,0|2,0,0]=4 1913 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [0,2,0,0,0,0|2,0,0]=4 1914 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [0,2,0,0,0,0|2,0,0]=4 1915 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [0,2,0,0,0,0|2,0,0]=4 1916 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [0,2,0,0,0,0|2,0,0]=4 1917 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [0,2,0,0,0,0|2,0,0]=4 1918 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [0,2,0,0,0,0|2,0,0]=4 1919 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [0,2,0,0,0,0|2,0,0]=4 1920 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [0,2,0,0,0,0|2,0,0]=4 1921 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [0,2,0,0,0,0|2,0,0]=4 1922 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [0,2,0,0,0,0|2,0,0]=4 1923 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [0,2,0,0,0,0|2,0,0]=4 1924 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [0,2,0,0,0,0|2,0,0]=4 1925 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [0,2,0,0,0,0|2,0,0]=4 1926 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [0,2,0,0,0,0|2,0,0]=4 1927 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [0,2,0,0,0,0|2,0,0]=4 1928 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [0,2,0,0,0,0|2,0,0]=4 1929 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [0,2,0,0,0,0|2,0,0]=4 1930 B6R0.3 NCC(O)C(=O)N MCULE-1543465850 [0,2,0,0,0,0|2,0,0]=4 1931 B6R0.3 NCC(O)C(=O)N MCULE-9574499203 [0,2,0,0,0,0|2,0,0]=4 1932 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [0,2,0,0,0,0|2,0,0]=4 1933 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [0,2,0,0,0,0|2,0,0]=4 1934 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [0,2,0,0,0,0|2,0,0]=4 1935 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [0,2,0,0,0,0|2,0,0]=4 1936 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [0,2,0,0,0,0|2,0,0]=4 1937 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [0,2,0,0,0,0|2,0,0]=4 1938 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [0,2,0,0,0,0|2,0,0]=4 1939 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [0,2,0,0,0,0|2,0,0]=4 1940 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [0,2,0,0,0,0|2,0,0]=4 1941 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [0,2,0,0,0,0|2,0,0]=4 1942 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [0,2,0,0,0,0|2,0,0]=4 1943 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [0,2,0,0,0,0|2,0,0]=4 1944 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [0,2,0,0,0,0|2,0,0]=4 1945 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [0,2,0,0,0,0|2,0,0]=4 1946 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [0,2,0,0,0,0|2,0,0]=4 1947 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [0,2,0,0,0,0|2,0,0]=4 1948 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [0,2,0,0,0,0|2,0,0]=4 1949 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [0,2,0,0,0,0|2,0,0]=4 1950 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [0,2,0,0,0,0|2,0,0]=4 1951 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [0,2,0,0,0,0|2,0,0]=4 1952 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [0,2,0,0,0,0|2,0,0]=4 1953 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [0,2,0,0,0,0|2,0,0]=4 1954 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [0,2,0,0,0,0|2,0,0]=4 1955 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [0,2,0,0,0,0|2,0,0]=4 1956 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [0,2,0,0,0,0|2,0,0]=4 1957 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [0,2,0,0,0,0|2,0,0]=4 1958 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [0,2,0,0,0,0|2,0,0]=4 1959 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [0,2,0,0,0,0|2,0,0]=4 1960 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [0,2,0,0,0,0|2,0,0]=4 1961 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [0,2,0,0,0,0|2,0,0]=4 1962 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [0,2,0,0,0,0|2,0,0]=4 1963 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [0,2,0,0,0,0|2,0,0]=4 1964 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [0,2,0,0,0,0|2,0,0]=4 1965 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [0,2,0,0,0,0|2,0,0]=4 1966 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [0,2,0,0,0,0|2,0,0]=4 1967 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [0,2,0,0,0,0|2,0,0]=4 1968 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [0,2,0,0,0,0|2,0,0]=4 1969 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [0,2,0,0,0,0|2,0,0]=4 1970 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [0,2,0,0,0,0|2,0,0]=4 1971 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [0,2,0,0,0,0|2,0,0]=4 1972 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [0,2,0,0,0,0|2,0,0]=4 1973 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [0,2,0,0,0,0|2,0,0]=4 1974 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [0,2,0,0,0,0|2,0,0]=4 1975 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [0,2,0,0,0,0|2,0,0]=4 1976 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [0,2,0,0,0,0|2,0,0]=4 1977 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [0,2,0,0,0,0|2,0,0]=4 1978 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [0,2,0,0,0,0|2,0,0]=4 1979 B6R0.3 O=C(Cl)C(=O)CBr MCULE-1637788630 [0,2,0,0,0,0|2,0,0]=4 1980 B6R0.3 O=C(Cl)C(Br)CBr MCULE-8490174834 [0,2,0,0,0,0|2,0,0]=4 1981 B6R0.3 O=C(Cl)C(Cl)CCl MCULE-5571003994 [0,2,0,0,0,0|2,0,0]=4 1982 B6R0.3 O=C(O)C(=O)CBr MCULE-4768170572 [0,2,0,0,0,0|2,0,0]=4 1983 B6R0.3 O=C(O)C(=O)CCl MCULE-7853426045 [0,2,0,0,0,0|2,0,0]=4 1984 B6R0.3 O=C(O)C(=O)CF MCULE-5884987827 [0,2,0,0,0,0|2,0,0]=4 1985 B6R0.3 O=C(O)C(=O)CO MCULE-2263002631 [0,2,0,0,0,0|2,0,0]=4 1986 B6R0.3 O=C(O)C(=O)CS MCULE-7466669113 [0,2,0,0,0,0|2,0,0]=4 1987 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [0,2,0,0,0,0|2,0,0]=4 1988 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [0,2,0,0,0,0|2,0,0]=4 1989 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [0,2,0,0,0,0|2,0,0]=4 1990 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [0,2,0,0,0,0|2,0,0]=4 1991 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [0,2,0,0,0,0|2,0,0]=4 1992 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [0,2,0,0,0,0|2,0,0]=4 1993 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [0,2,0,0,0,0|2,0,0]=4 1994 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [0,2,0,0,0,0|2,0,0]=4 1995 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [0,2,0,0,0,0|2,0,0]=4 1996 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [0,2,0,0,0,0|2,0,0]=4 1997 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [0,2,0,0,0,0|2,0,0]=4 1998 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [0,2,0,0,0,0|2,0,0]=4 1999 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [0,2,0,0,0,0|2,0,0]=4 2000 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [0,2,0,0,0,0|2,0,0]=4 2001 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [0,2,0,0,0,0|2,0,0]=4 2002 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [0,2,0,0,0,0|2,0,0]=4 2003 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [0,2,0,0,0,0|2,0,0]=4 2004 B6R0.3 O=C([O-])C(=O)CF MCULE-9109967389 [0,2,0,0,0,0|2,0,0]=4 2005 B6R0.3 O=C([O-])C(=O)CS MCULE-4375165973 [0,2,0,0,0,0|2,0,0]=4 2006 B6R0.3 O=C([O-])[C@@H](O)CO MCULE-4498291090 [0,2,0,0,0,0|2,0,0]=4 2007 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [0,2,0,0,0,0|2,0,0]=4 2008 B6R0.3 [C@H](C)(Cl)C(=O)OC MCULE-7212330759 [0,2,0,0,0,0|2,0,0]=4 2009 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [0,2,0,0,0,0|1,0,0]=3 2010 B6R0.3 [C@H](N)(CO)C(=O)N MCULE-2792784400 [0,2,0,0,0,0|2,0,0]=4 2011 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [0,2,0,0,0,0|2,0,0]=4 2012 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [0,2,0,0,0,0|2,0,0]=4 2013 B6R0.4 C#CC=CC(C)C MCULE-6714802798 [0,2,0,0,0,0|2,0,0]=4 2014 B6R0.4 C#CCCN(C)C MCULE-9558095172 [0,2,0,0,0,0|1,0,1]=4 2015 B6R0.4 C=CCCC(C)C MCULE-7128249655 [0,2,0,0,0,0|2,0,0]=4 2016 B6R0.4 C=CCNC(C)C MCULE-1450045891 [0,2,0,0,0,0|2,0,0]=4 2017 B6R0.4 C=CCNC(C)C MCULE-3261189096 [0,2,0,0,0,0|2,0,0]=4 2018 B6R0.4 C=CCNC(C)C MCULE-4894255968 [0,2,0,0,0,0|2,0,0]=4 2019 B6R0.4 C=COCC(C)C MCULE-7268141053 [0,2,0,0,0,0|2,0,0]=4 2020 B6R0.4 C=CON=C(C)C MCULE-5340817509 [0,2,0,0,0,0|2,0,0]=4 2021 B6R0.4 CC(=CCC#N)C MCULE-1406666578 [0,2,0,0,0,0|2,0,0]=4 2022 B6R0.4 CC(=CCCBr)C MCULE-9403575147 [0,2,0,0,0,0|2,0,0]=4 2023 B6R0.4 CC(=CCCN)C MCULE-9185531904 [0,2,0,0,0,0|2,0,0]=4 2024 B6R0.4 CC(=CCCO)C MCULE-2493404466 [0,2,0,0,0,0|1,0,1]=4 2025 B6R0.4 CC(=CCCO)C MCULE-8497528596 [0,2,0,0,0,0|1,0,1]=4 2026 B6R0.4 CC(=NNC=O)C MCULE-6194074981 [0,2,0,0,0,0|1,0,0]=3 2027 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [0,2,0,0,0,0|2,0,0]=4 2028 B6R0.4 CC(C)C=CC=O MCULE-5034551905 [0,2,0,0,0,0|1,0,0]=3 2029 B6R0.4 CC(C)C=CCBr MCULE-9812152361 [0,2,0,0,0,0|2,0,0]=4 2030 B6R0.4 CC(C)CCC=O MCULE-9664145623 [0,2,0,0,0,0|1,0,0]=3 2031 B6R0.4 CC(C)CN=C=O MCULE-3174970377 [0,2,0,0,0,0|1,0,1]=4 2032 B6R0.4 CC(C)CNC=O MCULE-2156996206 [0,2,0,0,0,0|1,0,0]=3 2033 B6R0.4 CC(C)COC=O MCULE-8234906771 [0,2,0,0,0,0|1,0,0]=3 2034 B6R0.4 CC(C)CON=O MCULE-8394966903 [0,2,0,0,0,0|1,0,1]=4 2035 B6R0.4 CC(C)OCC=O MCULE-5974054323 [0,2,0,0,0,0|1,0,0]=3 2036 B6R0.4 CC(C)SCC=O MCULE-3174965592 [0,2,0,0,0,0|1,0,0]=3 2037 B6R0.4 CC=CCC(C)C MCULE-7145682250 [0,2,0,0,0,0|2,0,0]=4 2038 B6R0.4 CCCC=C(C)C MCULE-2110588796 [0,2,0,0,0,0|2,0,0]=4 2039 B6R0.4 CCCCN(C)C MCULE-7202077639 [0,2,0,0,0,0|1,0,1]=4 2040 B6R0.4 CCN=CC(C)C MCULE-7306741362 [0,2,0,0,0,0|2,0,0]=4 2041 B6R0.4 CN(C)/C=C/C#N MCULE-6362841128 [0,2,0,0,0,0|1,0,0]=3 2042 B6R0.4 CN(C)/C=C/C=O MCULE-2048385164 [0,2,0,0,0,0|0,0,0]=2 2043 B6R0.4 CN(C)C=CC#N MCULE-7232815292 [0,2,0,0,0,0|1,0,0]=3 2044 B6R0.4 CN(C)C=CC=O MCULE-3308636651 [0,2,0,0,0,0|0,0,0]=2 2045 B6R0.4 CN(C)CCC#N MCULE-8979604677 [0,2,0,0,0,0|1,0,1]=4 2046 B6R0.4 CN(C)CCC=O MCULE-6830649526 [0,2,0,0,0,0|0,0,0]=2 2047 B6R0.4 CN(C)CCCBr MCULE-2862944726 [0,2,0,0,0,0|1,0,1]=4 2048 B6R0.4 CN(C)CCCBr MCULE-4596026048 [0,2,0,0,0,0|1,0,1]=4 2049 B6R0.4 CN(C)CCCBr MCULE-7515880350 [0,2,0,0,0,0|1,0,1]=4 2050 B6R0.4 CN(C)CCCCl MCULE-1347366200 [0,2,0,0,0,0|1,0,1]=4 2051 B6R0.4 CN(C)CCCCl MCULE-3767329555 [0,2,0,0,0,0|1,0,1]=4 2052 B6R0.4 CN(C)CCCI MCULE-2134226049 [0,2,0,0,0,0|1,0,1]=4 2053 B6R0.4 CN(C)CCCI MCULE-2999516061 [0,2,0,0,0,0|1,0,1]=4 2054 B6R0.4 CN(C)CCCN MCULE-3882436382 [0,2,0,0,0,0|1,0,1]=4 2055 B6R0.4 CN(C)CCCN MCULE-4415270662 [0,2,0,0,0,0|1,0,1]=4 2056 B6R0.4 CN(C)CCCN MCULE-4624916051 [0,2,0,0,0,0|1,0,1]=4 2057 B6R0.4 CN(C)CCCN MCULE-4749435878 [0,2,0,0,0,0|1,0,1]=4 2058 B6R0.4 CN(C)CCCN MCULE-9301668058 [0,2,0,0,0,0|1,0,1]=4 2059 B6R0.4 CN(C)CCCO MCULE-7408728427 [0,2,0,0,0,0|0,0,2]=4 2060 B6R0.4 CN(C)CCCS MCULE-7945161812 [0,2,0,0,0,0|0,1,1]=4 2061 B6R0.4 CN(C)CCNN MCULE-5321668174 [0,2,0,0,0,0|1,0,1]=4 2062 B6R0.4 CN(C)CCNN MCULE-6578987911 [0,2,0,0,0,0|1,0,1]=4 2063 B6R0.4 CN(C)CCON MCULE-1981169712 [0,2,0,0,0,0|0,0,2]=4 2064 B6R0.4 CN(C)CCON MCULE-6706970282 [0,2,0,0,0,0|0,0,2]=4 2065 B6R0.4 CN(C)NCCCl MCULE-2462354397 [0,2,0,0,0,0|1,0,1]=4 2066 B6R0.4 CN(C)NCCCl MCULE-7933853049 [0,2,0,0,0,0|1,0,1]=4 2067 B6R0.4 CNCCN(C)C MCULE-3324857553 [0,2,0,0,0,0|1,0,1]=4 2068 B6R0.4 CNCCN(C)C MCULE-8014008412 [0,2,0,0,0,0|1,0,1]=4 2069 B6R0.4 CNCCN(C)C MCULE-9954339750 [0,2,0,0,0,0|1,0,1]=4 2070 B6R0.4 COCCN(C)C MCULE-5323166567 [0,2,0,0,0,0|0,0,2]=4 2071 B6R0.4 CON=CC(C)C MCULE-1606683545 [0,2,0,0,0,0|1,0,1]=4 2072 B6R0.4 CSCCN(C)C MCULE-2148124964 [0,2,0,0,0,0|0,1,1]=4 2073 B6R0.4 CSCCN(C)C MCULE-5176242697 [0,2,0,0,0,0|0,1,1]=4 2074 B6R0.5 C/C=N/C(C)(C)C MCULE-5626139763 [0,2,0,0,0,0|2,0,0]=4 2075 B6R0.5 C=CCC(C)(C)C MCULE-1992751113 [0,2,0,0,0,0|2,0,0]=4 2076 B6R0.5 C=CCC(C)(C)N MCULE-5186161263 [0,2,0,0,0,0|2,0,0]=4 2077 B6R0.5 C=CCC(C)(C)N MCULE-6288336754 [0,2,0,0,0,0|2,0,0]=4 2078 B6R0.5 C=CCC(C)(C)O MCULE-3560651758 [0,2,0,0,0,0|2,0,0]=4 2079 B6R0.5 C=CC[N+](C)(C)C MCULE-5418366165 [0,2,0,0,0,0|1,0,1]=4 2080 B6R0.5 C=CC[N+](C)(C)C MCULE-8037238801 [0,2,0,0,0,0|1,0,1]=4 2081 B6R0.5 C=CC[Si](C)(C)C MCULE-5031938571 [0,2,0,0,0,0|2,0,0]=4 2082 B6R0.5 C=CC[Si](C)(C)Cl MCULE-1810628320 [0,2,0,0,0,0|2,0,0]=4 2083 B6R0.5 C=CC[Sn](C)(C)C MCULE-7062318521 [0,2,0,0,0,0|2,0,0]=4 2084 B6R0.5 C=COC(C)(C)C MCULE-5049432761 [0,2,0,0,0,0|2,0,0]=4 2085 B6R0.5 C=CO[Si](C)(C)C MCULE-8953873865 [0,2,0,0,0,0|2,0,0]=4 2086 B6R0.5 CC(C)(C)/C=N/O MCULE-3498128731 [0,2,0,0,0,0|1,0,1]=4 2087 B6R0.5 CC(C)(C)C=NO MCULE-5715890481 [0,2,0,0,0,0|1,0,1]=4 2088 B6R0.5 CC(C)(C)CC=O MCULE-6726853595 [0,2,0,0,0,0|1,0,0]=3 2089 B6R0.5 CC(C)(C)N=C=O MCULE-5607363135 [0,2,0,0,0,0|1,0,1]=4 2090 B6R0.5 CC(C)(C)NC=O MCULE-4474324800 [0,2,0,0,0,0|1,0,0]=3 2091 B6R0.5 CC(C)(C)OC=O MCULE-3317941666 [0,2,0,0,0,0|1,0,0]=3 2092 B6R0.5 CC(C)(C)ON=O MCULE-6314034226 [0,2,0,0,0,0|2,0,0]=4 2093 B6R0.5 CC=NC(C)(C)C MCULE-2642166720 [0,2,0,0,0,0|2,0,0]=4 2094 B6R0.5 C[N+](C)(C)CC=O MCULE-1973623516 [0,2,0,0,0,0|0,0,1]=3 2095 B6R0.5 C[N+](C)(C)CC=O MCULE-6964542865 [0,2,0,0,0,0|0,0,1]=3 2096 B6R0.5 C[Si](C)(C)/C=C/Br MCULE-9830897857 [0,2,0,0,0,0|2,0,0]=4 2097 B6R0.5 C[Si](C)(C)/C=C/I MCULE-3087366011 [0,2,0,0,0,0|2,0,0]=4 2098 B6R0.5 C[Si](C)(C)C=CBr MCULE-7908301119 [0,2,0,0,0,0|2,0,0]=4 2099 B6R0.5 C[Si](C)(C)C=CI MCULE-2274079570 [0,2,0,0,0,0|2,0,0]=4 2100 B6R0.5 C[Si](C)(C)N=C=O MCULE-9034058788 [0,2,0,0,0,0|1,0,1]=4 2101 B6R0.8 C=CC(C)(C)CN MCULE-8097307618 [0,2,0,0,0,0|2,0,0]=4 2102 B6R0.8 C=CC(C)(C)CO MCULE-8447675743 [0,2,0,0,0,0|2,0,0]=4 2103 B6R0.8 C=CC(C)(O)CBr MCULE-8151064620 [0,2,0,0,0,0|2,0,0]=4 2104 B6R0.8 C=CC(C)(O)CC MCULE-7004958709 [0,2,0,0,0,0|2,0,0]=4 2105 B6R0.8 C=CC(C)(O)CN MCULE-2921164232 [0,2,0,0,0,0|2,0,0]=4 2106 B6R0.8 C=C[Si](C)(C)C=C MCULE-9536837452 [0,2,0,0,0,0|2,0,0]=4 2107 B6R0.8 C=C[Si](C)(C)CCl MCULE-1738689023 [0,2,0,0,0,0|2,0,0]=4 2108 B6R0.8 C=C[Si](C)(C)OC MCULE-2954087667 [0,2,0,0,0,0|2,0,0]=4 2109 B6R0.8 CC(C)(C=O)CCl MCULE-4459822361 [0,2,0,0,0,0|1,0,0]=3 2110 B6R0.8 CC(C)(C=O)CF MCULE-7136604991 [0,2,0,0,0,0|1,0,0]=3 2111 B6R0.8 CC(C)(C=O)CI MCULE-4319040609 [0,2,0,0,0,0|1,0,0]=3 2112 B6R0.8 CC(C)(C=O)CO MCULE-9744921245 [0,2,0,0,0,0|1,0,0]=3 2113 B6R0.8 CCC(Br)(Br)C=O MCULE-5893364801 [0,2,0,0,0,0|2,0,0]=4 2114 B6R0.8 CCC(C)(C)C=O MCULE-4902007320 [0,2,0,0,0,0|1,0,0]=3 2115 B6R0.8 CSC(C)(C)C=O MCULE-7777472638 [0,2,0,0,0,0|1,0,0]=3 2116 B6R0.8 O=CC(Br)(Br)CBr MCULE-3050482544 [0,2,0,0,0,0|2,0,0]=4 2117 B6R0.9 C/C=C(/C=O)\CC MCULE-4811305564 [0,2,0,0,0,0|1,0,0]=3 2118 B6R0.9 C=CC(CCl)OC MCULE-7435605398 [0,2,0,0,0,0|2,0,0]=4 2119 B6R0.9 C=CC(OC)OC MCULE-7212819947 [0,2,0,0,0,0|2,0,0]=4 2120 B6R0.9 CC=C(C=O)CC MCULE-3354209980 [0,2,0,0,0,0|1,0,0]=3 2121 B6R0.9 CC=C(CC)CC MCULE-5609717261 [0,2,0,0,0,0|2,0,0]=4 2122 B6R0.9 CCC(=CO)CC MCULE-4973169590 [0,2,0,0,0,0|1,0,1]=4 2123 B6R0.9 CCC(=CO)CC MCULE-8459100577 [0,2,0,0,0,0|1,0,1]=4 2124 B6R0.9 CCC(C=O)CC MCULE-3529464122 [0,2,0,0,0,0|1,0,0]=3 2125 B6R0.9 CCN(C#N)CC MCULE-5340167535 [0,2,0,0,0,0|1,0,1]=4 2126 B6R0.9 CCN(C=O)CC MCULE-9053231156 [0,2,0,0,0,0|0,0,0]=2 2127 B6R0.9 CCN(CC)CC MCULE-1748959240 [0,2,0,0,0,0|1,0,1]=4 2128 B6R0.9 CCN(CC)CC MCULE-6692975244 [0,2,0,0,0,0|1,0,1]=4 2129 B6R0.9 CCN(CC)CC MCULE-8404374147 [0,2,0,0,0,0|1,0,1]=4 2130 B6R0.9 CCN(CC)CO MCULE-9782453115 [0,2,0,0,0,0|0,0,2]=4 2131 B6R0.9 CCN(CC)N=O MCULE-8931177297 [0,2,0,0,0,0|1,0,0]=3 2132 B6R0.9 COC(C=O)OC MCULE-7354932286 [0,2,0,0,0,0|1,0,0]=3 2133 B6R0.7 C=C(Br)C(C)(C)C MCULE-2463544596 [0,2,0,0,0,0|2,0,0]=4 2134 B6R0.7 C=C(Br)[Si](C)(C)C MCULE-6870311251 [0,2,0,0,0,0|2,0,0]=4 2135 B6R0.7 C=C(C)C(C)(C)C MCULE-9196090881 [0,2,0,0,0,0|2,0,0]=4 2136 B6R0.7 C=C(C)[Si](C)(C)C MCULE-9711658447 [0,2,0,0,0,0|2,0,0]=4 2137 B6R0.7 C=C(Cl)[Si](C)(C)C MCULE-4611349231 [0,2,0,0,0,0|2,0,0]=4 2138 B6R0.7 CC(=O)C(C)(C)Br MCULE-2211649171 [0,2,0,0,0,0|1,0,0]=3 2139 B6R0.7 CC(=O)C(C)(C)C MCULE-9731323161 [0,2,0,0,0,0|1,0,0]=3 2140 B6R0.7 CC(=O)C(C)(C)Cl MCULE-3074145802 [0,2,0,0,0,0|1,0,0]=3 2141 B6R0.7 CC(=O)C(C)(C)N MCULE-8236547032 [0,2,0,0,0,0|1,0,0]=3 2142 B6R0.7 CC(=O)C(C)(C)N MCULE-9736681939 [0,2,0,0,0,0|1,0,0]=3 2143 B6R0.7 CC(=O)C(C)(C)O MCULE-1535627387 [0,2,0,0,0,0|1,0,0]=3 2144 B6R0.7 CC(=O)C(C)(F)F MCULE-7856452896 [0,2,0,0,0,0|2,0,0]=4 2145 B6R0.7 CC(=O)[Si](C)(C)C MCULE-2207276552 [0,2,0,0,0,0|1,0,0]=3 2146 B6R0.7 CC(Br)(Br)C(=O)O MCULE-1654765678 [0,2,0,0,0,0|2,0,0]=4 2147 B6R0.7 CC(C)(Br)C(=O)Br MCULE-3927664220 [0,2,0,0,0,0|1,0,0]=3 2148 B6R0.7 CC(C)(Br)C(=O)Cl MCULE-4186209269 [0,2,0,0,0,0|1,0,0]=3 2149 B6R0.7 CC(C)(Br)C(=O)N MCULE-9238574572 [0,2,0,0,0,0|1,0,0]=3 2150 B6R0.7 CC(C)(Br)C(=O)O MCULE-9443967216 [0,2,0,0,0,0|1,0,0]=3 2151 B6R0.7 CC(C)(Br)N(=O)=O MCULE-3797855170 [0,2,0,0,0,0|2,0,0]=4 2152 B6R0.7 CC(C)(C)C(=N)N MCULE-7680688413 [0,2,0,0,0,0|2,0,0]=4 2153 B6R0.7 CC(C)(C)C(=N)N MCULE-8879048174 [0,2,0,0,0,0|2,0,0]=4 2154 B6R0.7 CC(C)(C)C(=O)Cl MCULE-2528821101 [0,2,0,0,0,0|1,0,0]=3 2155 B6R0.7 CC(C)(C)C(=O)N MCULE-1267347906 [0,2,0,0,0,0|1,0,0]=3 2156 B6R0.7 CC(C)(C)C(=O)O MCULE-7166067227 [0,2,0,0,0,0|1,0,0]=3 2157 B6R0.7 CC(C)(C)C(=O)[O-] MCULE-3836080044 [0,2,0,0,0,0|1,0,0]=3 2158 B6R0.7 CC(C)(C)C(=O)[O-] MCULE-4231941340 [0,2,0,0,0,0|1,0,0]=3 2159 B6R0.7 CC(C)(C)C(=S)N MCULE-3063566984 [0,2,0,0,0,0|1,1,0]=4 2160 B6R0.7 CC(C)(C)N(=O)=O MCULE-5389027053 [0,2,0,0,0,0|2,0,0]=4 2161 B6R0.7 CC(C)(C)S(=O)Cl MCULE-2395244349 [0,2,0,0,0,0|2,0,0]=4 2162 B6R0.7 CC(C)(C)S(=O)N MCULE-4119217508 [0,2,0,0,0,0|2,0,0]=4 2163 B6R0.7 CC(C)(C)S(=O)N MCULE-8120769030 [0,2,0,0,0,0|2,0,0]=4 2164 B6R0.7 CC(C)(C)S(=O)O MCULE-4329334255 [0,2,0,0,0,0|2,0,0]=4 2165 B6R0.7 CC(C)(C)S(=O)[O-] MCULE-9734265000 [0,2,0,0,0,0|2,0,0]=4 2166 B6R0.7 CC(C)(C)[S@@](=O)N MCULE-7239306561 [0,2,0,0,0,0|2,0,0]=4 2167 B6R0.7 CC(C)(C)[S@@](=O)N MCULE-8191878313 [0,2,0,0,0,0|2,0,0]=4 2168 B6R0.7 CC(C)(C)[S@](=O)N MCULE-1205816977 [0,2,0,0,0,0|2,0,0]=4 2169 B6R0.7 CC(C)(C)[S@](=O)N MCULE-6974247624 [0,2,0,0,0,0|2,0,0]=4 2170 B6R0.7 CC(C)(Cl)C(=O)Cl MCULE-1923898716 [0,2,0,0,0,0|1,0,0]=3 2171 B6R0.7 CC(C)(Cl)C(=O)O MCULE-4744644193 [0,2,0,0,0,0|1,0,0]=3 2172 B6R0.7 CC(C)(Cl)N(=O)=O MCULE-9123451241 [0,2,0,0,0,0|2,0,0]=4 2173 B6R0.7 CC(C)(F)C(=O)Cl MCULE-5874577670 [0,2,0,0,0,0|1,0,0]=3 2174 B6R0.7 CC(C)(F)C(=O)N MCULE-7528431736 [0,2,0,0,0,0|1,0,0]=3 2175 B6R0.7 CC(C)(F)C(=O)O MCULE-9323110637 [0,2,0,0,0,0|1,0,0]=3 2176 B6R0.7 CC(C)(N)C(=N)N MCULE-2891169783 [0,2,0,0,0,0|2,0,0]=4 2177 B6R0.7 CC(C)(N)C(=O)Cl MCULE-1303488979 [0,2,0,0,0,0|1,0,0]=3 2178 B6R0.7 CC(C)(N)C(=O)N MCULE-4893991321 [0,2,0,0,0,0|1,0,0]=3 2179 B6R0.7 CC(C)(N)C(=O)N MCULE-7819904882 [0,2,0,0,0,0|1,0,0]=3 2180 B6R0.7 CC(C)(N)C(=O)O MCULE-4254251799 [0,2,0,0,0,0|1,0,0]=3 2181 B6R0.7 CC(C)(N)C(=O)O MCULE-6175880842 [0,2,0,0,0,0|1,0,0]=3 2182 B6R0.7 CC(C)(O)C(=N)N MCULE-4499579707 [0,2,0,0,0,0|2,0,0]=4 2183 B6R0.7 CC(C)(O)C(=N)N MCULE-5382519131 [0,2,0,0,0,0|2,0,0]=4 2184 B6R0.7 CC(C)(O)C(=O)N MCULE-9151369011 [0,2,0,0,0,0|1,0,0]=3 2185 B6R0.7 CC(C)(O)C(=O)O MCULE-4093617756 [0,2,0,0,0,0|1,0,0]=3 2186 B6R0.7 CC(C)(S)C(=O)O MCULE-1863706684 [0,2,0,0,0,0|1,0,0]=3 2187 B6R0.7 CC(C)P(=O)(O)O MCULE-4572861400 [0,2,0,0,0,0|2,0,0]=4 2188 B6R0.7 CC(C)S(=N)(=O)C MCULE-6389709038 [0,2,0,0,0,0|2,0,0]=4 2189 B6R0.7 CC(C)S(=O)(=O)C MCULE-1630518669 [0,2,0,0,0,0|2,0,0]=4 2190 B6R0.7 CC(C)S(=O)(=O)Cl MCULE-9385900902 [0,2,0,0,0,0|2,0,0]=4 2191 B6R0.7 CC(C)S(=O)(=O)F MCULE-8621287493 [0,2,0,0,0,0|2,0,0]=4 2192 B6R0.7 CC(C)S(=O)(=O)N MCULE-7940692200 [0,2,0,0,0,0|2,0,0]=4 2193 B6R0.7 CC(C)S(=O)(=O)O MCULE-2568394676 [0,2,0,0,0,0|2,0,0]=4 2194 B6R0.7 CC(C)S(=O)(=O)[O-] MCULE-1225706200 [0,2,0,0,0,0|2,0,0]=4 2195 B6R0.7 CC(Cl)(Cl)C(=O)Cl MCULE-8935732005 [0,2,0,0,0,0|2,0,0]=4 2196 B6R0.7 CC(Cl)(Cl)C(=O)O MCULE-8201912740 [0,2,0,0,0,0|2,0,0]=4 2197 B6R0.7 CC(Cl)(Cl)C(=O)[O-] MCULE-7677513008 [0,2,0,0,0,0|2,0,0]=4 2198 B6R0.7 CC(F)(Br)C(=O)O MCULE-5584369540 [0,2,0,0,0,0|2,0,0]=4 2199 B6R0.7 CC(F)(F)C(=O)N MCULE-2299323235 [0,2,0,0,0,0|2,0,0]=4 2200 B6R0.7 CC(F)(F)C(=O)O MCULE-3936632737 [0,2,0,0,0,0|2,0,0]=4 2201 B6R0.7 CC(F)(F)C(=O)[O-] MCULE-1039544757 [0,2,0,0,0,0|2,0,0]=4 2202 B6R0.7 CN(C)C(C)(C)C MCULE-9794615428 [0,2,0,0,0,0|1,0,1]=4 2203 B6R0.7 CN(C)P(=O)(Cl)Cl MCULE-2578512938 [0,2,0,0,0,0|1,0,0]=3 2204 B6R0.7 CN(C)S(=N)(=O)C MCULE-3004118171 [0,2,0,0,0,0|1,0,0]=3 2205 B6R0.7 CN(C)S(=N)(=O)C MCULE-5099537454 [0,2,0,0,0,0|1,0,0]=3 2206 B6R0.7 CN(C)S(=O)(=O)C MCULE-9347739958 [0,2,0,0,0,0|1,0,0]=3 2207 B6R0.7 CN(C)S(=O)(=O)Cl MCULE-6441339083 [0,2,0,0,0,0|1,0,0]=3 2208 B6R0.7 CN(C)S(=O)(=O)F MCULE-7408393540 [0,2,0,0,0,0|1,0,0]=3 2209 B6R0.7 CN(C)S(=O)(=O)N MCULE-5196865280 [0,2,0,0,0,0|1,0,0]=3 2210 B6R0.7 CN(C)S(F)(F)F MCULE-7385898616 [0,2,0,0,0,0|2,0,0]=4 2211 B6R0.7 CN(C)[Si](C)(C)C MCULE-4058352118 [0,2,0,0,0,0|1,1,0]=4 2212 B6R0.7 CN(C)[Si](C)(C)Cl MCULE-7396227158 [0,2,0,0,0,0|1,1,0]=4 2213 B6R0.7 CS(=O)C(C)(C)C MCULE-5479134400 [0,2,0,0,0,0|2,0,0]=4 2214 B4R1.1 C1CNC1 MCULE-2817120281 [1,0,0,1,0,0|1,0,1]=4 2215 B4R1.1 C1CNC1 MCULE-5348168818 [1,0,0,1,0,0|1,0,1]=4 2216 B4R1.2 CC1CN1 MCULE-2953452695 [1,0,0,1,0,0|1,0,1]=4 2217 B4R1.2 [C@@H]1(CN1)C MCULE-4079798985 [1,0,0,1,0,0|1,0,1]=4 2218 B6R1.2 BrN1CC=CS1 MCULE-6872896536 [0,1,0,1,0,0|2,0,0]=4 2219 B6R1.2 CC1=CC=CC1 MCULE-3765599626 [0,1,0,1,0,0|2,0,0]=4 2220 B6R1.2 CC1=CCCC1 MCULE-8508688474 [0,1,0,1,0,0|2,0,0]=4 2221 B6R1.2 CC1=CCCO1 MCULE-7276659214 [0,1,0,1,0,0|2,0,0]=4 2222 B6R1.2 CC1=CCNC1 MCULE-5892113847 [0,1,0,1,0,0|2,0,0]=4 2223 B6R1.2 CC1=CCNC1 MCULE-9225220351 [0,1,0,1,0,0|2,0,0]=4 2224 B6R1.2 CC1C=CCC1 MCULE-1638534048 [0,1,0,1,0,0|2,0,0]=4 2225 B6R1.2 CN1C=CC=C1 MCULE-4929965979 [0,1,0,1,0,0|1,0,1]=4 2226 B6R1.2 CN1C=CC=N1 MCULE-9409141633 [0,1,0,1,0,0|1,0,1]=4 2227 B6R1.2 CN1C=CN=C1 MCULE-1468573178 [0,1,0,1,0,0|1,0,1]=4 2228 B6R1.2 CN1C=CN=C1 MCULE-1857627459 [0,1,0,1,0,0|1,0,1]=4 2229 B6R1.2 CN1C=CN=C1 MCULE-3087755909 [0,1,0,1,0,0|1,0,1]=4 2230 B6R1.2 CN1C=CN=C1 MCULE-7326970566 [0,1,0,1,0,0|1,0,1]=4 2231 B6R1.2 CN1C=CN=C1 MCULE-7347723440 [0,1,0,1,0,0|1,0,1]=4 2232 B6R1.2 CN1C=CN=N1 MCULE-5243651327 [0,1,0,1,0,0|2,0,0]=4 2233 B6R1.2 CN1C=C[NH+]=C1 MCULE-1511454799 [0,1,0,1,0,0|1,0,1]=4 2234 B6R1.2 CN1C=NC=N1 MCULE-7058833727 [0,1,0,1,0,0|1,0,1]=4 2235 B6R1.2 CN1C=NN=C1 MCULE-6264363668 [0,1,0,1,0,0|1,0,1]=4 2236 B6R1.2 CN1C=NN=N1 MCULE-3160538239 [0,1,0,1,0,0|2,0,0]=4 2237 B6R1.2 CN1CC=CC1 MCULE-2586884916 [0,1,0,1,0,0|1,0,0]=3 2238 B6R1.2 CN1CCCC1 MCULE-5387702231 [0,1,0,1,0,0|1,0,1]=4 2239 B6R1.2 CN1CCNC1 MCULE-8059197564 [0,1,0,1,0,0|1,0,1]=4 2240 B6R1.2 CN1CCNC1 MCULE-9818601515 [0,1,0,1,0,0|1,0,1]=4 2241 B6R1.2 CN1CCOC1 MCULE-5504672404 [0,1,0,1,0,0|0,0,2]=4 2242 B6R1.2 CN1N=CN=N1 MCULE-7206818291 [0,1,0,1,0,0|2,0,0]=4 2243 B6R1.3 Br/C=C/C1CC1 MCULE-8231904960 [0,1,0,1,0,0|2,0,0]=4 2244 B6R1.3 BrC=CC1CC1 MCULE-7061395349 [0,1,0,1,0,0|2,0,0]=4 2245 B6R1.3 NCCN1CC1 MCULE-3554584147 [0,1,0,1,0,0|1,0,1]=4 2246 B6R1.3 O=C=NC1CC1 MCULE-8769435962 [0,1,0,1,0,0|1,0,1]=4 2247 B6R1.3 O=CCC1CC1 MCULE-3319649937 [0,1,0,1,0,0|1,0,0]=3 2248 B6R1.3 O=CNC1CC1 MCULE-6602451187 [0,1,0,1,0,0|1,0,0]=3 2249 B6R1.3 OCCN1CC1 MCULE-3845187783 [0,1,0,1,0,0|0,0,2]=4 2250 B6R1.5 C=C1CC(=O)O1 MCULE-7149487095 [0,1,0,1,0,0|1,0,1]=4 2251 B6R1.5 CC1CC(=O)C1 MCULE-2159393653 [0,1,0,1,0,0|1,0,0]=3 2252 B6R1.5 CC1CC(=O)N1 MCULE-6139592633 [0,1,0,1,0,0|1,0,0]=3 2253 B6R1.5 CC1CC(=O)O1 MCULE-9285847382 [0,1,0,1,0,0|1,0,0]=3 2254 B6R1.5 CN1CC(=O)C1 MCULE-1685267969 [0,1,0,1,0,0|0,0,0]=2 2255 B6R1.5 CN1CC(=O)C1 MCULE-2242594777 [0,1,0,1,0,0|0,0,0]=2 2256 B6R1.5 CN1CC(C1)Cl MCULE-8475620447 [0,1,0,1,0,0|1,0,1]=4 2257 B6R1.5 CN1CC(C1)Cl MCULE-8543507391 [0,1,0,1,0,0|1,0,1]=4 2258 B6R1.5 CN1CC(C1)N MCULE-2180239206 [0,1,0,1,0,0|1,0,1]=4 2259 B6R1.5 CN1CC(C1)N MCULE-4181047352 [0,1,0,1,0,0|1,0,1]=4 2260 B6R1.5 CN1CC(C1)O MCULE-2897194266 [0,1,0,1,0,0|0,0,2]=4 2261 B6R1.5 CN1CC(C1)O MCULE-3717153558 [0,1,0,1,0,0|0,0,2]=4 2262 B6R1.5 CN1CC(C1)O MCULE-7229396078 [0,1,0,1,0,0|0,0,2]=4 2263 B6R1.5 C[C@@H]1CC(=O)O1 MCULE-3257475519 [0,1,0,1,0,0|1,0,0]=3 2264 B6R1.5 NC1CC(=O)C1 MCULE-3450860282 [0,1,0,1,0,0|2,0,0]=4 2265 B6R1.5 NC1CC(=O)C1 MCULE-5974961836 [0,1,0,1,0,0|2,0,0]=4 2266 B6R1.5 O=C1CC(C1)Br MCULE-1715982282 [0,1,0,1,0,0|2,0,0]=4 2267 B6R1.5 O=C1CC(C1)F MCULE-2541516698 [0,1,0,1,0,0|2,0,0]=4 2268 B6R1.5 O=C1CC(C1)O MCULE-7099112258 [0,1,0,1,0,0|2,0,0]=4 2269 B6R1.8 C=C1CC1CO MCULE-4338601055 [0,1,0,1,0,0|2,0,0]=4 2270 B6R1.8 CC1CC1C=O MCULE-2600627355 [0,1,0,1,0,0|1,0,0]=3 2271 B6R1.8 O=CC1CC1Cl MCULE-5539872961 [0,1,0,1,0,0|1,0,0]=3 2272 B6R1.11 CC(=O)C1CC1 MCULE-3846146416 [0,1,0,1,0,0|1,0,0]=3 2273 B6R1.11 CC(=O)C1CO1 MCULE-4329154079 [0,1,0,1,0,0|2,0,0]=4 2274 B6R1.11 CN(C)C1CC1 MCULE-5891640069 [0,1,0,1,0,0|1,0,1]=4 2275 B6R1.11 CN(C)C1CC1 MCULE-6751529979 [0,1,0,1,0,0|1,0,1]=4 2276 B6R1.11 N=C(N)C1CC1 MCULE-1244673727 [0,1,0,1,0,0|2,0,0]=4 2277 B6R1.11 N=C(N)C1CC1 MCULE-2494860413 [0,1,0,1,0,0|2,0,0]=4 2278 B6R1.11 NC(=O)C1CC1 MCULE-9911054913 [0,1,0,1,0,0|1,0,0]=3 2279 B6R1.11 NC(=O)C1CO1 MCULE-6911744868 [0,1,0,1,0,0|2,0,0]=4 2280 B6R1.11 NC(=S)C1CC1 MCULE-7304936539 [0,1,0,1,0,0|1,1,0]=4 2281 B6R1.11 O=C(Cl)C1CC1 MCULE-8675746452 [0,1,0,1,0,0|1,0,0]=3 2282 B6R1.11 O=C(O)C1CC1 MCULE-4677373694 [0,1,0,1,0,0|1,0,0]=3 2283 B6R1.11 O=C(O)C1CN1 MCULE-3236125597 [0,1,0,1,0,0|2,0,0]=4 2284 B6R1.11 O=C(O)C1CO1 MCULE-2152916793 [0,1,0,1,0,0|2,0,0]=4 2285 B6R1.11 O=C(O)[C@@H]1CN1 MCULE-4363753412 [0,1,0,1,0,0|2,0,0]=4 2286 B6R1.11 O=C(O)[C@H]1CN1 MCULE-4830347195 [0,1,0,1,0,0|2,0,0]=4 2287 B6R1.11 O=C(O)[C@H]1CO1 MCULE-5204459723 [0,1,0,1,0,0|2,0,0]=4 2288 B6R1.11 O=C(O)[C@H]1CO1 MCULE-6983707093 [0,1,0,1,0,0|2,0,0]=4 2289 B6R1.11 O=C([O-])C1CN1 MCULE-6490437892 [0,1,0,1,0,0|2,0,0]=4 2290 B6R1.11 O=C([O-])C1CO1 MCULE-4586459966 [0,1,0,1,0,0|2,0,0]=4 2291 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1647975669 [0,1,0,1,0,0|2,0,0]=4 2292 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1906997950 [0,1,0,1,0,0|2,0,0]=4 2293 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-4899800766 [0,1,0,1,0,0|2,0,0]=4 2294 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-9148170094 [0,1,0,1,0,0|2,0,0]=4 2295 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-6663734494 [0,1,0,1,0,0|2,0,0]=4 2296 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-8580451361 [0,1,0,1,0,0|2,0,0]=4 2297 B6R1.11 O=S(O)C1CC1 MCULE-1616243918 [0,1,0,1,0,0|2,0,0]=4 2298 B6R1.11 O=S([O-])C1CC1 MCULE-9446364072 [0,1,0,1,0,0|2,0,0]=4 2299 B6R1.4 CC1CCC1=O MCULE-4548181715 [0,1,0,1,0,0|1,0,0]=3 2300 B6R1.4 CC1CNC1=O MCULE-5523309752 [0,1,0,1,0,0|1,0,0]=3 2301 B6R1.4 CC1COC1=O MCULE-9711165188 [0,1,0,1,0,0|1,0,0]=3 2302 B6R1.4 CC1OCC1=O MCULE-7718609686 [0,1,0,1,0,0|1,0,0]=3 2303 B6R1.4 NC1CCC1=O MCULE-3868209809 [0,1,0,1,0,0|2,0,0]=4 2304 B6R1.4 NC1CCC1=O MCULE-9741389143 [0,1,0,1,0,0|2,0,0]=4 2305 B6R1.4 NC1CNC1=O MCULE-2761616663 [0,1,0,1,0,0|2,0,0]=4 2306 B6R1.4 NC1CNC1=O MCULE-3021306383 [0,1,0,1,0,0|2,0,0]=4 2307 B6R1.4 NC1CNC1=O MCULE-3943057121 [0,1,0,1,0,0|2,0,0]=4 2308 B6R1.4 NC1COC1=O MCULE-6998565452 [0,1,0,1,0,0|2,0,0]=4 2309 B6R1.4 NN1CCC1=O MCULE-6200802911 [0,1,0,1,0,0|1,0,0]=3 2310 B6R1.4 NN1CCC1=O MCULE-8249778821 [0,1,0,1,0,0|1,0,0]=3 2311 B6R1.4 N[C@@H]1CNC1=O MCULE-3645662662 [0,1,0,1,0,0|2,0,0]=4 2312 B6R1.4 N[C@@H]1CNC1=O MCULE-4399212271 [0,1,0,1,0,0|2,0,0]=4 2313 B6R1.4 N[C@@H]1CNC1=O MCULE-6332076219 [0,1,0,1,0,0|2,0,0]=4 2314 B6R1.4 N[C@@H]1CNC1=O MCULE-6365012530 [0,1,0,1,0,0|2,0,0]=4 2315 B6R1.4 N[C@@H]1COC1=O MCULE-8080548213 [0,1,0,1,0,0|2,0,0]=4 2316 B6R1.4 N[C@@H]1COC1=O MCULE-9370092691 [0,1,0,1,0,0|2,0,0]=4 2317 B6R1.4 N[C@H]1CNC1=O MCULE-2792436534 [0,1,0,1,0,0|2,0,0]=4 2318 B6R1.4 N[C@H]1CNC1=O MCULE-6881316562 [0,1,0,1,0,0|2,0,0]=4 2319 B6R1.4 N[C@H]1CNC1=O MCULE-8864053661 [0,1,0,1,0,0|2,0,0]=4 2320 B6R1.4 N[C@H]1CNC1=O MCULE-9014449253 [0,1,0,1,0,0|2,0,0]=4 2321 B6R1.4 N[C@H]1COC1=O MCULE-4812631526 [0,1,0,1,0,0|2,0,0]=4 2322 B6R1.4 O=C1CCC1Br MCULE-1088592133 [0,1,0,1,0,0|2,0,0]=4 2323 B6R1.4 O=C1CCC1F MCULE-6197375881 [0,1,0,1,0,0|2,0,0]=4 2324 B6R1.4 O=C1CCC1O MCULE-1248327203 [0,1,0,1,0,0|2,0,0]=4 2325 B6R1.4 O=C1CC[C@@H]1Br MCULE-3455449754 [0,1,0,1,0,0|2,0,0]=4 2326 B6R1.4 [C@@H]1(COC1=O)N MCULE-7456320845 [0,1,0,1,0,0|2,0,0]=4 2327 B6R1.6 C=CC1CNC1 MCULE-9929515921 [0,1,0,1,0,0|2,0,0]=4 2328 B6R1.6 O=CC1CCC1 MCULE-8678026416 [0,1,0,1,0,0|1,0,0]=3 2329 B6R1.6 O=CC1COC1 MCULE-3773699476 [0,1,0,1,0,0|1,0,0]=3 2330 B6R1.6 O=CC1CSC1 MCULE-2648443908 [0,1,0,1,0,0|1,0,0]=3 2331 B6R1.7 C=CC1(CC1)O MCULE-4527683750 [0,1,0,1,0,0|2,0,0]=4 2332 B6R1.7 C=CC1(CO1)C MCULE-2507036726 [0,1,0,1,0,0|2,0,0]=4 2333 B6R1.7 CC1(CC1)C=O MCULE-3651219428 [0,1,0,1,0,0|1,0,0]=3 2334 B6R1.7 O=CC1(CC1)F MCULE-5455667660 [0,1,0,1,0,0|1,0,0]=3