0 B5R0.5 BrC(Br)C(Br)Br MCULE-8965281409 [0,0,0,0,0,0|4,0,0]=4 1 B5R0.5 C=C(C)C(=C)C MCULE-6799765242 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.5 C=C(C)C(=O)C MCULE-5872425076 [0,0,0,0,0,0|1,1,2]=4 3 B5R0.5 C=C(C)C(C)C MCULE-2535284443 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.5 C=C(C)C(C)Cl MCULE-5294924458 [0,0,0,0,0,0|2,0,1]=3 5 B5R0.5 C=C(C)C(C)O MCULE-3768810742 [0,0,0,0,0,0|1,1,1]=3 6 B5R0.5 C=C(C)C(Cl)Cl MCULE-4460311331 [0,0,0,0,0,0|3,0,1]=4 7 B5R0.5 C=C(C)C(Cl)Cl MCULE-5923487420 [0,0,0,0,0,0|3,0,1]=4 8 B5R0.5 CC(=C(C)Br)C MCULE-2244219065 [0,0,0,0,0,0|2,0,2]=4 9 B5R0.5 CC(=C(C)C)C MCULE-2888318026 [0,0,0,0,0,0|2,0,2]=4 10 B5R0.5 CC(=O)C(=O)C MCULE-5742661187 [0,0,0,0,0,0|0,2,2]=4 11 B5R0.5 CC(=O)C(C)Br MCULE-3764525199 [0,0,0,0,0,0|1,1,1]=3 12 B5R0.5 CC(=O)C(C)C MCULE-5982732938 [0,0,0,0,0,0|1,1,1]=3 13 B5R0.5 CC(=O)C(C)Cl MCULE-5065840606 [0,0,0,0,0,0|1,1,1]=3 14 B5R0.5 CC(=O)C(C)F MCULE-2129925918 [0,0,0,0,0,0|1,1,1]=3 15 B5R0.5 CC(=O)C(C)N MCULE-5716124999 [0,0,0,0,0,0|1,1,1]=3 16 B5R0.5 CC(=O)C(C)N MCULE-9248002534 [0,0,0,0,0,0|1,1,1]=3 17 B5R0.5 CC(=O)C(C)O MCULE-5374414264 [0,0,0,0,0,0|0,2,1]=3 18 B5R0.5 CC(=O)C(C)S MCULE-2716722148 [0,0,0,0,0,0|0,1,1]=2 19 B5R0.5 CC(=O)C(Cl)Cl MCULE-9043899746 [0,0,0,0,0,0|2,1,1]=4 20 B5R0.5 CC(=O)C(F)F MCULE-9206168077 [0,0,0,0,0,0|2,1,1]=4 21 B5R0.5 CC(=O)N(C)C MCULE-4256511309 [0,0,0,0,0,0|2,1,1]=4 22 B5R0.5 CC(=O)N(C)N MCULE-2447375293 [0,0,0,0,0,0|2,1,1]=4 23 B5R0.5 CC(=O)[C@H](C)N MCULE-2609095078 [0,0,0,0,0,0|1,1,1]=3 24 B5R0.5 CC(=O)[C@H](C)N MCULE-6039921944 [0,0,0,0,0,0|1,1,1]=3 25 B5R0.5 CC(=O)[C@H](C)N MCULE-6387613992 [0,0,0,0,0,0|1,1,1]=3 26 B5R0.5 CC(=O)[C@H](C)N MCULE-7052375323 [0,0,0,0,0,0|1,1,1]=3 27 B5R0.5 CC(=S)N(C)C MCULE-6797990305 [0,0,0,0,0,0|2,0,2]=4 28 B5R0.5 CC(Br)C(=O)Br MCULE-2400047844 [0,0,0,0,0,0|2,1,1]=4 29 B5R0.5 CC(Br)C(=O)Cl MCULE-7431871683 [0,0,0,0,0,0|2,1,1]=4 30 B5R0.5 CC(Br)C(=O)N MCULE-9226586148 [0,0,0,0,0,0|2,1,1]=4 31 B5R0.5 CC(Br)C(=O)O MCULE-3935837943 [0,0,0,0,0,0|2,1,1]=4 32 B5R0.5 CC(Br)C(=O)O MCULE-6068441065 [0,0,0,0,0,0|2,1,1]=4 33 B5R0.5 CC(Br)C(C)Br MCULE-8272754345 [0,0,0,0,0,0|2,0,0]=2 34 B5R0.5 CC(Br)C(Cl)Br MCULE-8471336753 [0,0,0,0,0,0|3,0,0]=3 35 B5R0.5 CC(Br)C(Cl)Cl MCULE-1643063989 [0,0,0,0,0,0|3,0,0]=3 36 B5R0.5 CC(C)B(O)O MCULE-1255589444 [0,0,0,0,0,0|3,1,0]=4 37 B5R0.5 CC(C)C(=N)N MCULE-2464075086 [0,0,0,0,0,0|3,0,1]=4 38 B5R0.5 CC(C)C(=N)N MCULE-6743996580 [0,0,0,0,0,0|3,0,1]=4 39 B5R0.5 CC(C)C(=O)Br MCULE-3679003896 [0,0,0,0,0,0|2,1,1]=4 40 B5R0.5 CC(C)C(=O)Cl MCULE-6582236331 [0,0,0,0,0,0|2,1,1]=4 41 B5R0.5 CC(C)C(=O)N MCULE-9773835068 [0,0,0,0,0,0|2,1,1]=4 42 B5R0.5 CC(C)C(=O)O MCULE-7783770647 [0,0,0,0,0,0|2,1,1]=4 43 B5R0.5 CC(C)C(=O)S MCULE-9552406593 [0,0,0,0,0,0|2,0,1]=3 44 B5R0.5 CC(C)C(=S)N MCULE-3546856315 [0,0,0,0,0,0|2,0,2]=4 45 B5R0.5 CC(C)C(C)Br MCULE-8934980523 [0,0,0,0,0,0|2,0,0]=2 46 B5R0.5 CC(C)C(C)C MCULE-7887644548 [0,0,0,0,0,0|2,0,0]=2 47 B5R0.5 CC(C)C(C)I MCULE-7528764320 [0,0,0,0,0,0|2,0,0]=2 48 B5R0.5 CC(C)C(C)N MCULE-1630754475 [0,0,0,0,0,0|2,0,0]=2 49 B5R0.5 CC(C)C(C)N MCULE-1801901816 [0,0,0,0,0,0|2,0,0]=2 50 B5R0.5 CC(C)C(C)N MCULE-3544463874 [0,0,0,0,0,0|2,0,0]=2 51 B5R0.5 CC(C)C(C)N MCULE-4774844065 [0,0,0,0,0,0|2,0,0]=2 52 B5R0.5 CC(C)C(C)O MCULE-4829392845 [0,0,0,0,0,0|1,1,0]=2 53 B5R0.5 CC(C)C(C)S MCULE-7489203323 [0,0,0,0,0,0|1,0,0]=1 54 B5R0.5 CC(C)C(I)I MCULE-6684789578 [0,0,0,0,0,0|3,0,0]=3 55 B5R0.5 CC(C)N(=O)=O MCULE-8418443353 [0,0,0,0,0,0|3,1,0]=4 56 B5R0.5 CC(C)N(C)C MCULE-1993251030 [0,0,0,0,0,0|3,0,0]=3 57 B5R0.5 CC(C)S(=O)N MCULE-8425110407 [0,0,0,0,0,0|3,1,0]=4 58 B5R0.5 CC(C)S(=O)O MCULE-5200056082 [0,0,0,0,0,0|3,1,0]=4 59 B5R0.5 CC(C)S(=O)[O-] MCULE-2354817364 [0,0,0,0,0,0|3,1,0]=4 60 B5R0.5 CC(C)[C@@H](C)N MCULE-1953734886 [0,0,0,0,0,0|2,0,0]=2 61 B5R0.5 CC(C)[C@@H](C)N MCULE-3105334197 [0,0,0,0,0,0|2,0,0]=2 62 B5R0.5 CC(C)[C@@H](C)N MCULE-9470429569 [0,0,0,0,0,0|2,0,0]=2 63 B5R0.5 CC(C)[C@@H](C)O MCULE-3565458505 [0,0,0,0,0,0|1,1,0]=2 64 B5R0.5 CC(C)[C@H](C)N MCULE-2859174363 [0,0,0,0,0,0|2,0,0]=2 65 B5R0.5 CC(C)[C@H](C)N MCULE-3034457659 [0,0,0,0,0,0|2,0,0]=2 66 B5R0.5 CC(C)[C@H](C)N MCULE-5904658917 [0,0,0,0,0,0|2,0,0]=2 67 B5R0.5 CC(C)[C@H](C)O MCULE-1553214756 [0,0,0,0,0,0|1,1,0]=2 68 B5R0.5 CC(C)[C@H](C)O MCULE-8141633445 [0,0,0,0,0,0|1,1,0]=2 69 B5R0.5 CC(Cl)C(=N)N MCULE-2357555185 [0,0,0,0,0,0|3,0,1]=4 70 B5R0.5 CC(Cl)C(=N)N MCULE-5302250002 [0,0,0,0,0,0|3,0,1]=4 71 B5R0.5 CC(Cl)C(=O)Cl MCULE-6547241717 [0,0,0,0,0,0|2,1,1]=4 72 B5R0.5 CC(Cl)C(=O)N MCULE-5322078211 [0,0,0,0,0,0|2,1,1]=4 73 B5R0.5 CC(Cl)C(=O)O MCULE-3597230803 [0,0,0,0,0,0|2,1,1]=4 74 B5R0.5 CC(Cl)C(=O)O MCULE-5449120618 [0,0,0,0,0,0|2,1,1]=4 75 B5R0.5 CC(Cl)C(C)Cl MCULE-6954506926 [0,0,0,0,0,0|2,0,0]=2 76 B5R0.5 CC(Cl)C(Cl)Cl MCULE-1848161215 [0,0,0,0,0,0|3,0,0]=3 77 B5R0.5 CC(F)C(=O)O MCULE-7334922730 [0,0,0,0,0,0|2,1,1]=4 78 B5R0.5 CC(I)C(=O)N MCULE-8608495554 [0,0,0,0,0,0|2,1,1]=4 79 B5R0.5 CC(N)C(=O)N MCULE-1264398810 [0,0,0,0,0,0|2,1,1]=4 80 B5R0.5 CC(N)C(=O)N MCULE-2251123672 [0,0,0,0,0,0|2,1,1]=4 81 B5R0.5 CC(N)C(=O)N MCULE-2273926073 [0,0,0,0,0,0|2,1,1]=4 82 B5R0.5 CC(N)C(=O)N MCULE-5340923071 [0,0,0,0,0,0|2,1,1]=4 83 B5R0.5 CC(N)C(=O)N MCULE-6061233032 [0,0,0,0,0,0|2,1,1]=4 84 B5R0.5 CC(N)C(=O)N MCULE-9273221837 [0,0,0,0,0,0|2,1,1]=4 85 B5R0.5 CC(N)C(=O)O MCULE-3498369789 [0,0,0,0,0,0|2,1,1]=4 86 B5R0.5 CC(N)C(=O)O MCULE-3809839392 [0,0,0,0,0,0|2,1,1]=4 87 B5R0.5 CC(N)C(=O)O MCULE-4751903561 [0,0,0,0,0,0|2,1,1]=4 88 B5R0.5 CC(N)C(=O)O MCULE-6963397848 [0,0,0,0,0,0|2,1,1]=4 89 B5R0.5 CC(N)C(C)N MCULE-6724099648 [0,0,0,0,0,0|2,0,0]=2 90 B5R0.5 CC(N)C(C)O MCULE-3512899672 [0,0,0,0,0,0|1,1,0]=2 91 B5R0.5 CC(N)C(C)O MCULE-6286987696 [0,0,0,0,0,0|1,1,0]=2 92 B5R0.5 CC(N)C(F)F MCULE-5449346446 [0,0,0,0,0,0|3,0,0]=3 93 B5R0.5 CC(O)C(=N)N MCULE-4358846536 [0,0,0,0,0,0|2,1,1]=4 94 B5R0.5 CC(O)C(=N)N MCULE-5644516205 [0,0,0,0,0,0|2,1,1]=4 95 B5R0.5 CC(O)C(=O)N MCULE-6247123668 [0,0,0,0,0,0|1,2,1]=4 96 B5R0.5 CC(O)C(=O)N MCULE-7823792358 [0,0,0,0,0,0|1,2,1]=4 97 B5R0.5 CC(O)C(=O)O MCULE-3922256529 [0,0,0,0,0,0|1,2,1]=4 98 B5R0.5 CC(O)C(=O)O MCULE-5387110670 [0,0,0,0,0,0|1,2,1]=4 99 B5R0.5 CC(O)C(=O)[O-] MCULE-1056716990 [0,0,0,0,0,0|1,2,1]=4 100 B5R0.5 CC(O)C(=O)[O-] MCULE-8184872865 [0,0,0,0,0,0|1,2,1]=4 101 B5R0.5 CC(O)C(=O)[O-] MCULE-8730993694 [0,0,0,0,0,0|1,2,1]=4 102 B5R0.5 CC(O)C(C)Br MCULE-1140424623 [0,0,0,0,0,0|1,1,0]=2 103 B5R0.5 CC(O)C(C)Cl MCULE-3352632568 [0,0,0,0,0,0|1,1,0]=2 104 B5R0.5 CC(O)C(C)O MCULE-2858785316 [0,0,0,0,0,0|0,2,0]=2 105 B5R0.5 CC(O)C(C)S MCULE-3741743569 [0,0,0,0,0,0|0,1,0]=1 106 B5R0.5 CC(O)C(F)F MCULE-1258374037 [0,0,0,0,0,0|2,1,0]=3 107 B5R0.5 CC(S)C(=O)N MCULE-1465182001 [0,0,0,0,0,0|1,1,1]=3 108 B5R0.5 CC(S)C(=O)O MCULE-6944738352 [0,0,0,0,0,0|1,1,1]=3 109 B5R0.5 CC(S)C(C)S MCULE-3508721208 [0,0,0,0,0,0|0,0,0]=0 110 B5R0.5 CN(C)C(=S)S MCULE-4296425055 [0,0,0,0,0,0|3,0,1]=4 111 B5R0.5 CN(C)C(=S)S MCULE-5159570847 [0,0,0,0,0,0|3,0,1]=4 112 B5R0.5 CN(C)N(C)C MCULE-1054866442 [0,0,0,0,0,0|4,0,0]=4 113 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8303539222 [0,0,0,0,0,0|2,1,1]=4 114 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8530283309 [0,0,0,0,0,0|2,1,1]=4 115 B5R0.5 C[C@@H](Cl)C(=O)Cl MCULE-3579498695 [0,0,0,0,0,0|2,1,1]=4 116 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-6578788045 [0,0,0,0,0,0|2,1,1]=4 117 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-8314108697 [0,0,0,0,0,0|2,1,1]=4 118 B5R0.5 C[C@@H](F)C(=O)N MCULE-1505685009 [0,0,0,0,0,0|2,1,1]=4 119 B5R0.5 C[C@@H](N)C(=O)N MCULE-4677983549 [0,0,0,0,0,0|2,1,1]=4 120 B5R0.5 C[C@@H](N)C(=O)N MCULE-6112443507 [0,0,0,0,0,0|2,1,1]=4 121 B5R0.5 C[C@@H](N)C(=O)N MCULE-7940270709 [0,0,0,0,0,0|2,1,1]=4 122 B5R0.5 C[C@@H](N)C(=O)N MCULE-8482332558 [0,0,0,0,0,0|2,1,1]=4 123 B5R0.5 C[C@@H](N)C(=O)O MCULE-3571488623 [0,0,0,0,0,0|2,1,1]=4 124 B5R0.5 C[C@@H](N)C(=O)O MCULE-9756365751 [0,0,0,0,0,0|2,1,1]=4 125 B5R0.5 C[C@@H](N)C(F)F MCULE-3679161461 [0,0,0,0,0,0|3,0,0]=3 126 B5R0.5 C[C@@H](N)C(F)F MCULE-5068481064 [0,0,0,0,0,0|3,0,0]=3 127 B5R0.5 C[C@@H](N)[C@@H](C)N MCULE-5194916344 [0,0,0,0,0,0|2,0,0]=2 128 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-4537991630 [0,0,0,0,0,0|1,1,0]=2 129 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5710552020 [0,0,0,0,0,0|1,1,0]=2 130 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5951487868 [0,0,0,0,0,0|1,1,0]=2 131 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8093543292 [0,0,0,0,0,0|1,1,0]=2 132 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8196664475 [0,0,0,0,0,0|1,1,0]=2 133 B5R0.5 C[C@@H](O)C(=N)N MCULE-1498978023 [0,0,0,0,0,0|2,1,1]=4 134 B5R0.5 C[C@@H](O)C(=N)N MCULE-6124491136 [0,0,0,0,0,0|2,1,1]=4 135 B5R0.5 C[C@@H](O)C(=N)N MCULE-7410387081 [0,0,0,0,0,0|2,1,1]=4 136 B5R0.5 C[C@@H](O)C(=N)N MCULE-9566288141 [0,0,0,0,0,0|2,1,1]=4 137 B5R0.5 C[C@@H](O)C(=O)N MCULE-2026557726 [0,0,0,0,0,0|1,2,1]=4 138 B5R0.5 C[C@@H](O)C(=O)N MCULE-8056291801 [0,0,0,0,0,0|1,2,1]=4 139 B5R0.5 C[C@@H](O)C(=O)O MCULE-4625208788 [0,0,0,0,0,0|1,2,1]=4 140 B5R0.5 C[C@@H](O)C(=O)O MCULE-9141235095 [0,0,0,0,0,0|1,2,1]=4 141 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-5673591667 [0,0,0,0,0,0|1,2,1]=4 142 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-8146434340 [0,0,0,0,0,0|1,2,1]=4 143 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-9026662277 [0,0,0,0,0,0|1,2,1]=4 144 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-2843927827 [0,0,0,0,0,0|0,2,0]=2 145 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-3739961672 [0,0,0,0,0,0|0,2,0]=2 146 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-5488313047 [0,0,0,0,0,0|0,2,0]=2 147 B5R0.5 C[C@H](Br)C(=O)Cl MCULE-2960953088 [0,0,0,0,0,0|2,1,1]=4 148 B5R0.5 C[C@H](Br)C(=O)O MCULE-4788730445 [0,0,0,0,0,0|2,1,1]=4 149 B5R0.5 C[C@H](Br)C(=O)O MCULE-9354978281 [0,0,0,0,0,0|2,1,1]=4 150 B5R0.5 C[C@H](Br)[C@@H](C)Br MCULE-7263507123 [0,0,0,0,0,0|2,0,0]=2 151 B5R0.5 C[C@H](Cl)C(=O)O MCULE-4816831649 [0,0,0,0,0,0|2,1,1]=4 152 B5R0.5 C[C@H](Cl)C(=O)O MCULE-8389122613 [0,0,0,0,0,0|2,1,1]=4 153 B5R0.5 C[C@H](F)C(=O)N MCULE-7457242428 [0,0,0,0,0,0|2,1,1]=4 154 B5R0.5 C[C@H](N)C(=O)N MCULE-4716963408 [0,0,0,0,0,0|2,1,1]=4 155 B5R0.5 C[C@H](N)C(=O)N MCULE-6879702251 [0,0,0,0,0,0|2,1,1]=4 156 B5R0.5 C[C@H](N)C(=O)N MCULE-7090555441 [0,0,0,0,0,0|2,1,1]=4 157 B5R0.5 C[C@H](N)C(=O)N MCULE-7293369315 [0,0,0,0,0,0|2,1,1]=4 158 B5R0.5 C[C@H](N)C(=O)N MCULE-7341432132 [0,0,0,0,0,0|2,1,1]=4 159 B5R0.5 C[C@H](N)C(=O)N MCULE-7556063213 [0,0,0,0,0,0|2,1,1]=4 160 B5R0.5 C[C@H](N)C(=O)N MCULE-8320991932 [0,0,0,0,0,0|2,1,1]=4 161 B5R0.5 C[C@H](N)C(=O)N MCULE-8491573930 [0,0,0,0,0,0|2,1,1]=4 162 B5R0.5 C[C@H](N)C(=O)O MCULE-4916719758 [0,0,0,0,0,0|2,1,1]=4 163 B5R0.5 C[C@H](N)C(=O)O MCULE-5261590548 [0,0,0,0,0,0|2,1,1]=4 164 B5R0.5 C[C@H](N)C(=O)O MCULE-7791919887 [0,0,0,0,0,0|2,1,1]=4 165 B5R0.5 C[C@H](N)C(=O)O MCULE-8724854497 [0,0,0,0,0,0|2,1,1]=4 166 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-6389040758 [0,0,0,0,0,0|1,1,0]=2 167 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-7956913866 [0,0,0,0,0,0|1,1,0]=2 168 B5R0.5 C[C@H](N)[C@H](C)N MCULE-1560418234 [0,0,0,0,0,0|2,0,0]=2 169 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1340338147 [0,0,0,0,0,0|1,1,0]=2 170 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1738016964 [0,0,0,0,0,0|1,1,0]=2 171 B5R0.5 C[C@H](N)[C@H](C)O MCULE-2254798251 [0,0,0,0,0,0|1,1,0]=2 172 B5R0.5 C[C@H](N)[C@H](C)O MCULE-7688101680 [0,0,0,0,0,0|1,1,0]=2 173 B5R0.5 C[C@H](O)C(=O)N MCULE-8400190365 [0,0,0,0,0,0|1,2,1]=4 174 B5R0.5 C[C@H](O)C(=O)O MCULE-5695391344 [0,0,0,0,0,0|1,2,1]=4 175 B5R0.5 C[C@H](O)C(=O)O MCULE-8864689875 [0,0,0,0,0,0|1,2,1]=4 176 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-1034285072 [0,0,0,0,0,0|1,2,1]=4 177 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-3598405830 [0,0,0,0,0,0|1,2,1]=4 178 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-7525689298 [0,0,0,0,0,0|1,2,1]=4 179 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8057429776 [0,0,0,0,0,0|1,2,1]=4 180 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8729310894 [0,0,0,0,0,0|1,2,1]=4 181 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-3776841970 [0,0,0,0,0,0|1,1,0]=2 182 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-4906999918 [0,0,0,0,0,0|1,1,0]=2 183 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5860404631 [0,0,0,0,0,0|1,1,0]=2 184 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5888789996 [0,0,0,0,0,0|1,1,0]=2 185 B5R0.5 C[C@H](O)[C@@H](C)O MCULE-8389904530 [0,0,0,0,0,0|0,2,0]=2 186 B5R0.5 C[C@H](O)[C@H](C)O MCULE-8448870055 [0,0,0,0,0,0|0,2,0]=2 187 B5R0.5 C[C@H](O)[C@H](C)O MCULE-9615630900 [0,0,0,0,0,0|0,2,0]=2 188 B5R0.5 C[C@H](S)[C@@H](C)O MCULE-3347141817 [0,0,0,0,0,0|0,1,0]=1 189 B5R0.5 ClC(Cl)C(Cl)Cl MCULE-4029260741 [0,0,0,0,0,0|4,0,0]=4 190 B5R0.5 FC(Cl)C(Cl)Cl MCULE-8036739850 [0,0,0,0,0,0|4,0,0]=4 191 B5R0.5 FC(Cl)C(F)Cl MCULE-8576959735 [0,0,0,0,0,0|4,0,0]=4 192 B5R0.5 FC(F)C(Cl)Cl MCULE-3568657525 [0,0,0,0,0,0|4,0,0]=4 193 B5R0.5 OC(O)C(Cl)Cl MCULE-3363992346 [0,0,0,0,0,0|3,1,0]=4 194 B5R0.5 [C@@H](C)(O)C(=O)N MCULE-6953360641 [0,0,0,0,0,0|1,2,1]=4 195 B5R0.5 [NH3+]C(C)C(C)[NH3+] MCULE-4215582247 [0,0,0,0,0,0|2,0,0]=2 196 B4R0.1 BrCC(Br)Br MCULE-1904439252 [1,0,0,0,0,0|3,0,0]=4 197 B4R0.1 C#CC(C)Br MCULE-6701225038 [1,0,0,0,0,0|1,0,2]=4 198 B4R0.1 C#CC(C)C MCULE-4600802925 [1,0,0,0,0,0|1,0,2]=4 199 B4R0.1 C#CC(C)Cl MCULE-2069451312 [1,0,0,0,0,0|1,0,2]=4 200 B4R0.1 C#CC(C)N MCULE-5174459541 [1,0,0,0,0,0|1,0,2]=4 201 B4R0.1 C#CC(C)N MCULE-7552261137 [1,0,0,0,0,0|1,0,2]=4 202 B4R0.1 C#CC(C)N MCULE-8458008104 [1,0,0,0,0,0|1,0,2]=4 203 B4R0.1 C#CC(C)N MCULE-8872781976 [1,0,0,0,0,0|1,0,2]=4 204 B4R0.1 C#CC(C)O MCULE-6692690957 [1,0,0,0,0,0|0,1,2]=4 205 B4R0.1 C#CC(C)O MCULE-8115962170 [1,0,0,0,0,0|0,1,2]=4 206 B4R0.1 C#C[C@@H](C)N MCULE-1688945745 [1,0,0,0,0,0|1,0,2]=4 207 B4R0.1 C#C[C@@H](C)N MCULE-2648127023 [1,0,0,0,0,0|1,0,2]=4 208 B4R0.1 C#C[C@@H](C)N MCULE-4450167680 [1,0,0,0,0,0|1,0,2]=4 209 B4R0.1 C#C[C@@H](C)N MCULE-5940189329 [1,0,0,0,0,0|1,0,2]=4 210 B4R0.1 C#C[C@@H](C)O MCULE-3014030718 [1,0,0,0,0,0|0,1,2]=4 211 B4R0.1 C#C[C@@H](C)O MCULE-5925379513 [1,0,0,0,0,0|0,1,2]=4 212 B4R0.1 C#C[C@H](C)N MCULE-1256303297 [1,0,0,0,0,0|1,0,2]=4 213 B4R0.1 C#C[C@H](C)N MCULE-4223264163 [1,0,0,0,0,0|1,0,2]=4 214 B4R0.1 C#C[C@H](C)N MCULE-9450573338 [1,0,0,0,0,0|1,0,2]=4 215 B4R0.1 C#C[C@H](C)N MCULE-9795039145 [1,0,0,0,0,0|1,0,2]=4 216 B4R0.1 C#C[C@H](C)O MCULE-3264536845 [1,0,0,0,0,0|0,1,2]=4 217 B4R0.1 C(C)(N)CN MCULE-5877041140 [1,0,0,0,0,0|2,0,0]=3 218 B4R0.1 C(C)(N)CO MCULE-5844242932 [1,0,0,0,0,0|1,1,0]=3 219 B4R0.1 C/C=C(/C)\Cl MCULE-6841426098 [1,0,0,0,0,0|1,0,2]=4 220 B4R0.1 C/C=C(\C)/Br MCULE-3045523462 [1,0,0,0,0,0|1,0,2]=4 221 B4R0.1 C/C=C(\C)/Cl MCULE-4683862502 [1,0,0,0,0,0|1,0,2]=4 222 B4R0.1 C=C(Br)CC MCULE-6271946451 [1,0,0,0,0,0|1,0,2]=4 223 B4R0.1 C=C(C)CBr MCULE-1361893863 [1,0,0,0,0,0|2,0,1]=4 224 B4R0.1 C=C(C)CCl MCULE-5586406339 [1,0,0,0,0,0|2,0,1]=4 225 B4R0.1 C=C(C)CI MCULE-3678124406 [1,0,0,0,0,0|2,0,1]=4 226 B4R0.1 C=C(C)CN MCULE-1033495975 [1,0,0,0,0,0|2,0,1]=4 227 B4R0.1 C=C(C)CN MCULE-8730181300 [1,0,0,0,0,0|2,0,1]=4 228 B4R0.1 C=C(C)CO MCULE-8641288398 [1,0,0,0,0,0|1,1,1]=4 229 B4R0.1 C=C(C)CS MCULE-5174170431 [1,0,0,0,0,0|1,0,1]=3 230 B4R0.1 C=C(C)OC MCULE-7344104255 [1,0,0,0,0,0|2,0,1]=4 231 B4R0.1 C=CC(C)Cl MCULE-1756172983 [1,0,0,0,0,0|1,0,2]=4 232 B4R0.1 C=CC(C)N MCULE-5748048106 [1,0,0,0,0,0|1,0,2]=4 233 B4R0.1 C=CC(C)N MCULE-6786590923 [1,0,0,0,0,0|1,0,2]=4 234 B4R0.1 C=CC(C)O MCULE-4525368256 [1,0,0,0,0,0|0,1,2]=4 235 B4R0.1 C=C[C@@H](C)N MCULE-4388444035 [1,0,0,0,0,0|1,0,2]=4 236 B4R0.1 C=C[C@@H](C)N MCULE-6107415849 [1,0,0,0,0,0|1,0,2]=4 237 B4R0.1 C=C[C@@H](C)N MCULE-6707490046 [1,0,0,0,0,0|1,0,2]=4 238 B4R0.1 C=C[C@@H](C)N MCULE-9654995108 [1,0,0,0,0,0|1,0,2]=4 239 B4R0.1 C=C[C@H](C)N MCULE-1396113041 [1,0,0,0,0,0|1,0,2]=4 240 B4R0.1 C=C[C@H](C)N MCULE-2197513722 [1,0,0,0,0,0|1,0,2]=4 241 B4R0.1 C=C[C@H](C)N MCULE-4698235480 [1,0,0,0,0,0|1,0,2]=4 242 B4R0.1 C=C[C@H](C)N MCULE-8745929233 [1,0,0,0,0,0|1,0,2]=4 243 B4R0.1 C=C[C@H](C)O MCULE-2251589245 [1,0,0,0,0,0|0,1,2]=4 244 B4R0.1 CC(=O)CBr MCULE-7812920675 [1,0,0,0,0,0|1,1,1]=4 245 B4R0.1 CC(=O)CCl MCULE-2501365933 [1,0,0,0,0,0|1,1,1]=4 246 B4R0.1 CC(=O)CF MCULE-7417279999 [1,0,0,0,0,0|1,1,1]=4 247 B4R0.1 CC(=O)CN MCULE-2715277783 [1,0,0,0,0,0|1,1,1]=4 248 B4R0.1 CC(=O)CN MCULE-6004541862 [1,0,0,0,0,0|1,1,1]=4 249 B4R0.1 CC(=O)CO MCULE-2989526028 [1,0,0,0,0,0|0,2,1]=4 250 B4R0.1 CC(=O)CS MCULE-9736174016 [1,0,0,0,0,0|0,1,1]=3 251 B4R0.1 CC(Br)C#N MCULE-2994851090 [1,0,0,0,0,0|2,0,1]=4 252 B4R0.1 CC(Br)C=O MCULE-6060704330 [1,0,0,0,0,0|1,1,1]=4 253 B4R0.1 CC(Br)CBr MCULE-6304574748 [1,0,0,0,0,0|2,0,0]=3 254 B4R0.1 CC(Br)CCl MCULE-8021380791 [1,0,0,0,0,0|2,0,0]=3 255 B4R0.1 CC(Br)CN MCULE-5214613046 [1,0,0,0,0,0|2,0,0]=3 256 B4R0.1 CC(Br)CN MCULE-6326218362 [1,0,0,0,0,0|2,0,0]=3 257 B4R0.1 CC(Br)CO MCULE-8344365003 [1,0,0,0,0,0|1,1,0]=3 258 B4R0.1 CC(C)C#N MCULE-8390118776 [1,0,0,0,0,0|2,0,1]=4 259 B4R0.1 CC(C)C=O MCULE-3575731904 [1,0,0,0,0,0|1,1,1]=4 260 B4R0.1 CC(C)CBr MCULE-6039420480 [1,0,0,0,0,0|2,0,0]=3 261 B4R0.1 CC(C)CCl MCULE-6524976746 [1,0,0,0,0,0|2,0,0]=3 262 B4R0.1 CC(C)CI MCULE-5280589461 [1,0,0,0,0,0|2,0,0]=3 263 B4R0.1 CC(C)CN MCULE-2158650588 [1,0,0,0,0,0|2,0,0]=3 264 B4R0.1 CC(C)CN MCULE-6751437658 [1,0,0,0,0,0|2,0,0]=3 265 B4R0.1 CC(C)CN MCULE-8319193456 [1,0,0,0,0,0|2,0,0]=3 266 B4R0.1 CC(C)CN MCULE-8705657065 [1,0,0,0,0,0|2,0,0]=3 267 B4R0.1 CC(C)CO MCULE-6294327194 [1,0,0,0,0,0|1,1,0]=3 268 B4R0.1 CC(C)CP MCULE-3724358658 [1,0,0,0,0,0|2,0,0]=3 269 B4R0.1 CC(C)CS MCULE-7978911055 [1,0,0,0,0,0|1,0,0]=2 270 B4R0.1 CC(C)NN MCULE-4673953224 [1,0,0,0,0,0|3,0,0]=4 271 B4R0.1 CC(C)NN MCULE-7901160798 [1,0,0,0,0,0|3,0,0]=4 272 B4R0.1 CC(C)NN MCULE-9473118288 [1,0,0,0,0,0|3,0,0]=4 273 B4R0.1 CC(C)NO MCULE-6516566403 [1,0,0,0,0,0|2,1,0]=4 274 B4R0.1 CC(C)NO MCULE-8545146035 [1,0,0,0,0,0|2,1,0]=4 275 B4R0.1 CC(C)ON MCULE-4063407094 [1,0,0,0,0,0|3,0,0]=4 276 B4R0.1 CC(C)ON MCULE-9108231771 [1,0,0,0,0,0|3,0,0]=4 277 B4R0.1 CC(C)O[NH3+] MCULE-7527132972 [1,0,0,0,0,0|3,0,0]=4 278 B4R0.1 CC(C)O[NH3+] MCULE-8847326857 [1,0,0,0,0,0|3,0,0]=4 279 B4R0.1 CC(Cl)C#N MCULE-9841634909 [1,0,0,0,0,0|2,0,1]=4 280 B4R0.1 CC(Cl)CBr MCULE-8474943880 [1,0,0,0,0,0|2,0,0]=3 281 B4R0.1 CC(Cl)CCl MCULE-1548912109 [1,0,0,0,0,0|2,0,0]=3 282 B4R0.1 CC(Cl)CN MCULE-2637316379 [1,0,0,0,0,0|2,0,0]=3 283 B4R0.1 CC(Cl)CN MCULE-5591419030 [1,0,0,0,0,0|2,0,0]=3 284 B4R0.1 CC(Cl)CO MCULE-3857255988 [1,0,0,0,0,0|1,1,0]=3 285 B4R0.1 CC(Cl)CO MCULE-7538548427 [1,0,0,0,0,0|1,1,0]=3 286 B4R0.1 CC(F)CN MCULE-6584490651 [1,0,0,0,0,0|2,0,0]=3 287 B4R0.1 CC(F)CN MCULE-9499916116 [1,0,0,0,0,0|2,0,0]=3 288 B4R0.1 CC(F)CO MCULE-6006763378 [1,0,0,0,0,0|1,1,0]=3 289 B4R0.1 CC(N)C#N MCULE-4008524363 [1,0,0,0,0,0|2,0,1]=4 290 B4R0.1 CC(N)C#N MCULE-8654767875 [1,0,0,0,0,0|2,0,1]=4 291 B4R0.1 CC(N)C=O MCULE-3421118418 [1,0,0,0,0,0|1,1,1]=4 292 B4R0.1 CC(N)CBr MCULE-1783493149 [1,0,0,0,0,0|2,0,0]=3 293 B4R0.1 CC(N)CBr MCULE-2775398297 [1,0,0,0,0,0|2,0,0]=3 294 B4R0.1 CC(N)CCl MCULE-8652434595 [1,0,0,0,0,0|2,0,0]=3 295 B4R0.1 CC(N)CCl MCULE-9580466630 [1,0,0,0,0,0|2,0,0]=3 296 B4R0.1 CC(N)CF MCULE-1603143200 [1,0,0,0,0,0|2,0,0]=3 297 B4R0.1 CC(N)CF MCULE-3787216870 [1,0,0,0,0,0|2,0,0]=3 298 B4R0.1 CC(N)CF MCULE-4138869746 [1,0,0,0,0,0|2,0,0]=3 299 B4R0.1 CC(N)CF MCULE-8611760275 [1,0,0,0,0,0|2,0,0]=3 300 B4R0.1 CC(N)CN MCULE-2119036110 [1,0,0,0,0,0|2,0,0]=3 301 B4R0.1 CC(N)CN MCULE-6286216576 [1,0,0,0,0,0|2,0,0]=3 302 B4R0.1 CC(N)CN MCULE-9919433465 [1,0,0,0,0,0|2,0,0]=3 303 B4R0.1 CC(N)CO MCULE-1361379423 [1,0,0,0,0,0|1,1,0]=3 304 B4R0.1 CC(N)CO MCULE-2098440985 [1,0,0,0,0,0|1,1,0]=3 305 B4R0.1 CC(N)CS MCULE-1396853557 [1,0,0,0,0,0|1,0,0]=2 306 B4R0.1 CC(N)CS MCULE-4094732666 [1,0,0,0,0,0|1,0,0]=2 307 B4R0.1 CC(O)C#N MCULE-3166802314 [1,0,0,0,0,0|1,1,1]=4 308 B4R0.1 CC(O)CBr MCULE-7835094737 [1,0,0,0,0,0|1,1,0]=3 309 B4R0.1 CC(O)CCl MCULE-9140807958 [1,0,0,0,0,0|1,1,0]=3 310 B4R0.1 CC(O)CF MCULE-1023052065 [1,0,0,0,0,0|1,1,0]=3 311 B4R0.1 CC(O)CN MCULE-4370440652 [1,0,0,0,0,0|1,1,0]=3 312 B4R0.1 CC(O)CN MCULE-5694317743 [1,0,0,0,0,0|1,1,0]=3 313 B4R0.1 CC(O)CN MCULE-6406041538 [1,0,0,0,0,0|1,1,0]=3 314 B4R0.1 CC(O)CN MCULE-6636652305 [1,0,0,0,0,0|1,1,0]=3 315 B4R0.1 CC(O)CO MCULE-5574440784 [1,0,0,0,0,0|0,2,0]=3 316 B4R0.1 CC(O)CO MCULE-8743139013 [1,0,0,0,0,0|0,2,0]=3 317 B4R0.1 CC(O)CS MCULE-7881083356 [1,0,0,0,0,0|0,1,0]=2 318 B4R0.1 CC(O)C[NH3+] MCULE-6871369474 [1,0,0,0,0,0|1,1,0]=3 319 B4R0.1 CC(S)CN MCULE-1957568322 [1,0,0,0,0,0|1,0,0]=2 320 B4R0.1 CC(S)CN MCULE-7469442412 [1,0,0,0,0,0|1,0,0]=2 321 B4R0.1 CC(S)CO MCULE-5090908062 [1,0,0,0,0,0|0,1,0]=2 322 B4R0.1 CC(S)CS MCULE-9264694858 [1,0,0,0,0,0|0,0,0]=1 323 B4R0.1 CC=C(C)Br MCULE-1371905211 [1,0,0,0,0,0|1,0,2]=4 324 B4R0.1 CC=C(C)C MCULE-4230157245 [1,0,0,0,0,0|1,0,2]=4 325 B4R0.1 CC=C(C)Cl MCULE-3844314543 [1,0,0,0,0,0|1,0,2]=4 326 B4R0.1 CCB(O)O MCULE-1650960999 [1,0,0,0,0,0|2,1,0]=4 327 B4R0.1 CCC(=N)N MCULE-1856575742 [1,0,0,0,0,0|2,0,1]=4 328 B4R0.1 CCC(=N)N MCULE-2534386807 [1,0,0,0,0,0|2,0,1]=4 329 B4R0.1 CCC(=O)Br MCULE-7870678619 [1,0,0,0,0,0|1,1,1]=4 330 B4R0.1 CCC(=O)C MCULE-8276670748 [1,0,0,0,0,0|0,1,1]=3 331 B4R0.1 CCC(=O)Cl MCULE-3081874391 [1,0,0,0,0,0|1,1,1]=4 332 B4R0.1 CCC(=O)F MCULE-8783887670 [1,0,0,0,0,0|1,1,1]=4 333 B4R0.1 CCC(=O)N MCULE-3730796130 [1,0,0,0,0,0|1,1,1]=4 334 B4R0.1 CCC(=O)O MCULE-2199051150 [1,0,0,0,0,0|1,1,1]=4 335 B4R0.1 CCC(=O)O MCULE-9800054040 [1,0,0,0,0,0|1,1,1]=4 336 B4R0.1 CCC(=O)S MCULE-3392119766 [1,0,0,0,0,0|1,0,1]=3 337 B4R0.1 CCC(=O)[O-] MCULE-6321502767 [1,0,0,0,0,0|1,1,1]=4 338 B4R0.1 CCC(=S)N MCULE-3921479699 [1,0,0,0,0,0|1,0,2]=4 339 B4R0.1 CCC(C)Br MCULE-9661620259 [1,0,0,0,0,0|1,0,0]=2 340 B4R0.1 CCC(C)C MCULE-5376105936 [1,0,0,0,0,0|1,0,0]=2 341 B4R0.1 CCC(C)Cl MCULE-2954418486 [1,0,0,0,0,0|1,0,0]=2 342 B4R0.1 CCC(C)I MCULE-5239699587 [1,0,0,0,0,0|1,0,0]=2 343 B4R0.1 CCC(C)N MCULE-5041676035 [1,0,0,0,0,0|1,0,0]=2 344 B4R0.1 CCC(C)N MCULE-5835091553 [1,0,0,0,0,0|1,0,0]=2 345 B4R0.1 CCC(C)N MCULE-6631606230 [1,0,0,0,0,0|1,0,0]=2 346 B4R0.1 CCC(C)N MCULE-8165681721 [1,0,0,0,0,0|1,0,0]=2 347 B4R0.1 CCC(C)O MCULE-4099350806 [1,0,0,0,0,0|0,1,0]=2 348 B4R0.1 CCC(C)O MCULE-5005120003 [1,0,0,0,0,0|0,1,0]=2 349 B4R0.1 CCC(C)S MCULE-4988033753 [1,0,0,0,0,0|0,0,0]=1 350 B4R0.1 CCN(=O)=O MCULE-6603591614 [1,0,0,0,0,0|2,1,0]=4 351 B4R0.1 CCN(C)C MCULE-5825033552 [1,0,0,0,0,0|2,0,0]=3 352 B4R0.1 CCN(C)N MCULE-2279492356 [1,0,0,0,0,0|2,0,0]=3 353 B4R0.1 CCN(C)N MCULE-5660338703 [1,0,0,0,0,0|2,0,0]=3 354 B4R0.1 CCN(C)N MCULE-9839987578 [1,0,0,0,0,0|2,0,0]=3 355 B4R0.1 CCS(=O)C MCULE-4400935745 [1,0,0,0,0,0|1,1,0]=3 356 B4R0.1 CCS(=O)O MCULE-9872932319 [1,0,0,0,0,0|2,1,0]=4 357 B4R0.1 CCS(=O)[O-] MCULE-4386198822 [1,0,0,0,0,0|2,1,0]=4 358 B4R0.1 CC[C@@H](C)N MCULE-2017255826 [1,0,0,0,0,0|1,0,0]=2 359 B4R0.1 CC[C@@H](C)N MCULE-3555707512 [1,0,0,0,0,0|1,0,0]=2 360 B4R0.1 CC[C@@H](C)N MCULE-6783735598 [1,0,0,0,0,0|1,0,0]=2 361 B4R0.1 CC[C@@H](C)N MCULE-7004219201 [1,0,0,0,0,0|1,0,0]=2 362 B4R0.1 CC[C@@H](C)O MCULE-2661481448 [1,0,0,0,0,0|0,1,0]=2 363 B4R0.1 CC[C@@H](C)O MCULE-6785232833 [1,0,0,0,0,0|0,1,0]=2 364 B4R0.1 CC[C@H](C)N MCULE-2450201533 [1,0,0,0,0,0|1,0,0]=2 365 B4R0.1 CC[C@H](C)N MCULE-2998961427 [1,0,0,0,0,0|1,0,0]=2 366 B4R0.1 CC[C@H](C)N MCULE-6692190471 [1,0,0,0,0,0|1,0,0]=2 367 B4R0.1 CC[C@H](C)N MCULE-6904795465 [1,0,0,0,0,0|1,0,0]=2 368 B4R0.1 CC[C@H](C)O MCULE-3700911573 [1,0,0,0,0,0|0,1,0]=2 369 B4R0.1 CC[C@H](C)O MCULE-6063716138 [1,0,0,0,0,0|0,1,0]=2 370 B4R0.1 CN(C)CCl MCULE-4906480184 [1,0,0,0,0,0|3,0,0]=4 371 B4R0.1 CN(C)CCl MCULE-5465672480 [1,0,0,0,0,0|3,0,0]=4 372 B4R0.1 CNC(=O)C MCULE-2612997941 [1,0,0,0,0,0|1,1,1]=4 373 B4R0.1 CNC(=S)C MCULE-8699171591 [1,0,0,0,0,0|1,0,2]=4 374 B4R0.1 CNC(C)C MCULE-3849513543 [1,0,0,0,0,0|2,0,0]=3 375 B4R0.1 CNN(C)C MCULE-7120869955 [1,0,0,0,0,0|3,0,0]=4 376 B4R0.1 CNN(C)C MCULE-8318926099 [1,0,0,0,0,0|3,0,0]=4 377 B4R0.1 COC(=N)C MCULE-2752794913 [1,0,0,0,0,0|2,0,1]=4 378 B4R0.1 COC(=N)C MCULE-2904991083 [1,0,0,0,0,0|2,0,1]=4 379 B4R0.1 COC(=O)C MCULE-7368066093 [1,0,0,0,0,0|1,1,1]=4 380 B4R0.1 COC(C)Cl MCULE-9043930044 [1,0,0,0,0,0|2,0,0]=3 381 B4R0.1 COC(Cl)Cl MCULE-7296291650 [1,0,0,0,0,0|3,0,0]=4 382 B4R0.1 CSC(=O)C MCULE-7061634598 [1,0,0,0,0,0|1,1,1]=4 383 B4R0.1 CSC(=S)C MCULE-4836153374 [1,0,0,0,0,0|1,0,2]=4 384 B4R0.1 CSC(C)C MCULE-5932565699 [1,0,0,0,0,0|2,0,0]=3 385 B4R0.1 CSS(=O)C MCULE-6515592458 [1,0,0,0,0,0|2,1,0]=4 386 B4R0.1 CS[S+](C)C MCULE-1869043585 [1,0,0,0,0,0|3,0,0]=4 387 B4R0.1 CS[S+](C)C MCULE-4164877790 [1,0,0,0,0,0|3,0,0]=4 388 B4R0.1 C[C@@H](Cl)CO MCULE-4834664531 [1,0,0,0,0,0|1,1,0]=3 389 B4R0.1 C[C@@H](Cl)CO MCULE-8797955903 [1,0,0,0,0,0|1,1,0]=3 390 B4R0.1 C[C@@H](F)CO MCULE-3312305972 [1,0,0,0,0,0|1,1,0]=3 391 B4R0.1 C[C@@H](F)CO MCULE-4754825872 [1,0,0,0,0,0|1,1,0]=3 392 B4R0.1 C[C@@H](N)C#N MCULE-4366493733 [1,0,0,0,0,0|2,0,1]=4 393 B4R0.1 C[C@@H](N)C#N MCULE-4475438132 [1,0,0,0,0,0|2,0,1]=4 394 B4R0.1 C[C@@H](N)C#N MCULE-8152568021 [1,0,0,0,0,0|2,0,1]=4 395 B4R0.1 C[C@@H](N)C#N MCULE-9327848803 [1,0,0,0,0,0|2,0,1]=4 396 B4R0.1 C[C@@H](N)CF MCULE-2227343602 [1,0,0,0,0,0|2,0,0]=3 397 B4R0.1 C[C@@H](N)CF MCULE-2283243747 [1,0,0,0,0,0|2,0,0]=3 398 B4R0.1 C[C@@H](N)CF MCULE-6326763354 [1,0,0,0,0,0|2,0,0]=3 399 B4R0.1 C[C@@H](N)CF MCULE-6630824972 [1,0,0,0,0,0|2,0,0]=3 400 B4R0.1 C[C@@H](N)CN MCULE-5207840256 [1,0,0,0,0,0|2,0,0]=3 401 B4R0.1 C[C@@H](N)CN MCULE-5332214014 [1,0,0,0,0,0|2,0,0]=3 402 B4R0.1 C[C@@H](N)CN MCULE-7816211809 [1,0,0,0,0,0|2,0,0]=3 403 B4R0.1 C[C@@H](N)CN MCULE-7982492466 [1,0,0,0,0,0|2,0,0]=3 404 B4R0.1 C[C@@H](N)CO MCULE-5655560645 [1,0,0,0,0,0|1,1,0]=3 405 B4R0.1 C[C@@H](N)CO MCULE-8066658004 [1,0,0,0,0,0|1,1,0]=3 406 B4R0.1 C[C@@H](O)C=O MCULE-5921136435 [1,0,0,0,0,0|0,2,1]=4 407 B4R0.1 C[C@@H](O)CCl MCULE-4669677883 [1,0,0,0,0,0|1,1,0]=3 408 B4R0.1 C[C@@H](O)CCl MCULE-7670590902 [1,0,0,0,0,0|1,1,0]=3 409 B4R0.1 C[C@@H](O)CN MCULE-9301041927 [1,0,0,0,0,0|1,1,0]=3 410 B4R0.1 C[C@@H](O)CO MCULE-4464598400 [1,0,0,0,0,0|0,2,0]=3 411 B4R0.1 C[C@@H](O)CO MCULE-9914833832 [1,0,0,0,0,0|0,2,0]=3 412 B4R0.1 C[C@@H](O)CS MCULE-8817452889 [1,0,0,0,0,0|0,1,0]=2 413 B4R0.1 C[C@H](Cl)CO MCULE-6747279587 [1,0,0,0,0,0|1,1,0]=3 414 B4R0.1 C[C@H](Cl)CO MCULE-8509218918 [1,0,0,0,0,0|1,1,0]=3 415 B4R0.1 C[C@H](F)CO MCULE-1024261541 [1,0,0,0,0,0|1,1,0]=3 416 B4R0.1 C[C@H](F)CO MCULE-7028098137 [1,0,0,0,0,0|1,1,0]=3 417 B4R0.1 C[C@H](N)C#N MCULE-2449963253 [1,0,0,0,0,0|2,0,1]=4 418 B4R0.1 C[C@H](N)C#N MCULE-3624286995 [1,0,0,0,0,0|2,0,1]=4 419 B4R0.1 C[C@H](N)CF MCULE-1053227516 [1,0,0,0,0,0|2,0,0]=3 420 B4R0.1 C[C@H](N)CF MCULE-4024916343 [1,0,0,0,0,0|2,0,0]=3 421 B4R0.1 C[C@H](N)CF MCULE-6312285034 [1,0,0,0,0,0|2,0,0]=3 422 B4R0.1 C[C@H](N)CF MCULE-7630744199 [1,0,0,0,0,0|2,0,0]=3 423 B4R0.1 C[C@H](N)CN MCULE-2048837128 [1,0,0,0,0,0|2,0,0]=3 424 B4R0.1 C[C@H](N)CN MCULE-4105152552 [1,0,0,0,0,0|2,0,0]=3 425 B4R0.1 C[C@H](N)CN MCULE-7106390536 [1,0,0,0,0,0|2,0,0]=3 426 B4R0.1 C[C@H](N)CN MCULE-9863306005 [1,0,0,0,0,0|2,0,0]=3 427 B4R0.1 C[C@H](N)CO MCULE-2471107013 [1,0,0,0,0,0|1,1,0]=3 428 B4R0.1 C[C@H](N)CO MCULE-5424195678 [1,0,0,0,0,0|1,1,0]=3 429 B4R0.1 C[C@H](O)CCl MCULE-3018109825 [1,0,0,0,0,0|1,1,0]=3 430 B4R0.1 C[C@H](O)CCl MCULE-5836677540 [1,0,0,0,0,0|1,1,0]=3 431 B4R0.1 C[C@H](O)CN MCULE-3227371869 [1,0,0,0,0,0|1,1,0]=3 432 B4R0.1 C[C@H](O)CN MCULE-5480489257 [1,0,0,0,0,0|1,1,0]=3 433 B4R0.1 C[C@H](O)CO MCULE-6582852191 [1,0,0,0,0,0|0,2,0]=3 434 B4R0.1 C[C@H](O)CO MCULE-8074793296 [1,0,0,0,0,0|0,2,0]=3 435 B4R0.1 C[C@H](O)CS MCULE-9061842733 [1,0,0,0,0,0|0,1,0]=2 436 B4R0.1 ClC(Br)CBr MCULE-4330156086 [1,0,0,0,0,0|3,0,0]=4 437 B4R0.1 ClC(Cl)CBr MCULE-8368261609 [1,0,0,0,0,0|3,0,0]=4 438 B4R0.1 ClCC(Cl)Cl MCULE-9302905435 [1,0,0,0,0,0|3,0,0]=4 439 B4R0.1 FC(Br)CBr MCULE-2977436061 [1,0,0,0,0,0|3,0,0]=4 440 B4R0.1 FC(Cl)CCl MCULE-6531960916 [1,0,0,0,0,0|3,0,0]=4 441 B4R0.1 FC(F)CBr MCULE-5166579689 [1,0,0,0,0,0|3,0,0]=4 442 B4R0.1 FC(F)CI MCULE-4051435294 [1,0,0,0,0,0|3,0,0]=4 443 B4R0.1 FCC(F)Cl MCULE-7439685421 [1,0,0,0,0,0|3,0,0]=4 444 B4R0.1 NC(=O)CS MCULE-2639305532 [1,0,0,0,0,0|1,1,1]=4 445 B4R0.1 NCC(=O)S MCULE-9837799864 [1,0,0,0,0,0|2,0,1]=4 446 B4R0.1 NCC(Cl)Cl MCULE-6022785182 [1,0,0,0,0,0|3,0,0]=4 447 B4R0.1 NCC(Cl)Cl MCULE-8181626787 [1,0,0,0,0,0|3,0,0]=4 448 B4R0.1 NCC(F)F MCULE-5562582586 [1,0,0,0,0,0|3,0,0]=4 449 B4R0.1 NCC(F)F MCULE-9437628707 [1,0,0,0,0,0|3,0,0]=4 450 B4R0.1 O=C(O)CS MCULE-8097997001 [1,0,0,0,0,0|1,1,1]=4 451 B4R0.1 O=C([O-])CS MCULE-3314809220 [1,0,0,0,0,0|1,1,1]=4 452 B4R0.1 O=C([O-])CS MCULE-5989133747 [1,0,0,0,0,0|1,1,1]=4 453 B4R0.1 OCC(Cl)Cl MCULE-3279441180 [1,0,0,0,0,0|2,1,0]=4 454 B4R0.1 OCC(F)Br MCULE-5466660542 [1,0,0,0,0,0|2,1,0]=4 455 B4R0.1 OCC(F)F MCULE-3252378943 [1,0,0,0,0,0|2,1,0]=4 456 B4R0.1 [C@@H](C)(O)C#C MCULE-8971134855 [1,0,0,0,0,0|0,1,2]=4 457 B4R0.1 [C@H](C)(O)CN MCULE-8212000072 [1,0,0,0,0,0|1,1,0]=3 458 B4R0.1 [NH3+]C(C)CC MCULE-3066898055 [1,0,0,0,0,0|1,0,0]=2 459 B6R0.3 C#CC(N)C(C)C MCULE-3430729891 [0,1,0,0,0,0|2,0,1]=4 460 B6R0.3 C#CC(N)C(C)C MCULE-7604887558 [0,1,0,0,0,0|2,0,1]=4 461 B6R0.3 C#CC(O)C(C)C MCULE-6729964061 [0,1,0,0,0,0|1,1,1]=4 462 B6R0.3 C#C[C@@H](O)C(C)C MCULE-2957798079 [0,1,0,0,0,0|1,1,1]=4 463 B6R0.3 C#C[C@H](O)C(C)C MCULE-7477457472 [0,1,0,0,0,0|1,1,1]=4 464 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [0,1,0,0,0,0|2,0,1]=4 465 B6R0.3 C=CC(C)C(C)C MCULE-4461669612 [0,1,0,0,0,0|2,0,0]=3 466 B6R0.3 C=CC(C)C(C)O MCULE-5639096655 [0,1,0,0,0,0|1,1,0]=3 467 B6R0.3 C=CC(O)C(C)C MCULE-2504249276 [0,1,0,0,0,0|1,1,1]=4 468 B6R0.3 C=C[C@@H](C)[C@@H](C)O MCULE-1946110265 [0,1,0,0,0,0|1,1,0]=3 469 B6R0.3 C=C[C@@H](C)[C@@H](C)O MCULE-2042493608 [0,1,0,0,0,0|1,1,0]=3 470 B6R0.3 C=C[C@@H](C)[C@H](C)O MCULE-1482556738 [0,1,0,0,0,0|1,1,0]=3 471 B6R0.3 C=C[C@H](C)[C@@H](C)O MCULE-4591189626 [0,1,0,0,0,0|1,1,0]=3 472 B6R0.3 C=C[C@H](C)[C@H](C)O MCULE-2180884086 [0,1,0,0,0,0|1,1,0]=3 473 B6R0.3 C=C[C@H](C)[C@H](C)O MCULE-2347920403 [0,1,0,0,0,0|1,1,0]=3 474 B6R0.3 CC(=O)C(C)C#N MCULE-3849364002 [0,1,0,0,0,0|1,1,1]=4 475 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [0,1,0,0,0,0|0,2,1]=4 476 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [0,1,0,0,0,0|0,2,1]=4 477 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [0,1,0,0,0,0|1,1,1]=4 478 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [0,1,0,0,0,0|1,1,1]=4 479 B6R0.3 CC(Br)C(O)C#N MCULE-5520123598 [0,1,0,0,0,0|1,1,1]=4 480 B6R0.3 CC(C#N)N(C)C MCULE-5893415129 [0,1,0,0,0,0|3,0,0]=4 481 B6R0.3 CC(C)C(=O)CBr MCULE-5913227185 [0,1,0,0,0,0|1,1,1]=4 482 B6R0.3 CC(C)C(=O)CCl MCULE-4093256141 [0,1,0,0,0,0|1,1,1]=4 483 B6R0.3 CC(C)C(=O)CN MCULE-6091425997 [0,1,0,0,0,0|1,1,1]=4 484 B6R0.3 CC(C)C(=O)CN MCULE-7368122425 [0,1,0,0,0,0|1,1,1]=4 485 B6R0.3 CC(C)C(=O)CO MCULE-8746789873 [0,1,0,0,0,0|1,1,1]=4 486 B6R0.3 CC(C)C(Br)C#N MCULE-3045325666 [0,1,0,0,0,0|2,0,1]=4 487 B6R0.3 CC(C)C(Br)C=O MCULE-2054791376 [0,1,0,0,0,0|2,0,1]=4 488 B6R0.3 CC(C)C(C)CBr MCULE-4323135623 [0,1,0,0,0,0|2,0,0]=3 489 B6R0.3 CC(C)C(C)CN MCULE-1011041652 [0,1,0,0,0,0|2,0,0]=3 490 B6R0.3 CC(C)C(C)CN MCULE-5682817467 [0,1,0,0,0,0|2,0,0]=3 491 B6R0.3 CC(C)C(C)CO MCULE-7008552664 [0,1,0,0,0,0|1,1,0]=3 492 B6R0.3 CC(C)C(C)NN MCULE-3145633578 [0,1,0,0,0,0|2,0,0]=3 493 B6R0.3 CC(C)C(C)NN MCULE-5160672778 [0,1,0,0,0,0|2,0,0]=3 494 B6R0.3 CC(C)C(C)NN MCULE-7702836838 [0,1,0,0,0,0|2,0,0]=3 495 B6R0.3 CC(C)C(Cl)C#N MCULE-5102063658 [0,1,0,0,0,0|2,0,1]=4 496 B6R0.3 CC(C)C(N)C#N MCULE-5486541909 [0,1,0,0,0,0|2,0,1]=4 497 B6R0.3 CC(C)C(N)C#N MCULE-6250354053 [0,1,0,0,0,0|2,0,1]=4 498 B6R0.3 CC(C)C(N)CF MCULE-4101575579 [0,1,0,0,0,0|2,0,0]=3 499 B6R0.3 CC(C)C(N)CF MCULE-4888178244 [0,1,0,0,0,0|2,0,0]=3 500 B6R0.3 CC(C)C(N)CN MCULE-3414430422 [0,1,0,0,0,0|2,0,0]=3 501 B6R0.3 CC(C)C(N)CN MCULE-5279153780 [0,1,0,0,0,0|2,0,0]=3 502 B6R0.3 CC(C)C(N)CO MCULE-2361921763 [0,1,0,0,0,0|2,0,0]=3 503 B6R0.3 CC(C)C(N)CO MCULE-2989454077 [0,1,0,0,0,0|2,0,0]=3 504 B6R0.3 CC(C)C(N)CO MCULE-9793548365 [0,1,0,0,0,0|2,0,0]=3 505 B6R0.3 CC(C)C(O)C#N MCULE-1764798154 [0,1,0,0,0,0|1,1,1]=4 506 B6R0.3 CC(C)C(O)CBr MCULE-1921145212 [0,1,0,0,0,0|1,1,0]=3 507 B6R0.3 CC(C)C(O)CCl MCULE-7270676495 [0,1,0,0,0,0|1,1,0]=3 508 B6R0.3 CC(C)C(O)CN MCULE-3560246402 [0,1,0,0,0,0|1,1,0]=3 509 B6R0.3 CC(C)C(O)CN MCULE-9420842607 [0,1,0,0,0,0|1,1,0]=3 510 B6R0.3 CC(C)C(O)CO MCULE-6069815474 [0,1,0,0,0,0|1,1,0]=3 511 B6R0.3 CC(C)C(S)CO MCULE-1903780493 [0,1,0,0,0,0|1,0,0]=2 512 B6R0.3 CC(C)N(C)N=O MCULE-3797884338 [0,1,0,0,0,0|2,1,0]=4 513 B6R0.3 CC(C)[C@@H](C)CO MCULE-4943691177 [0,1,0,0,0,0|1,1,0]=3 514 B6R0.3 CC(C)[C@@H](C)CO MCULE-6583781047 [0,1,0,0,0,0|1,1,0]=3 515 B6R0.3 CC(C)[C@@H](N)C#N MCULE-3710740145 [0,1,0,0,0,0|2,0,1]=4 516 B6R0.3 CC(C)[C@@H](N)C#N MCULE-6831295533 [0,1,0,0,0,0|2,0,1]=4 517 B6R0.3 CC(C)[C@@H](N)CF MCULE-7429178470 [0,1,0,0,0,0|2,0,0]=3 518 B6R0.3 CC(C)[C@@H](N)CF MCULE-7951488806 [0,1,0,0,0,0|2,0,0]=3 519 B6R0.3 CC(C)[C@@H](N)CO MCULE-1135743088 [0,1,0,0,0,0|2,0,0]=3 520 B6R0.3 CC(C)[C@@H](N)CO MCULE-3994511291 [0,1,0,0,0,0|2,0,0]=3 521 B6R0.3 CC(C)[C@H](C)CO MCULE-9527582465 [0,1,0,0,0,0|1,1,0]=3 522 B6R0.3 CC(C)[C@H](N)C#N MCULE-6519039369 [0,1,0,0,0,0|2,0,1]=4 523 B6R0.3 CC(C)[C@H](N)C#N MCULE-8475611484 [0,1,0,0,0,0|2,0,1]=4 524 B6R0.3 CC(C)[C@H](N)C=O MCULE-6686967175 [0,1,0,0,0,0|2,0,1]=4 525 B6R0.3 CC(C)[C@H](N)CF MCULE-2978082368 [0,1,0,0,0,0|2,0,0]=3 526 B6R0.3 CC(C)[C@H](N)CF MCULE-4609473233 [0,1,0,0,0,0|2,0,0]=3 527 B6R0.3 CC(C)[C@H](N)CN MCULE-2884084983 [0,1,0,0,0,0|2,0,0]=3 528 B6R0.3 CC(C)[C@H](N)CO MCULE-2625936994 [0,1,0,0,0,0|2,0,0]=3 529 B6R0.3 CC(C)[C@H](N)CO MCULE-3229973889 [0,1,0,0,0,0|2,0,0]=3 530 B6R0.3 CC(C)[C@H](N)CO MCULE-6090001117 [0,1,0,0,0,0|2,0,0]=3 531 B6R0.3 CC(C)[C@H](N)CO MCULE-8284816696 [0,1,0,0,0,0|2,0,0]=3 532 B6R0.3 CC(CCl)N(C)C MCULE-1058476958 [0,1,0,0,0,0|3,0,0]=4 533 B6R0.3 CC(CCl)N(C)C MCULE-3515287037 [0,1,0,0,0,0|3,0,0]=4 534 B6R0.3 CC(CN)C(F)F MCULE-3764511329 [0,1,0,0,0,0|3,0,0]=4 535 B6R0.3 CC(CN)C(F)F MCULE-3885392808 [0,1,0,0,0,0|3,0,0]=4 536 B6R0.3 CC(CN)N(C)C MCULE-1383449400 [0,1,0,0,0,0|3,0,0]=4 537 B6R0.3 CC(CN)N(C)C MCULE-9891789912 [0,1,0,0,0,0|3,0,0]=4 538 B6R0.3 CC(CN)S(=O)C MCULE-9048112625 [0,1,0,0,0,0|2,1,0]=4 539 B6R0.3 CC(CO)N(C)C MCULE-7300076854 [0,1,0,0,0,0|2,1,0]=4 540 B6R0.3 CC(CO)N(C)N MCULE-8306784573 [0,1,0,0,0,0|2,1,0]=4 541 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [0,1,0,0,0,0|1,1,1]=4 542 B6R0.3 CC(Cl)C(O)CCl MCULE-5399761987 [0,1,0,0,0,0|1,1,0]=3 543 B6R0.3 CC(N)C(C)CO MCULE-8179225289 [0,1,0,0,0,0|1,1,0]=3 544 B6R0.3 CC(N)C(O)CO MCULE-8191126136 [0,1,0,0,0,0|1,1,0]=3 545 B6R0.3 CC(O)C(C)C#N MCULE-2580244921 [0,1,0,0,0,0|1,1,0]=3 546 B6R0.3 CC(O)C(C)CN MCULE-5251700993 [0,1,0,0,0,0|1,1,0]=3 547 B6R0.3 CC(O)C(C)CO MCULE-4061946423 [0,1,0,0,0,0|0,2,0]=3 548 B6R0.3 CC(O)C(N)CN MCULE-2787573482 [0,1,0,0,0,0|1,1,0]=3 549 B6R0.3 CC(O)C(N)CN MCULE-5330950433 [0,1,0,0,0,0|1,1,0]=3 550 B6R0.3 CC(O)C(N)CO MCULE-7733336449 [0,1,0,0,0,0|1,1,0]=3 551 B6R0.3 CC(O)C(O)CN MCULE-6591390331 [0,1,0,0,0,0|0,2,0]=3 552 B6R0.3 CC(O)C(O)CO MCULE-1795053551 [0,1,0,0,0,0|0,2,0]=3 553 B6R0.3 CC(S)C(C)CO MCULE-5435813701 [0,1,0,0,0,0|0,1,0]=2 554 B6R0.3 CC=C(C)C(C)C MCULE-4070109813 [0,1,0,0,0,0|2,0,1]=4 555 B6R0.3 CCC(=O)C(C)Br MCULE-2803556971 [0,1,0,0,0,0|1,1,1]=4 556 B6R0.3 CCC(=O)C(C)C MCULE-9576230007 [0,1,0,0,0,0|1,1,1]=4 557 B6R0.3 CCC(=O)C(C)Cl MCULE-8346980404 [0,1,0,0,0,0|1,1,1]=4 558 B6R0.3 CCC(=O)C(C)N MCULE-5434634349 [0,1,0,0,0,0|1,1,1]=4 559 B6R0.3 CCC(=O)C(C)N MCULE-8408562669 [0,1,0,0,0,0|1,1,1]=4 560 B6R0.3 CCC(=O)C(C)O MCULE-4144791660 [0,1,0,0,0,0|0,2,1]=4 561 B6R0.3 CCC(=O)C(C)S MCULE-3934356624 [0,1,0,0,0,0|0,1,1]=3 562 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [0,1,0,0,0,0|1,1,1]=4 563 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [0,1,0,0,0,0|1,1,1]=4 564 B6R0.3 CCC(C)C(C)Br MCULE-5368409335 [0,1,0,0,0,0|2,0,0]=3 565 B6R0.3 CCC(C)C(C)C MCULE-9189749509 [0,1,0,0,0,0|2,0,0]=3 566 B6R0.3 CCC(C)C(C)Cl MCULE-2663176330 [0,1,0,0,0,0|2,0,0]=3 567 B6R0.3 CCC(C)C(C)N MCULE-1056466337 [0,1,0,0,0,0|2,0,0]=3 568 B6R0.3 CCC(C)C(C)N MCULE-1503543126 [0,1,0,0,0,0|2,0,0]=3 569 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [0,1,0,0,0,0|1,1,0]=3 570 B6R0.3 CCC(N)C(C)C MCULE-3624338196 [0,1,0,0,0,0|2,0,0]=3 571 B6R0.3 CCC(N)C(C)C MCULE-4491326477 [0,1,0,0,0,0|2,0,0]=3 572 B6R0.3 CCC(N)C(C)O MCULE-2752432664 [0,1,0,0,0,0|1,1,0]=3 573 B6R0.3 CCC(N)C(C)O MCULE-6087590428 [0,1,0,0,0,0|1,1,0]=3 574 B6R0.3 CCC(N)C(F)F MCULE-3079670807 [0,1,0,0,0,0|3,0,0]=4 575 B6R0.3 CCC(N)C(F)F MCULE-4157824434 [0,1,0,0,0,0|3,0,0]=4 576 B6R0.3 CCC(O)C(C)C MCULE-1130775455 [0,1,0,0,0,0|1,1,0]=3 577 B6R0.3 CCC(O)C(C)N MCULE-4027170059 [0,1,0,0,0,0|1,1,0]=3 578 B6R0.3 CCC(O)C(C)O MCULE-1468922095 [0,1,0,0,0,0|0,2,0]=3 579 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [0,1,0,0,0,0|0,1,1]=3 580 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [0,1,0,0,0,0|1,1,1]=4 581 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-8294520512 [0,1,0,0,0,0|1,1,0]=3 582 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-9521001934 [0,1,0,0,0,0|1,1,0]=3 583 B6R0.3 CC[C@@H](O)C(C)C MCULE-3684327261 [0,1,0,0,0,0|1,1,0]=3 584 B6R0.3 CC[C@H](N)C(C)C MCULE-3200638239 [0,1,0,0,0,0|2,0,0]=3 585 B6R0.3 CC[C@H](N)C(C)C MCULE-4973720203 [0,1,0,0,0,0|2,0,0]=3 586 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-1930738992 [0,1,0,0,0,0|1,1,0]=3 587 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-4226147180 [0,1,0,0,0,0|1,1,0]=3 588 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-7445496718 [0,1,0,0,0,0|1,1,0]=3 589 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-9770959398 [0,1,0,0,0,0|1,1,0]=3 590 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-3878355824 [0,1,0,0,0,0|1,1,0]=3 591 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-4791160457 [0,1,0,0,0,0|1,1,0]=3 592 B6R0.3 CC[C@H](O)C(C)C MCULE-9659963395 [0,1,0,0,0,0|1,1,0]=3 593 B6R0.3 CNC(=O)C(C)Br MCULE-8111267694 [0,1,0,0,0,0|1,1,1]=4 594 B6R0.3 CNC(=O)C(C)C MCULE-9646758802 [0,1,0,0,0,0|1,1,1]=4 595 B6R0.3 CNC(=O)C(C)Cl MCULE-6524637023 [0,1,0,0,0,0|1,1,1]=4 596 B6R0.3 CNC(=O)C(C)N MCULE-2283707986 [0,1,0,0,0,0|1,1,1]=4 597 B6R0.3 CNC(=O)C(C)N MCULE-2976078375 [0,1,0,0,0,0|1,1,1]=4 598 B6R0.3 CNC(=O)C(C)N MCULE-5544490576 [0,1,0,0,0,0|1,1,1]=4 599 B6R0.3 CNC(=O)C(C)N MCULE-8815196909 [0,1,0,0,0,0|1,1,1]=4 600 B6R0.3 CNC(=O)C(C)O MCULE-4714977257 [0,1,0,0,0,0|0,2,1]=4 601 B6R0.3 CNC(=O)[C@@H](C)N MCULE-4498032248 [0,1,0,0,0,0|1,1,1]=4 602 B6R0.3 CNC(=O)[C@@H](C)N MCULE-6909082129 [0,1,0,0,0,0|1,1,1]=4 603 B6R0.3 CNC(=O)[C@@H](C)N MCULE-7642558844 [0,1,0,0,0,0|1,1,1]=4 604 B6R0.3 CNC(=O)[C@@H](C)N MCULE-8543898121 [0,1,0,0,0,0|1,1,1]=4 605 B6R0.3 CNC(=O)[C@@H](C)O MCULE-8955033466 [0,1,0,0,0,0|0,2,1]=4 606 B6R0.3 CNC(=O)[C@H](C)N MCULE-5297375743 [0,1,0,0,0,0|1,1,1]=4 607 B6R0.3 CNC(=O)[C@H](C)N MCULE-6807150828 [0,1,0,0,0,0|1,1,1]=4 608 B6R0.3 CNC(=O)[C@H](C)N MCULE-8365508630 [0,1,0,0,0,0|1,1,1]=4 609 B6R0.3 CNC(=O)[C@H](C)N MCULE-9773818316 [0,1,0,0,0,0|1,1,1]=4 610 B6R0.3 CNC(=O)[C@H](C)O MCULE-8015727044 [0,1,0,0,0,0|0,2,1]=4 611 B6R0.3 CNC(C)C(C)C MCULE-3041212030 [0,1,0,0,0,0|2,0,0]=3 612 B6R0.3 CNC(C)C(C)C MCULE-7052543779 [0,1,0,0,0,0|2,0,0]=3 613 B6R0.3 COC(=N)C(C)C MCULE-2061399513 [0,1,0,0,0,0|2,0,1]=4 614 B6R0.3 COC(=N)C(C)C MCULE-9270611186 [0,1,0,0,0,0|2,0,1]=4 615 B6R0.3 COC(=O)C(C)Br MCULE-8218697195 [0,1,0,0,0,0|1,1,1]=4 616 B6R0.3 COC(=O)C(C)C MCULE-8740211817 [0,1,0,0,0,0|1,1,1]=4 617 B6R0.3 COC(=O)C(C)Cl MCULE-5874523100 [0,1,0,0,0,0|1,1,1]=4 618 B6R0.3 COC(=O)C(C)Cl MCULE-7725109837 [0,1,0,0,0,0|1,1,1]=4 619 B6R0.3 COC(=O)C(C)F MCULE-2381396302 [0,1,0,0,0,0|1,1,1]=4 620 B6R0.3 COC(=O)C(C)N MCULE-6823731158 [0,1,0,0,0,0|1,1,1]=4 621 B6R0.3 COC(=O)C(C)N MCULE-7003387212 [0,1,0,0,0,0|1,1,1]=4 622 B6R0.3 COC(=O)C(C)N MCULE-8331503444 [0,1,0,0,0,0|1,1,1]=4 623 B6R0.3 COC(=O)C(C)N MCULE-8860467123 [0,1,0,0,0,0|1,1,1]=4 624 B6R0.3 COC(=O)C(C)O MCULE-7040827393 [0,1,0,0,0,0|0,2,1]=4 625 B6R0.3 COC(=O)C(C)O MCULE-7872489483 [0,1,0,0,0,0|0,2,1]=4 626 B6R0.3 COC(=O)C(C)S MCULE-8499044680 [0,1,0,0,0,0|0,1,1]=3 627 B6R0.3 COC(=O)[C@@H](C)Br MCULE-8118895575 [0,1,0,0,0,0|1,1,1]=4 628 B6R0.3 COC(=O)[C@@H](C)Cl MCULE-1037727130 [0,1,0,0,0,0|1,1,1]=4 629 B6R0.3 COC(=O)[C@@H](C)F MCULE-4776326501 [0,1,0,0,0,0|1,1,1]=4 630 B6R0.3 COC(=O)[C@@H](C)F MCULE-8049982812 [0,1,0,0,0,0|1,1,1]=4 631 B6R0.3 COC(=O)[C@@H](C)N MCULE-6142127864 [0,1,0,0,0,0|1,1,1]=4 632 B6R0.3 COC(=O)[C@@H](C)N MCULE-6606835410 [0,1,0,0,0,0|1,1,1]=4 633 B6R0.3 COC(=O)[C@@H](C)N MCULE-7979979694 [0,1,0,0,0,0|1,1,1]=4 634 B6R0.3 COC(=O)[C@@H](C)N MCULE-9290287586 [0,1,0,0,0,0|1,1,1]=4 635 B6R0.3 COC(=O)[C@@H](C)O MCULE-5441095431 [0,1,0,0,0,0|0,2,1]=4 636 B6R0.3 COC(=O)[C@@H](C)O MCULE-6924152779 [0,1,0,0,0,0|0,2,1]=4 637 B6R0.3 COC(=O)[C@H](C)Cl MCULE-1009662992 [0,1,0,0,0,0|1,1,1]=4 638 B6R0.3 COC(=O)[C@H](C)Cl MCULE-7624485295 [0,1,0,0,0,0|1,1,1]=4 639 B6R0.3 COC(=O)[C@H](C)N MCULE-1665306037 [0,1,0,0,0,0|1,1,1]=4 640 B6R0.3 COC(=O)[C@H](C)N MCULE-2941352505 [0,1,0,0,0,0|1,1,1]=4 641 B6R0.3 COC(=O)[C@H](C)N MCULE-5314047552 [0,1,0,0,0,0|1,1,1]=4 642 B6R0.3 COC(=O)[C@H](C)N MCULE-7930428859 [0,1,0,0,0,0|1,1,1]=4 643 B6R0.3 COC(=O)[C@H](C)O MCULE-2590929895 [0,1,0,0,0,0|0,2,1]=4 644 B6R0.3 COC(=O)[C@H](C)O MCULE-3292709954 [0,1,0,0,0,0|0,2,1]=4 645 B6R0.3 COC(Br)C(=O)C MCULE-1220922171 [0,1,0,0,0,0|1,1,1]=4 646 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [0,1,0,0,0,0|0,2,1]=4 647 B6R0.3 COC(C)C(C)O MCULE-9844405908 [0,1,0,0,0,0|0,2,0]=3 648 B6R0.3 COC(C)[C@@H](C)N MCULE-2029978265 [0,1,0,0,0,0|1,1,0]=3 649 B6R0.3 COC(C)[C@@H](C)N MCULE-4755003017 [0,1,0,0,0,0|1,1,0]=3 650 B6R0.3 COC(C)[C@@H](C)N MCULE-9820337483 [0,1,0,0,0,0|1,1,0]=3 651 B6R0.3 COC(C)[C@@H](C)N MCULE-9820818995 [0,1,0,0,0,0|1,1,0]=3 652 B6R0.3 CSC(=O)C(C)C MCULE-3533547228 [0,1,0,0,0,0|1,1,1]=4 653 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [0,1,0,0,0,0|0,1,1]=3 654 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [0,1,0,0,0,0|1,1,1]=4 655 B6R0.3 CSC(C)C(C)O MCULE-9554880840 [0,1,0,0,0,0|0,1,0]=2 656 B6R0.3 C[C@@H](CO)N(C)C MCULE-4388248602 [0,1,0,0,0,0|2,1,0]=4 657 B6R0.3 C[C@@H](CS)N(C)C MCULE-7111398165 [0,1,0,0,0,0|2,0,0]=3 658 B6R0.3 C[C@@H](F)[C@@H](F)CN MCULE-9285557840 [0,1,0,0,0,0|2,0,0]=3 659 B6R0.3 C[C@@H](F)[C@H](F)CN MCULE-9353092073 [0,1,0,0,0,0|2,0,0]=3 660 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-1499224916 [0,1,0,0,0,0|1,1,0]=3 661 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-3539522955 [0,1,0,0,0,0|1,1,0]=3 662 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-1381786707 [0,1,0,0,0,0|1,1,0]=3 663 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-3627537672 [0,1,0,0,0,0|1,1,0]=3 664 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-5429038645 [0,1,0,0,0,0|1,1,0]=3 665 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-6146168744 [0,1,0,0,0,0|1,1,0]=3 666 B6R0.3 C[C@H](N)C(=O)CCl MCULE-1387458909 [0,1,0,0,0,0|1,1,1]=4 667 B6R0.3 C[C@H](N)C(=O)CCl MCULE-3307546885 [0,1,0,0,0,0|1,1,1]=4 668 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-5329315346 [0,1,0,0,0,0|1,1,0]=3 669 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7239426628 [0,1,0,0,0,0|1,1,0]=3 670 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7437797788 [0,1,0,0,0,0|1,1,0]=3 671 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-2378004602 [0,1,0,0,0,0|1,1,0]=3 672 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-9436764758 [0,1,0,0,0,0|1,1,0]=3 673 B6R0.3 ClCC(Cl)C(Cl)Cl MCULE-6272586982 [0,1,0,0,0,0|3,0,0]=4 674 B6R0.3 NCC(O)C(F)F MCULE-3263599594 [0,1,0,0,0,0|2,1,0]=4 675 B6R0.3 NCC(O)C(F)F MCULE-6925242752 [0,1,0,0,0,0|2,1,0]=4 676 B6R0.3 OC(CBr)C(F)F MCULE-2512834773 [0,1,0,0,0,0|2,1,0]=4 677 B6R0.3 OC[C@@H](O)C(F)F MCULE-5042610356 [0,1,0,0,0,0|2,1,0]=4 678 B6R0.3 OC[C@@H](O)C(F)F MCULE-8643910063 [0,1,0,0,0,0|2,1,0]=4 679 B6R0.3 [C@H](C)(Cl)C(=O)OC MCULE-7212330759 [0,1,0,0,0,0|1,1,1]=4 680 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [0,1,0,0,0,0|1,1,1]=4 681 B6R0.7 C=C(C)C(C)(C)C MCULE-9196090881 [0,1,0,0,0,0|2,0,1]=4 682 B6R0.7 CC(=O)C(C)(C)Br MCULE-2211649171 [0,1,0,0,0,0|1,1,1]=4 683 B6R0.7 CC(=O)C(C)(C)C MCULE-9731323161 [0,1,0,0,0,0|1,1,1]=4 684 B6R0.7 CC(=O)C(C)(C)Cl MCULE-3074145802 [0,1,0,0,0,0|1,1,1]=4 685 B6R0.7 CC(=O)C(C)(C)N MCULE-8236547032 [0,1,0,0,0,0|1,1,1]=4 686 B6R0.7 CC(=O)C(C)(C)N MCULE-9736681939 [0,1,0,0,0,0|1,1,1]=4 687 B6R0.7 CC(=O)C(C)(C)O MCULE-1535627387 [0,1,0,0,0,0|0,2,1]=4 688 B6R0.7 CC(=O)C(C)(F)F MCULE-7856452896 [0,1,0,0,0,0|1,1,1]=4 689 B6R0.7 CC(Br)C(C)(Br)Br MCULE-8291248982 [0,1,0,0,0,0|2,0,0]=3 690 B6R0.7 CC(Br)C(C)(C)O MCULE-8852960455 [0,1,0,0,0,0|1,1,0]=3 691 B6R0.7 CC(Br)C(F)(F)F MCULE-2513242011 [0,1,0,0,0,0|3,0,0]=4 692 B6R0.7 CC(C)(N)C(F)F MCULE-3533657881 [0,1,0,0,0,0|3,0,0]=4 693 B6R0.7 CC(C)(N)C(F)F MCULE-6482627990 [0,1,0,0,0,0|3,0,0]=4 694 B6R0.7 CC(C)(O)C(F)F MCULE-8985905844 [0,1,0,0,0,0|2,1,0]=4 695 B6R0.7 CC(C)(S)C(=O)O MCULE-1863706684 [0,1,0,0,0,0|1,1,1]=4 696 B6R0.7 CC(C)C(C)(C)C MCULE-1812497972 [0,1,0,0,0,0|2,0,0]=3 697 B6R0.7 CC(C)C(C)(C)Cl MCULE-8433683576 [0,1,0,0,0,0|2,0,0]=3 698 B6R0.7 CC(C)C(C)(C)N MCULE-1087702564 [0,1,0,0,0,0|2,0,0]=3 699 B6R0.7 CC(C)C(C)(C)N MCULE-7970243446 [0,1,0,0,0,0|2,0,0]=3 700 B6R0.7 CC(C)C(C)(C)N MCULE-9070308251 [0,1,0,0,0,0|2,0,0]=3 701 B6R0.7 CC(C)C(C)(C)N MCULE-9504763687 [0,1,0,0,0,0|2,0,0]=3 702 B6R0.7 CC(C)C(C)(C)O MCULE-9552110431 [0,1,0,0,0,0|1,1,0]=3 703 B6R0.7 CC(C)C(C)(C)S MCULE-2543562742 [0,1,0,0,0,0|1,0,0]=2 704 B6R0.7 CC(C)S(=N)(=O)C MCULE-6389709038 [0,1,0,0,0,0|2,1,0]=4 705 B6R0.7 CC(C)S(=O)(=O)C MCULE-1630518669 [0,1,0,0,0,0|2,1,0]=4 706 B6R0.7 CC(C)[Si](C)(C)Cl MCULE-3061239516 [0,1,0,0,0,0|2,1,0]=4 707 B6R0.7 CC(C)[Si](C)(Cl)Cl MCULE-4183904792 [0,1,0,0,0,0|2,1,0]=4 708 B6R0.7 CC(Cl)[Si](C)(C)C MCULE-8216058934 [0,1,0,0,0,0|2,1,0]=4 709 B6R0.7 CC(F)(F)C(F)F MCULE-7024439355 [0,1,0,0,0,0|3,0,0]=4 710 B6R0.7 CC(I)C(C)(C)O MCULE-2789802208 [0,1,0,0,0,0|1,1,0]=3 711 B6R0.7 CC(I)C(F)(F)F MCULE-6487463885 [0,1,0,0,0,0|3,0,0]=4 712 B6R0.7 CC(N)C(C)(C)C MCULE-1560445367 [0,1,0,0,0,0|2,0,0]=3 713 B6R0.7 CC(N)C(C)(C)C MCULE-2502277340 [0,1,0,0,0,0|2,0,0]=3 714 B6R0.7 CC(N)C(C)(C)C MCULE-2961240055 [0,1,0,0,0,0|2,0,0]=3 715 B6R0.7 CC(N)C(C)(C)C MCULE-6247289312 [0,1,0,0,0,0|2,0,0]=3 716 B6R0.7 CC(N)C(C)(C)O MCULE-4039964918 [0,1,0,0,0,0|1,1,0]=3 717 B6R0.7 CC(N)C(C)(F)F MCULE-4707783981 [0,1,0,0,0,0|2,0,0]=3 718 B6R0.7 CC(N)C(C)(F)F MCULE-4940930603 [0,1,0,0,0,0|2,0,0]=3 719 B6R0.7 CC(N)C(F)(F)F MCULE-3262630519 [0,1,0,0,0,0|3,0,0]=4 720 B6R0.7 CC(N)C(F)(F)F MCULE-5807700972 [0,1,0,0,0,0|3,0,0]=4 721 B6R0.7 CC(N)C(F)(F)F MCULE-9059703170 [0,1,0,0,0,0|3,0,0]=4 722 B6R0.7 CC(N)C(F)(F)F MCULE-9338683660 [0,1,0,0,0,0|3,0,0]=4 723 B6R0.7 CC(O)C(C)(C)C MCULE-7642386536 [0,1,0,0,0,0|1,1,0]=3 724 B6R0.7 CC(O)C(C)(C)N MCULE-3194936121 [0,1,0,0,0,0|1,1,0]=3 725 B6R0.7 CC(O)C(C)(C)N MCULE-6694352146 [0,1,0,0,0,0|1,1,0]=3 726 B6R0.7 CC(O)C(C)(C)O MCULE-6808101269 [0,1,0,0,0,0|0,2,0]=3 727 B6R0.7 CC(O)C(Cl)(Cl)Cl MCULE-5935806357 [0,1,0,0,0,0|2,1,0]=4 728 B6R0.7 CC(O)C(F)(F)F MCULE-7932621726 [0,1,0,0,0,0|2,1,0]=4 729 B6R0.7 CC(O)C(F)(F)F MCULE-9204617232 [0,1,0,0,0,0|2,1,0]=4 730 B6R0.7 CN(C)C(C)(C)C MCULE-9794615428 [0,1,0,0,0,0|3,0,0]=4 731 B6R0.7 CS(=O)C(C)(C)C MCULE-5479134400 [0,1,0,0,0,0|2,1,0]=4 732 B6R0.7 C[C@@H](N)C(C)(C)C MCULE-4605264480 [0,1,0,0,0,0|2,0,0]=3 733 B6R0.7 C[C@@H](N)C(C)(C)C MCULE-4749686394 [0,1,0,0,0,0|2,0,0]=3 734 B6R0.7 C[C@@H](N)C(C)(C)C MCULE-6899493984 [0,1,0,0,0,0|2,0,0]=3 735 B6R0.7 C[C@@H](N)C(C)(C)C MCULE-8453431428 [0,1,0,0,0,0|2,0,0]=3 736 B6R0.7 C[C@@H](N)C(C)(C)O MCULE-3417639330 [0,1,0,0,0,0|1,1,0]=3 737 B6R0.7 C[C@@H](N)C(C)(C)O MCULE-4565477059 [0,1,0,0,0,0|1,1,0]=3 738 B6R0.7 C[C@@H](N)C(C)(C)O MCULE-6545041854 [0,1,0,0,0,0|1,1,0]=3 739 B6R0.7 C[C@@H](N)C(C)(C)O MCULE-7923052614 [0,1,0,0,0,0|1,1,0]=3 740 B6R0.7 C[C@@H](N)C(C)(F)F MCULE-2091512809 [0,1,0,0,0,0|2,0,0]=3 741 B6R0.7 C[C@@H](N)C(C)(F)F MCULE-8739903384 [0,1,0,0,0,0|2,0,0]=3 742 B6R0.7 C[C@@H](N)C(F)(F)F MCULE-4764078144 [0,1,0,0,0,0|3,0,0]=4 743 B6R0.7 C[C@@H](N)C(F)(F)F MCULE-5519320185 [0,1,0,0,0,0|3,0,0]=4 744 B6R0.7 C[C@@H](N)C(F)(F)F MCULE-6357974683 [0,1,0,0,0,0|3,0,0]=4 745 B6R0.7 C[C@@H](N)C(F)(F)F MCULE-8361949262 [0,1,0,0,0,0|3,0,0]=4 746 B6R0.7 C[C@@H](O)C(C)(C)C MCULE-7929838583 [0,1,0,0,0,0|1,1,0]=3 747 B6R0.7 C[C@@H](O)C(F)(F)F MCULE-2563742748 [0,1,0,0,0,0|2,1,0]=4 748 B6R0.7 C[C@H](N)C(C)(C)C MCULE-4139932684 [0,1,0,0,0,0|2,0,0]=3 749 B6R0.7 C[C@H](N)C(C)(C)C MCULE-4860282434 [0,1,0,0,0,0|2,0,0]=3 750 B6R0.7 C[C@H](N)C(C)(C)C MCULE-6310262013 [0,1,0,0,0,0|2,0,0]=3 751 B6R0.7 C[C@H](N)C(C)(C)C MCULE-6777039869 [0,1,0,0,0,0|2,0,0]=3 752 B6R0.7 C[C@H](N)C(C)(C)O MCULE-2544089301 [0,1,0,0,0,0|1,1,0]=3 753 B6R0.7 C[C@H](N)C(C)(C)O MCULE-3586309450 [0,1,0,0,0,0|1,1,0]=3 754 B6R0.7 C[C@H](N)C(C)(C)O MCULE-3878079754 [0,1,0,0,0,0|1,1,0]=3 755 B6R0.7 C[C@H](N)C(C)(C)O MCULE-6958997632 [0,1,0,0,0,0|1,1,0]=3 756 B6R0.7 C[C@H](N)C(C)(F)F MCULE-1126441542 [0,1,0,0,0,0|2,0,0]=3 757 B6R0.7 C[C@H](N)C(C)(F)F MCULE-5528735738 [0,1,0,0,0,0|2,0,0]=3 758 B6R0.7 C[C@H](N)C(C)(F)F MCULE-8435527625 [0,1,0,0,0,0|2,0,0]=3 759 B6R0.7 C[C@H](N)C(C)(F)F MCULE-9214849722 [0,1,0,0,0,0|2,0,0]=3 760 B6R0.7 C[C@H](N)C(F)(F)F MCULE-3362038134 [0,1,0,0,0,0|3,0,0]=4 761 B6R0.7 C[C@H](N)C(F)(F)F MCULE-4246179222 [0,1,0,0,0,0|3,0,0]=4 762 B6R0.7 C[C@H](N)C(F)(F)F MCULE-5429343374 [0,1,0,0,0,0|3,0,0]=4 763 B6R0.7 C[C@H](N)C(F)(F)F MCULE-8647501380 [0,1,0,0,0,0|3,0,0]=4 764 B6R0.7 C[C@H](O)C(C)(C)C MCULE-8207064949 [0,1,0,0,0,0|1,1,0]=3 765 B6R0.7 C[C@H](O)C(C)(C)O MCULE-5048641902 [0,1,0,0,0,0|0,2,0]=3 766 B6R0.7 C[C@H](O)C(F)(F)F MCULE-2310271940 [0,1,0,0,0,0|2,1,0]=4 767 B6R0.7 C[C@H](O)C(F)(F)F MCULE-8236579487 [0,1,0,0,0,0|2,1,0]=4 768 B6R0.7 [C@H](C)(O)C(F)(F)F MCULE-3479344719 [0,1,0,0,0,0|2,1,0]=4 769 B6R1.4 CC1CCC1=O MCULE-4548181715 [0,0,0,1,0,0|1,1,1]=4 770 B6R1.4 CC1CCC1N MCULE-9634057678 [0,0,0,1,0,0|2,0,0]=3 771 B6R1.4 CC1CCC1N MCULE-9849489304 [0,0,0,1,0,0|2,0,0]=3 772 B6R1.4 CC1CCC1O MCULE-3852133104 [0,0,0,1,0,0|1,1,0]=3 773 B6R1.4 CC1CNC1C MCULE-6217110869 [0,0,0,1,0,0|2,0,0]=3 774 B6R1.4 CC1CNC1C MCULE-8966220604 [0,0,0,1,0,0|2,0,0]=3 775 B6R1.4 CC1NCC1F MCULE-2205876595 [0,0,0,1,0,0|2,0,0]=3 776 B6R1.4 CC1NCC1F MCULE-3575637458 [0,0,0,1,0,0|2,0,0]=3 777 B6R1.4 CC1NCC1O MCULE-6512695808 [0,0,0,1,0,0|1,1,0]=3 778 B6R1.4 CC1NCC1O MCULE-8357296054 [0,0,0,1,0,0|1,1,0]=3 779 B6R1.4 CC1OCC1=O MCULE-7718609686 [0,0,0,1,0,0|0,2,1]=4 780 B6R1.4 CC1OCC1O MCULE-1893283492 [0,0,0,1,0,0|0,2,0]=3 781 B6R1.4 C[C@@H]1CC[C@@H]1N MCULE-9803413081 [0,0,0,1,0,0|2,0,0]=3 782 B6R1.4 C[C@@H]1CC[C@H]1N MCULE-3888655890 [0,0,0,1,0,0|2,0,0]=3 783 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-5099590573 [0,0,0,1,0,0|2,0,0]=3 784 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-6754257002 [0,0,0,1,0,0|2,0,0]=3 785 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-7084262632 [0,0,0,1,0,0|2,0,0]=3 786 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-9147724667 [0,0,0,1,0,0|2,0,0]=3 787 B6R1.4 C[C@@H]1NC[C@@H]1F MCULE-2104999017 [0,0,0,1,0,0|2,0,0]=3 788 B6R1.4 C[C@@H]1NC[C@@H]1F MCULE-9859591204 [0,0,0,1,0,0|2,0,0]=3 789 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-1528414534 [0,0,0,1,0,0|1,1,0]=3 790 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-2910306067 [0,0,0,1,0,0|1,1,0]=3 791 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-3197698089 [0,0,0,1,0,0|1,1,0]=3 792 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-3295326997 [0,0,0,1,0,0|1,1,0]=3 793 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-5640695802 [0,0,0,1,0,0|1,1,0]=3 794 B6R1.4 C[C@@H]1NC[C@@H]1O MCULE-7598216076 [0,0,0,1,0,0|1,1,0]=3 795 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-2384338566 [0,0,0,1,0,0|2,0,0]=3 796 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-3761027062 [0,0,0,1,0,0|2,0,0]=3 797 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-7625337051 [0,0,0,1,0,0|2,0,0]=3 798 B6R1.4 C[C@@H]1NC[C@H]1F MCULE-8482078532 [0,0,0,1,0,0|2,0,0]=3 799 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-3152396704 [0,0,0,1,0,0|1,1,0]=3 800 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-3248209918 [0,0,0,1,0,0|1,1,0]=3 801 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-3575939824 [0,0,0,1,0,0|1,1,0]=3 802 B6R1.4 C[C@@H]1NC[C@H]1O MCULE-4120662394 [0,0,0,1,0,0|1,1,0]=3 803 B6R1.4 C[C@H]1CC[C@@H]1N MCULE-1445146965 [0,0,0,1,0,0|2,0,0]=3 804 B6R1.4 C[C@H]1CC[C@H]1N MCULE-3329522369 [0,0,0,1,0,0|2,0,0]=3 805 B6R1.4 C[C@H]1NC[C@@H]1F MCULE-6266484815 [0,0,0,1,0,0|2,0,0]=3 806 B6R1.4 C[C@H]1NC[C@@H]1F MCULE-9525975864 [0,0,0,1,0,0|2,0,0]=3 807 B6R1.4 C[C@H]1NC[C@@H]1O MCULE-3510002118 [0,0,0,1,0,0|1,1,0]=3 808 B6R1.4 C[C@H]1NC[C@@H]1O MCULE-6901722671 [0,0,0,1,0,0|1,1,0]=3 809 B6R1.4 C[C@H]1NC[C@H]1F MCULE-6303998999 [0,0,0,1,0,0|2,0,0]=3 810 B6R1.4 C[C@H]1NC[C@H]1F MCULE-8897044344 [0,0,0,1,0,0|2,0,0]=3 811 B6R1.4 C[C@H]1NC[C@H]1O MCULE-1733557375 [0,0,0,1,0,0|1,1,0]=3 812 B6R1.4 C[C@H]1NC[C@H]1O MCULE-3026150373 [0,0,0,1,0,0|1,1,0]=3 813 B6R1.4 C[C@H]1NC[C@H]1O MCULE-7386387747 [0,0,0,1,0,0|1,1,0]=3 814 B6R1.4 C[C@H]1NC[C@H]1O MCULE-7405032693 [0,0,0,1,0,0|1,1,0]=3 815 B6R1.4 NC1CCC1=O MCULE-3868209809 [0,0,0,1,0,0|1,1,1]=4 816 B6R1.4 NC1CCC1=O MCULE-9741389143 [0,0,0,1,0,0|1,1,1]=4 817 B6R1.4 NC1CCC1F MCULE-1403984623 [0,0,0,1,0,0|2,0,0]=3 818 B6R1.4 NC1CCC1F MCULE-8216841286 [0,0,0,1,0,0|2,0,0]=3 819 B6R1.4 NC1CCC1N MCULE-6052332328 [0,0,0,1,0,0|2,0,0]=3 820 B6R1.4 NC1CCC1O MCULE-4636397534 [0,0,0,1,0,0|1,1,0]=3 821 B6R1.4 NC1CCC1O MCULE-7148132261 [0,0,0,1,0,0|1,1,0]=3 822 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-1054283097 [0,0,0,1,0,0|1,1,0]=3 823 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-3905992171 [0,0,0,1,0,0|1,1,0]=3 824 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-6111990015 [0,0,0,1,0,0|1,1,0]=3 825 B6R1.4 N[C@@H]1CC[C@@H]1O MCULE-9101755956 [0,0,0,1,0,0|1,1,0]=3 826 B6R1.4 N[C@@H]1CC[C@H]1N MCULE-6204977772 [0,0,0,1,0,0|2,0,0]=3 827 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-1883601377 [0,0,0,1,0,0|1,1,0]=3 828 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-6045787726 [0,0,0,1,0,0|1,1,0]=3 829 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-7120290402 [0,0,0,1,0,0|1,1,0]=3 830 B6R1.4 N[C@@H]1CC[C@H]1O MCULE-8603369729 [0,0,0,1,0,0|1,1,0]=3 831 B6R1.4 N[C@H]1CC[C@@H]1N MCULE-3551063683 [0,0,0,1,0,0|2,0,0]=3 832 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-1761694918 [0,0,0,1,0,0|1,1,0]=3 833 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-2828590958 [0,0,0,1,0,0|1,1,0]=3 834 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-3261752057 [0,0,0,1,0,0|1,1,0]=3 835 B6R1.4 N[C@H]1CC[C@@H]1O MCULE-7711512049 [0,0,0,1,0,0|1,1,0]=3 836 B6R1.4 N[C@H]1CC[C@H]1N MCULE-2823061893 [0,0,0,1,0,0|2,0,0]=3 837 B6R1.4 N[C@H]1CC[C@H]1N MCULE-6752412872 [0,0,0,1,0,0|2,0,0]=3 838 B6R1.4 N[C@H]1CC[C@H]1O MCULE-3204268809 [0,0,0,1,0,0|1,1,0]=3 839 B6R1.4 N[C@H]1CC[C@H]1O MCULE-4184135738 [0,0,0,1,0,0|1,1,0]=3 840 B6R1.4 O=C1CCC1Br MCULE-1088592133 [0,0,0,1,0,0|1,1,1]=4 841 B6R1.4 O=C1CCC1F MCULE-6197375881 [0,0,0,1,0,0|1,1,1]=4 842 B6R1.4 O=C1CCC1O MCULE-1248327203 [0,0,0,1,0,0|0,2,1]=4 843 B6R1.4 O=C1CC[C@@H]1Br MCULE-3455449754 [0,0,0,1,0,0|1,1,1]=4 844 B6R1.4 OC1CCC1O MCULE-3286787157 [0,0,0,1,0,0|0,2,0]=3 845 B6R1.4 O[C@@H]1CC[C@H]1O MCULE-5060593050 [0,0,0,1,0,0|0,2,0]=3 846 B6R1.4 O[C@@H]1CC[C@H]1O MCULE-6357622033 [0,0,0,1,0,0|0,2,0]=3 847 B6R1.4 O[C@H]1CC[C@H]1O MCULE-7964152901 [0,0,0,1,0,0|0,2,0]=3 848 B6R1.9 CC1(CC1Br)C MCULE-4060390279 [0,0,0,1,0,0|2,0,0]=3 849 B6R1.9 CC1(CC1Br)N MCULE-2545863228 [0,0,0,1,0,0|2,0,0]=3 850 B6R1.9 CC1(CC1Br)N MCULE-6976008667 [0,0,0,1,0,0|2,0,0]=3 851 B6R1.9 CC1(CC1N)C MCULE-3767513819 [0,0,0,1,0,0|2,0,0]=3 852 B6R1.9 CC1(CC1N)C MCULE-9259559793 [0,0,0,1,0,0|2,0,0]=3 853 B6R1.9 CC1(CC1O)C MCULE-2207251369 [0,0,0,1,0,0|1,1,0]=3 854 B6R1.9 CC1(C[C@@H]1N)C MCULE-8232974349 [0,0,0,1,0,0|2,0,0]=3 855 B6R1.9 CC1(C[C@@H]1N)C MCULE-9299327749 [0,0,0,1,0,0|2,0,0]=3 856 B6R1.9 CC1(C[C@H]1N)C MCULE-2015844172 [0,0,0,1,0,0|2,0,0]=3 857 B6R1.9 CC1(C[C@H]1N)C MCULE-8301129744 [0,0,0,1,0,0|2,0,0]=3 858 B6R1.9 CC1CC1(C)N MCULE-2748884505 [0,0,0,1,0,0|2,0,0]=3 859 B6R1.9 CC1CC1(C)N MCULE-6309103404 [0,0,0,1,0,0|2,0,0]=3 860 B6R1.9 CC1OC1(C)C MCULE-6556425885 [0,0,0,1,0,0|1,1,0]=3 861 B6R1.9 FC1(CC1Br)F MCULE-5007635902 [0,0,0,1,0,0|3,0,0]=4 862 B6R1.9 NC1CC1(F)F MCULE-2003011750 [0,0,0,1,0,0|3,0,0]=4 863 B6R1.9 NC1CC1(F)F MCULE-7089924421 [0,0,0,1,0,0|3,0,0]=4 864 B6R1.9 NC1CC1(F)F MCULE-7356261907 [0,0,0,1,0,0|3,0,0]=4 865 B6R1.9 NC1CC1(F)F MCULE-9011855744 [0,0,0,1,0,0|3,0,0]=4 866 B6R1.9 N[C@@H]1CC1(F)F MCULE-1053742798 [0,0,0,1,0,0|3,0,0]=4 867 B6R1.9 N[C@@H]1CC1(F)F MCULE-9077998884 [0,0,0,1,0,0|3,0,0]=4 868 B6R1.9 N[C@H]1CC1(F)F MCULE-5518291494 [0,0,0,1,0,0|3,0,0]=4 869 B6R1.9 N[C@H]1CC1(F)F MCULE-8293867852 [0,0,0,1,0,0|3,0,0]=4 870 B6R1.9 OC1CC1(F)F MCULE-7582982777 [0,0,0,1,0,0|2,1,0]=4 871 B6R1.11 C=C(C)C1CO1 MCULE-3656533343 [0,0,0,1,0,0|1,1,1]=4 872 B6R1.11 CC(=O)C1CC1 MCULE-3846146416 [0,0,0,1,0,0|1,1,1]=4 873 B6R1.11 CC(=O)C1CO1 MCULE-4329154079 [0,0,0,1,0,0|0,2,1]=4 874 B6R1.11 CC(C)C1CO1 MCULE-6294069717 [0,0,0,1,0,0|1,1,0]=3 875 B6R1.11 CC(C)[C@@H]1CO1 MCULE-9181831987 [0,0,0,1,0,0|1,1,0]=3 876 B6R1.11 CC(C)[C@H]1CO1 MCULE-1978831452 [0,0,0,1,0,0|1,1,0]=3 877 B6R1.11 CC(Cl)C1CC1 MCULE-7361335709 [0,0,0,1,0,0|2,0,0]=3 878 B6R1.11 CC(N)C1CC1 MCULE-2052303800 [0,0,0,1,0,0|2,0,0]=3 879 B6R1.11 CC(N)C1CC1 MCULE-3007763115 [0,0,0,1,0,0|2,0,0]=3 880 B6R1.11 CC(N)C1CC1 MCULE-3459276996 [0,0,0,1,0,0|2,0,0]=3 881 B6R1.11 CC(N)C1CC1 MCULE-6761961556 [0,0,0,1,0,0|2,0,0]=3 882 B6R1.11 CC(O)C1CC1 MCULE-8628810684 [0,0,0,1,0,0|1,1,0]=3 883 B6R1.11 CC(O)C1CO1 MCULE-2044990126 [0,0,0,1,0,0|0,2,0]=3 884 B6R1.11 CN(C)C1CC1 MCULE-5891640069 [0,0,0,1,0,0|3,0,0]=4 885 B6R1.11 CN(C)C1CC1 MCULE-6751529979 [0,0,0,1,0,0|3,0,0]=4 886 B6R1.11 CN(N)C1CC1 MCULE-4590166937 [0,0,0,1,0,0|3,0,0]=4 887 B6R1.11 CN(N)C1CC1 MCULE-7317282450 [0,0,0,1,0,0|3,0,0]=4 888 B6R1.11 C[C@@H](N)C1CC1 MCULE-2097889079 [0,0,0,1,0,0|2,0,0]=3 889 B6R1.11 C[C@@H](N)C1CC1 MCULE-3667125695 [0,0,0,1,0,0|2,0,0]=3 890 B6R1.11 C[C@@H](N)C1CC1 MCULE-4529741221 [0,0,0,1,0,0|2,0,0]=3 891 B6R1.11 C[C@@H](N)C1CC1 MCULE-4996656085 [0,0,0,1,0,0|2,0,0]=3 892 B6R1.11 C[C@@H](O)C1CC1 MCULE-8359847821 [0,0,0,1,0,0|1,1,0]=3 893 B6R1.11 C[C@H](N)C1CC1 MCULE-5080052640 [0,0,0,1,0,0|2,0,0]=3 894 B6R1.11 C[C@H](N)C1CC1 MCULE-8331040870 [0,0,0,1,0,0|2,0,0]=3 895 B6R1.11 C[C@H](N)C1CC1 MCULE-8367240790 [0,0,0,1,0,0|2,0,0]=3 896 B6R1.11 C[C@H](N)C1CC1 MCULE-8726268701 [0,0,0,1,0,0|2,0,0]=3 897 B6R1.11 C[C@H](O)C1CC1 MCULE-2458075152 [0,0,0,1,0,0|1,1,0]=3 898 B6R0.2 C=C(C)CC(C)C MCULE-5553118538 [0,0,0,0,0,1|2,0,1]=4 899 B6R0.2 C=C(C)C[C@@H](C)O MCULE-8518319636 [0,0,0,0,0,1|1,1,1]=4 900 B6R0.2 C=C(C)C[C@H](C)O MCULE-7139115019 [0,0,0,0,0,1|1,1,1]=4 901 B6R0.2 CC(=CC(C)C)C MCULE-5460531772 [0,0,0,0,0,1|2,0,1]=4 902 B6R0.2 CC(=CC(C)O)C MCULE-5270694894 [0,0,0,0,0,1|1,1,1]=4 903 B6R0.2 CC(=NC(C)C)C MCULE-4174313497 [0,0,0,0,0,1|2,0,1]=4 904 B6R0.2 CC(=O)CC(C)C MCULE-2172909634 [0,0,0,0,0,1|1,1,1]=4 905 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [0,0,0,0,0,1|1,1,1]=4 906 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [0,0,0,0,0,1|1,1,1]=4 907 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [0,0,0,0,0,1|0,2,1]=4 908 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [0,0,0,0,0,1|1,1,1]=4 909 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [0,0,0,0,0,1|1,1,1]=4 910 B6R0.2 CC(=O)NC(C)C MCULE-2095134698 [0,0,0,0,0,1|1,1,1]=4 911 B6R0.2 CC(=O)OC(C)Br MCULE-6494616843 [0,0,0,0,0,1|1,1,1]=4 912 B6R0.2 CC(=O)OC(C)C MCULE-6152257819 [0,0,0,0,0,1|1,1,1]=4 913 B6R0.2 CC(=O)OC(C)Cl MCULE-3738479003 [0,0,0,0,0,1|1,1,1]=4 914 B6R0.2 CC(Br)CC(C)Br MCULE-1139583334 [0,0,0,0,0,1|2,0,0]=3 915 B6R0.2 CC(C)CC(C)Br MCULE-1549882864 [0,0,0,0,0,1|2,0,0]=3 916 B6R0.2 CC(C)CC(C)C MCULE-1646863110 [0,0,0,0,0,1|2,0,0]=3 917 B6R0.2 CC(C)CC(C)I MCULE-6965017338 [0,0,0,0,0,1|2,0,0]=3 918 B6R0.2 CC(C)CC(C)N MCULE-1144229692 [0,0,0,0,0,1|2,0,0]=3 919 B6R0.2 CC(C)CC(C)N MCULE-5992377656 [0,0,0,0,0,1|2,0,0]=3 920 B6R0.2 CC(C)CC(C)O MCULE-9223768698 [0,0,0,0,0,1|1,1,0]=3 921 B6R0.2 CC(C)C[C@@H](C)N MCULE-5902933285 [0,0,0,0,0,1|2,0,0]=3 922 B6R0.2 CC(C)C[C@@H](C)N MCULE-7208228535 [0,0,0,0,0,1|2,0,0]=3 923 B6R0.2 CC(C)C[C@@H](C)O MCULE-3150675602 [0,0,0,0,0,1|1,1,0]=3 924 B6R0.2 CC(C)C[C@@H](C)O MCULE-4011042896 [0,0,0,0,0,1|1,1,0]=3 925 B6R0.2 CC(C)NC(C)C MCULE-4201618834 [0,0,0,0,0,1|2,0,0]=3 926 B6R0.2 CC(C)NC(C)C MCULE-4622359369 [0,0,0,0,0,1|2,0,0]=3 927 B6R0.2 CC(C)NC(C)C MCULE-6982639198 [0,0,0,0,0,1|2,0,0]=3 928 B6R0.2 CC(C)NC(C)C MCULE-8645161809 [0,0,0,0,0,1|2,0,0]=3 929 B6R0.2 CC(C)NC(C)C MCULE-9048109449 [0,0,0,0,0,1|2,0,0]=3 930 B6R0.2 CC(C)OC(C)C MCULE-2250230766 [0,0,0,0,0,1|2,0,0]=3 931 B6R0.2 CC(C)PC(C)C MCULE-7216494966 [0,0,0,0,0,1|2,0,0]=3 932 B6R0.2 CC(C)SC(C)C MCULE-4851334832 [0,0,0,0,0,1|2,0,0]=3 933 B6R0.2 CC(Cl)CN(C)C MCULE-6738916847 [0,0,0,0,0,1|3,0,0]=4 934 B6R0.2 CC(Cl)CN(C)C MCULE-7074789151 [0,0,0,0,0,1|3,0,0]=4 935 B6R0.2 CC(N)CC(C)O MCULE-7772080010 [0,0,0,0,0,1|1,1,0]=3 936 B6R0.2 CC(N)CC(F)F MCULE-9211292557 [0,0,0,0,0,1|3,0,0]=4 937 B6R0.2 CC(N)CC(F)F MCULE-9693935594 [0,0,0,0,0,1|3,0,0]=4 938 B6R0.2 CC(N)CN(C)C MCULE-4834268309 [0,0,0,0,0,1|3,0,0]=4 939 B6R0.2 CC(N)CN(C)C MCULE-9601630435 [0,0,0,0,0,1|3,0,0]=4 940 B6R0.2 CC(N)CS(=O)C MCULE-1278482312 [0,0,0,0,0,1|2,1,0]=4 941 B6R0.2 CC(O)CC(C)O MCULE-1652556328 [0,0,0,0,0,1|0,2,0]=3 942 B6R0.2 CC(O)CN(C)C MCULE-6531222530 [0,0,0,0,0,1|2,1,0]=4 943 B6R0.2 CC(O)CN(C)C MCULE-7127620454 [0,0,0,0,0,1|2,1,0]=4 944 B6R0.2 CC(O)CN(C)N MCULE-6197492770 [0,0,0,0,0,1|2,1,0]=4 945 B6R0.2 CC(O)CS(=O)C MCULE-2365161952 [0,0,0,0,0,1|1,2,0]=4 946 B6R0.2 C[C@@H](N)CN(C)C MCULE-2034828409 [0,0,0,0,0,1|3,0,0]=4 947 B6R0.2 C[C@@H](N)CN(C)C MCULE-2147556460 [0,0,0,0,0,1|3,0,0]=4 948 B6R0.2 C[C@@H](N)CN(C)C MCULE-6097836560 [0,0,0,0,0,1|3,0,0]=4 949 B6R0.2 C[C@@H](O)CN(C)C MCULE-3114172439 [0,0,0,0,0,1|2,1,0]=4 950 B6R0.2 C[C@@H](O)CN(C)C MCULE-9927679143 [0,0,0,0,0,1|2,1,0]=4 951 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-3504626196 [0,0,0,0,0,1|0,2,0]=3 952 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-4671148975 [0,0,0,0,0,1|0,2,0]=3 953 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-8345849773 [0,0,0,0,0,1|0,2,0]=3 954 B6R0.2 C[C@H](N)CN(C)C MCULE-2526118342 [0,0,0,0,0,1|3,0,0]=4 955 B6R0.2 C[C@H](N)CN(C)C MCULE-3902055308 [0,0,0,0,0,1|3,0,0]=4 956 B6R0.2 C[C@H](N)CN(C)C MCULE-4292583182 [0,0,0,0,0,1|3,0,0]=4 957 B6R0.2 C[C@H](O)CN(C)C MCULE-4542650002 [0,0,0,0,0,1|2,1,0]=4 958 B6R0.2 C[C@H](O)CN(C)C MCULE-4717676519 [0,0,0,0,0,1|2,1,0]=4 959 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-1267135444 [0,0,0,0,0,1|0,2,0]=3 960 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-5878966333 [0,0,0,0,0,1|0,2,0]=3 961 B3R0.1 BrCCBr MCULE-7586462642 [2,0,0,0,0,0|2,0,0]=4 962 B3R0.1 BrCCI MCULE-8691237057 [2,0,0,0,0,0|2,0,0]=4 963 B3R0.1 C#CCC MCULE-8090253856 [2,0,0,0,0,0|0,0,2]=4 964 B3R0.1 C=CCC MCULE-8167907130 [2,0,0,0,0,0|0,0,2]=4 965 B3R0.1 C=CCS MCULE-7270484838 [2,0,0,0,0,0|0,0,2]=4 966 B3R0.1 CC#CC MCULE-3721942346 [2,0,0,0,0,0|0,0,2]=4 967 B3R0.1 CCC#N MCULE-9484970536 [2,0,0,0,0,0|1,0,1]=4 968 B3R0.1 CCC=O MCULE-4079744837 [2,0,0,0,0,0|0,1,1]=4 969 B3R0.1 CCCBr MCULE-2393970713 [2,0,0,0,0,0|1,0,0]=3 970 B3R0.1 CCCC MCULE-9760497805 [2,0,0,0,0,0|0,0,0]=2 971 B3R0.1 CCCCl MCULE-3496412829 [2,0,0,0,0,0|1,0,0]=3 972 B3R0.1 CCCF MCULE-8540338768 [2,0,0,0,0,0|1,0,0]=3 973 B3R0.1 CCCI MCULE-1721488805 [2,0,0,0,0,0|1,0,0]=3 974 B3R0.1 CCCN MCULE-2885523792 [2,0,0,0,0,0|1,0,0]=3 975 B3R0.1 CCCN MCULE-4318907091 [2,0,0,0,0,0|1,0,0]=3 976 B3R0.1 CCCN MCULE-6330457870 [2,0,0,0,0,0|1,0,0]=3 977 B3R0.1 CCCN MCULE-7146820007 [2,0,0,0,0,0|1,0,0]=3 978 B3R0.1 CCCO MCULE-6252105126 [2,0,0,0,0,0|0,1,0]=3 979 B3R0.1 CCCS MCULE-8267649092 [2,0,0,0,0,0|0,0,0]=2 980 B3R0.1 CCNC MCULE-7215376398 [2,0,0,0,0,0|1,0,0]=3 981 B3R0.1 CCNC MCULE-9811899205 [2,0,0,0,0,0|1,0,0]=3 982 B3R0.1 CCNN MCULE-4753127904 [2,0,0,0,0,0|2,0,0]=4 983 B3R0.1 CCNN MCULE-7630363192 [2,0,0,0,0,0|2,0,0]=4 984 B3R0.1 CCNN MCULE-8402230944 [2,0,0,0,0,0|2,0,0]=4 985 B3R0.1 CCNO MCULE-1215586669 [2,0,0,0,0,0|1,1,0]=4 986 B3R0.1 CCNO MCULE-7075818857 [2,0,0,0,0,0|1,1,0]=4 987 B3R0.1 CCON MCULE-5316082054 [2,0,0,0,0,0|2,0,0]=4 988 B3R0.1 CCON MCULE-6621418839 [2,0,0,0,0,0|2,0,0]=4 989 B3R0.1 CCO[NH3+] MCULE-7670481464 [2,0,0,0,0,0|2,0,0]=4 990 B3R0.1 CCO[NH3+] MCULE-7871083232 [2,0,0,0,0,0|2,0,0]=4 991 B3R0.1 CCSC MCULE-6944750263 [2,0,0,0,0,0|1,0,0]=3 992 B3R0.1 CNNC MCULE-5932476941 [2,0,0,0,0,0|2,0,0]=4 993 B3R0.1 CNNC MCULE-6419598860 [2,0,0,0,0,0|2,0,0]=4 994 B3R0.1 CNOC MCULE-1706082503 [2,0,0,0,0,0|2,0,0]=4 995 B3R0.1 CNOC MCULE-6224540090 [2,0,0,0,0,0|2,0,0]=4 996 B3R0.1 COCBr MCULE-2566721472 [2,0,0,0,0,0|2,0,0]=4 997 B3R0.1 COCCl MCULE-5928768006 [2,0,0,0,0,0|2,0,0]=4 998 B3R0.1 COCI MCULE-5215132549 [2,0,0,0,0,0|2,0,0]=4 999 B3R0.1 CSCCl MCULE-1281800596 [2,0,0,0,0,0|2,0,0]=4 1000 B3R0.1 CSSC MCULE-7451882535 [2,0,0,0,0,0|2,0,0]=4 1001 B3R0.1 C[Se][Se]C MCULE-1189700302 [2,0,0,0,0,0|2,0,0]=4 1002 B3R0.1 ClCCBr MCULE-3933774075 [2,0,0,0,0,0|2,0,0]=4 1003 B3R0.1 ClCCCl MCULE-3493741440 [2,0,0,0,0,0|2,0,0]=4 1004 B3R0.1 ClCCI MCULE-7847880962 [2,0,0,0,0,0|2,0,0]=4 1005 B3R0.1 FCCBr MCULE-3117974140 [2,0,0,0,0,0|2,0,0]=4 1006 B3R0.1 FCCCl MCULE-1862981403 [2,0,0,0,0,0|2,0,0]=4 1007 B3R0.1 FCCF MCULE-1975194621 [2,0,0,0,0,0|2,0,0]=4 1008 B3R0.1 FCCI MCULE-3689313503 [2,0,0,0,0,0|2,0,0]=4 1009 B3R0.1 ICCI MCULE-8025471988 [2,0,0,0,0,0|2,0,0]=4 1010 B3R0.1 NCCBr MCULE-3401124597 [2,0,0,0,0,0|2,0,0]=4 1011 B3R0.1 NCCBr MCULE-6215378497 [2,0,0,0,0,0|2,0,0]=4 1012 B3R0.1 NCCCl MCULE-1458699843 [2,0,0,0,0,0|2,0,0]=4 1013 B3R0.1 NCCCl MCULE-6944306112 [2,0,0,0,0,0|2,0,0]=4 1014 B3R0.1 NCCF MCULE-1670520169 [2,0,0,0,0,0|2,0,0]=4 1015 B3R0.1 NCCF MCULE-4963351029 [2,0,0,0,0,0|2,0,0]=4 1016 B3R0.1 NCCI MCULE-6905308399 [2,0,0,0,0,0|2,0,0]=4 1017 B3R0.1 NCCI MCULE-7487764362 [2,0,0,0,0,0|2,0,0]=4 1018 B3R0.1 NCCN MCULE-4740333723 [2,0,0,0,0,0|2,0,0]=4 1019 B3R0.1 NCCN MCULE-6795272853 [2,0,0,0,0,0|2,0,0]=4 1020 B3R0.1 NCCN MCULE-8304126024 [2,0,0,0,0,0|2,0,0]=4 1021 B3R0.1 NCCN MCULE-8325612144 [2,0,0,0,0,0|2,0,0]=4 1022 B3R0.1 NCCO MCULE-5175116598 [2,0,0,0,0,0|1,1,0]=4 1023 B3R0.1 NCCO MCULE-8624730373 [2,0,0,0,0,0|1,1,0]=4 1024 B3R0.1 NCCS MCULE-1838427828 [2,0,0,0,0,0|1,0,0]=3 1025 B3R0.1 NCCS MCULE-2418938683 [2,0,0,0,0,0|1,0,0]=3 1026 B3R0.1 OCCBr MCULE-5097256006 [2,0,0,0,0,0|1,1,0]=4 1027 B3R0.1 OCCCl MCULE-5139580173 [2,0,0,0,0,0|1,1,0]=4 1028 B3R0.1 OCCF MCULE-7590677201 [2,0,0,0,0,0|1,1,0]=4 1029 B3R0.1 OCCI MCULE-8359750387 [2,0,0,0,0,0|1,1,0]=4 1030 B3R0.1 OCCO MCULE-6366313128 [2,0,0,0,0,0|0,2,0]=4 1031 B3R0.1 OCCS MCULE-2252943288 [2,0,0,0,0,0|0,1,0]=3 1032 B3R0.1 PCCP MCULE-2159678577 [2,0,0,0,0,0|2,0,0]=4 1033 B3R0.1 SCCBr MCULE-5899941299 [2,0,0,0,0,0|1,0,0]=3 1034 B3R0.1 SCCS MCULE-8277435664 [2,0,0,0,0,0|0,0,0]=2 1035 B3R0.1 [NH3+]CCS MCULE-6407472407 [2,0,0,0,0,0|1,0,0]=3 1036 B3R0.1 [NH3+]CC[NH3+] MCULE-5313549416 [2,0,0,0,0,0|2,0,0]=4 1037 B3R0.2 BN(C)C MCULE-2470964161 [2,0,0,0,0,0|2,0,0]=4 1038 B3R0.2 C=C(C)C MCULE-5640095130 [2,0,0,0,0,0|1,0,1]=4 1039 B3R0.2 C=[N+](C)C MCULE-4450980212 [2,0,0,0,0,0|2,0,0]=4 1040 B3R0.2 C=[N+](C)C MCULE-5309464837 [2,0,0,0,0,0|2,0,0]=4 1041 B3R0.2 C=[N+](C)C MCULE-9321779445 [2,0,0,0,0,0|2,0,0]=4 1042 B3R0.2 CC(=O)C MCULE-6679625040 [2,0,0,0,0,0|0,1,1]=4 1043 B3R0.2 CC(=O)S MCULE-5769447035 [2,0,0,0,0,0|0,1,1]=4 1044 B3R0.2 CC(Br)Br MCULE-3156450089 [2,0,0,0,0,0|2,0,0]=4 1045 B3R0.2 CC(C)Br MCULE-4068304617 [2,0,0,0,0,0|1,0,0]=3 1046 B3R0.2 CC(C)C MCULE-6616676274 [2,0,0,0,0,0|1,0,0]=3 1047 B3R0.2 CC(C)Cl MCULE-3190141598 [2,0,0,0,0,0|1,0,0]=3 1048 B3R0.2 CC(C)F MCULE-5333357055 [2,0,0,0,0,0|1,0,0]=3 1049 B3R0.2 CC(C)I MCULE-6151711033 [2,0,0,0,0,0|1,0,0]=3 1050 B3R0.2 CC(C)N MCULE-1048799006 [2,0,0,0,0,0|1,0,0]=3 1051 B3R0.2 CC(C)N MCULE-1125416142 [2,0,0,0,0,0|1,0,0]=3 1052 B3R0.2 CC(C)N MCULE-2418429353 [2,0,0,0,0,0|1,0,0]=3 1053 B3R0.2 CC(C)N MCULE-7280647435 [2,0,0,0,0,0|1,0,0]=3 1054 B3R0.2 CC(C)O MCULE-6646752234 [2,0,0,0,0,0|0,1,0]=3 1055 B3R0.2 CC(C)S MCULE-8283942088 [2,0,0,0,0,0|0,0,0]=2 1056 B3R0.2 CC(Cl)Br MCULE-6166388747 [2,0,0,0,0,0|2,0,0]=4 1057 B3R0.2 CC(Cl)Cl MCULE-2444543893 [2,0,0,0,0,0|2,0,0]=4 1058 B3R0.2 CC(F)Cl MCULE-1350283946 [2,0,0,0,0,0|2,0,0]=4 1059 B3R0.2 CC(F)F MCULE-1642052461 [2,0,0,0,0,0|2,0,0]=4 1060 B3R0.2 CN(C)C MCULE-5179437979 [2,0,0,0,0,0|2,0,0]=4 1061 B3R0.2 CN(C)C MCULE-6816696733 [2,0,0,0,0,0|2,0,0]=4 1062 B3R0.2 CN(C)C MCULE-7903544426 [2,0,0,0,0,0|2,0,0]=4 1063 B3R0.2 CN(C)N MCULE-7177216911 [2,0,0,0,0,0|2,0,0]=4 1064 B3R0.2 CN(C)N MCULE-8775366011 [2,0,0,0,0,0|2,0,0]=4 1065 B3R0.2 CN(C)O MCULE-6572915706 [2,0,0,0,0,0|1,1,0]=4 1066 B3R0.2 CN(C)O MCULE-6950647562 [2,0,0,0,0,0|1,1,0]=4 1067 B3R0.2 CP(=O)C MCULE-6150886622 [2,0,0,0,0,0|1,1,0]=4 1068 B3R0.2 CP(C)C MCULE-6703190251 [2,0,0,0,0,0|2,0,0]=4 1069 B3R0.2 CS(=O)C MCULE-2005841258 [2,0,0,0,0,0|1,1,0]=4 1070 B3R0.2 C[Ga](C)C MCULE-6013775603 [2,0,0,0,0,0|2,0,0]=4 1071 B3R0.2 C[In](C)C MCULE-1424187192 [2,0,0,0,0,0|2,0,0]=4 1072 B3R0.2 C[O+](C)C MCULE-2925451414 [2,0,0,0,0,0|2,0,0]=4 1073 B3R0.2 C[S+](C)Br MCULE-2734391695 [2,0,0,0,0,0|2,0,0]=4 1074 B3R0.2 C[S+](C)Br MCULE-6411921824 [2,0,0,0,0,0|2,0,0]=4 1075 B3R0.2 C[S+](C)C MCULE-5867625832 [2,0,0,0,0,0|2,0,0]=4 1076 B3R0.2 C[S+](C)C MCULE-7678314643 [2,0,0,0,0,0|2,0,0]=4 1077 B3R0.2 C[S+](C)C MCULE-8005905986 [2,0,0,0,0,0|2,0,0]=4 1078 B3R0.2 C[Se](=O)C MCULE-4596040471 [2,0,0,0,0,0|1,1,0]=4 1079 B5R0.1 C#CCC(C)C MCULE-2506063278 [1,1,0,0,0,0|1,0,1]=4 1080 B5R0.1 C#CCC(C)N MCULE-1523044787 [1,1,0,0,0,0|1,0,1]=4 1081 B5R0.1 C#CCC(C)N MCULE-3399522488 [1,1,0,0,0,0|1,0,1]=4 1082 B5R0.1 C#CCC(C)O MCULE-2487589857 [1,1,0,0,0,0|0,1,1]=4 1083 B5R0.1 C(C)(N)CCC MCULE-4800297905 [1,1,0,0,0,0|1,0,0]=3 1084 B5R0.1 C(C)(N)CCC MCULE-7674864567 [1,1,0,0,0,0|1,0,0]=3 1085 B5R0.1 C(C)(N)CCO MCULE-5545469271 [1,1,0,0,0,0|1,0,0]=3 1086 B5R0.1 C/C=C/C(C)C MCULE-8705863155 [1,1,0,0,0,0|1,0,1]=4 1087 B5R0.1 C/C=C/C(C)O MCULE-3191147789 [1,1,0,0,0,0|0,1,1]=4 1088 B5R0.1 C=C(C)CCBr MCULE-3439794005 [1,1,0,0,0,0|1,0,1]=4 1089 B5R0.1 C=C(C)CCC MCULE-8225129744 [1,1,0,0,0,0|1,0,1]=4 1090 B5R0.1 C=C(C)CCCl MCULE-2816016781 [1,1,0,0,0,0|1,0,1]=4 1091 B5R0.1 C=C(C)CCI MCULE-6317205481 [1,1,0,0,0,0|1,0,1]=4 1092 B5R0.1 C=C(C)CCN MCULE-4037025602 [1,1,0,0,0,0|1,0,1]=4 1093 B5R0.1 C=C(C)CCN MCULE-5001503744 [1,1,0,0,0,0|1,0,1]=4 1094 B5R0.1 C=C(C)CCO MCULE-2689800711 [1,1,0,0,0,0|1,0,1]=4 1095 B5R0.1 C=C(C)CNC MCULE-6783886553 [1,1,0,0,0,0|1,0,1]=4 1096 B5R0.1 C=C(C)CNC MCULE-8292313282 [1,1,0,0,0,0|1,0,1]=4 1097 B5R0.1 C=C(C)OCC MCULE-5303468686 [1,1,0,0,0,0|1,0,1]=4 1098 B5R0.1 C=CCC(C)Br MCULE-5638987302 [1,1,0,0,0,0|1,0,1]=4 1099 B5R0.1 C=CCC(C)C MCULE-4586731422 [1,1,0,0,0,0|1,0,1]=4 1100 B5R0.1 C=CCC(C)N MCULE-5354228552 [1,1,0,0,0,0|1,0,1]=4 1101 B5R0.1 C=CCC(C)N MCULE-9454660067 [1,1,0,0,0,0|1,0,1]=4 1102 B5R0.1 C=CCC(C)O MCULE-7724200334 [1,1,0,0,0,0|0,1,1]=4 1103 B5R0.1 C=CCC(C)O MCULE-9910771503 [1,1,0,0,0,0|0,1,1]=4 1104 B5R0.1 C=CC[C@@H](C)O MCULE-1663575568 [1,1,0,0,0,0|0,1,1]=4 1105 B5R0.1 C=CC[C@@H](C)O MCULE-3971480179 [1,1,0,0,0,0|0,1,1]=4 1106 B5R0.1 C=CC[C@H](C)N MCULE-2398654329 [1,1,0,0,0,0|1,0,1]=4 1107 B5R0.1 C=CC[C@H](C)N MCULE-5817451810 [1,1,0,0,0,0|1,0,1]=4 1108 B5R0.1 C=CC[C@H](C)O MCULE-5783959808 [1,1,0,0,0,0|0,1,1]=4 1109 B5R0.1 C=CC[C@H](C)O MCULE-6146696600 [1,1,0,0,0,0|0,1,1]=4 1110 B5R0.1 CC#CC(C)C MCULE-9841369985 [1,1,0,0,0,0|1,0,1]=4 1111 B5R0.1 CC#CC(C)O MCULE-5523814936 [1,1,0,0,0,0|0,1,1]=4 1112 B5R0.1 CC(=CCS)C MCULE-4180446913 [1,1,0,0,0,0|1,0,1]=4 1113 B5R0.1 CC(=O)CCBr MCULE-2615300206 [1,1,0,0,0,0|0,1,1]=4 1114 B5R0.1 CC(=O)CCCl MCULE-8019748964 [1,1,0,0,0,0|0,1,1]=4 1115 B5R0.1 CC(=O)CCN MCULE-7550348751 [1,1,0,0,0,0|0,1,1]=4 1116 B5R0.1 CC(=O)CCN MCULE-9519063810 [1,1,0,0,0,0|0,1,1]=4 1117 B5R0.1 CC(=O)CCO MCULE-6328537335 [1,1,0,0,0,0|0,1,1]=4 1118 B5R0.1 CC(Br)CC#N MCULE-6321379216 [1,1,0,0,0,0|1,0,1]=4 1119 B5R0.1 CC(Br)CCBr MCULE-1045475402 [1,1,0,0,0,0|1,0,0]=3 1120 B5R0.1 CC(C)CC#N MCULE-4346986727 [1,1,0,0,0,0|1,0,1]=4 1121 B5R0.1 CC(C)CC=O MCULE-2939497534 [1,1,0,0,0,0|1,0,1]=4 1122 B5R0.1 CC(C)CCBr MCULE-7163010428 [1,1,0,0,0,0|1,0,0]=3 1123 B5R0.1 CC(C)CCCl MCULE-8360122696 [1,1,0,0,0,0|1,0,0]=3 1124 B5R0.1 CC(C)CCCl MCULE-9017922949 [1,1,0,0,0,0|1,0,0]=3 1125 B5R0.1 CC(C)CCI MCULE-4934529500 [1,1,0,0,0,0|1,0,0]=3 1126 B5R0.1 CC(C)CCN MCULE-3081003576 [1,1,0,0,0,0|1,0,0]=3 1127 B5R0.1 CC(C)CCN MCULE-5118782389 [1,1,0,0,0,0|1,0,0]=3 1128 B5R0.1 CC(C)CCN MCULE-5217981670 [1,1,0,0,0,0|1,0,0]=3 1129 B5R0.1 CC(C)CCN MCULE-6280940933 [1,1,0,0,0,0|1,0,0]=3 1130 B5R0.1 CC(C)CCO MCULE-7411270401 [1,1,0,0,0,0|1,0,0]=3 1131 B5R0.1 CC(C)CCS MCULE-7115473363 [1,1,0,0,0,0|1,0,0]=3 1132 B5R0.1 CC(C)CNN MCULE-6797887001 [1,1,0,0,0,0|2,0,0]=4 1133 B5R0.1 CC(C)CNN MCULE-9592971233 [1,1,0,0,0,0|2,0,0]=4 1134 B5R0.1 CC(C)CNN MCULE-9725792452 [1,1,0,0,0,0|2,0,0]=4 1135 B5R0.1 CC(C)CON MCULE-3476786246 [1,1,0,0,0,0|1,1,0]=4 1136 B5R0.1 CC(C)CON MCULE-4450654727 [1,1,0,0,0,0|1,1,0]=4 1137 B5R0.1 CC(C)OCCl MCULE-3680602217 [1,1,0,0,0,0|2,0,0]=4 1138 B5R0.1 CC(C)SCCl MCULE-3836735379 [1,1,0,0,0,0|2,0,0]=4 1139 B5R0.1 CC(Cl)CCCl MCULE-3656498608 [1,1,0,0,0,0|1,0,0]=3 1140 B5R0.1 CC(Cl)CCO MCULE-1955496242 [1,1,0,0,0,0|1,0,0]=3 1141 B5R0.1 CC(F)CCBr MCULE-3035340901 [1,1,0,0,0,0|1,0,0]=3 1142 B5R0.1 CC(F)CCI MCULE-6469250150 [1,1,0,0,0,0|1,0,0]=3 1143 B5R0.1 CC(F)CCN MCULE-2805813131 [1,1,0,0,0,0|1,0,0]=3 1144 B5R0.1 CC(F)CCN MCULE-5849913362 [1,1,0,0,0,0|1,0,0]=3 1145 B5R0.1 CC(N)CC#N MCULE-2350352782 [1,1,0,0,0,0|1,0,1]=4 1146 B5R0.1 CC(N)CC#N MCULE-7269201059 [1,1,0,0,0,0|1,0,1]=4 1147 B5R0.1 CC(N)CCN MCULE-5308134596 [1,1,0,0,0,0|1,0,0]=3 1148 B5R0.1 CC(N)CCN MCULE-5880045507 [1,1,0,0,0,0|1,0,0]=3 1149 B5R0.1 CC(N)CCN MCULE-7827515430 [1,1,0,0,0,0|1,0,0]=3 1150 B5R0.1 CC(N)CCO MCULE-1771399942 [1,1,0,0,0,0|1,0,0]=3 1151 B5R0.1 CC(N)CCO MCULE-7239872808 [1,1,0,0,0,0|1,0,0]=3 1152 B5R0.1 CC(O)CC#N MCULE-7172428142 [1,1,0,0,0,0|0,1,1]=4 1153 B5R0.1 CC(O)CCBr MCULE-7983169885 [1,1,0,0,0,0|0,1,0]=3 1154 B5R0.1 CC(O)CCCl MCULE-2952545606 [1,1,0,0,0,0|0,1,0]=3 1155 B5R0.1 CC(O)CCN MCULE-6836791276 [1,1,0,0,0,0|0,1,0]=3 1156 B5R0.1 CC(O)CCN MCULE-7186260925 [1,1,0,0,0,0|0,1,0]=3 1157 B5R0.1 CC(O)CCO MCULE-1694239851 [1,1,0,0,0,0|0,1,0]=3 1158 B5R0.1 CC(O)CCO MCULE-7784884948 [1,1,0,0,0,0|0,1,0]=3 1159 B5R0.1 CC(O)CNN MCULE-4956670781 [1,1,0,0,0,0|1,1,0]=4 1160 B5R0.1 CC(O)CNN MCULE-7917439573 [1,1,0,0,0,0|1,1,0]=4 1161 B5R0.1 CC(O)CON MCULE-1051091134 [1,1,0,0,0,0|0,2,0]=4 1162 B5R0.1 CC(O)CON MCULE-6722092589 [1,1,0,0,0,0|0,2,0]=4 1163 B5R0.1 CC(S)CCO MCULE-5702212503 [1,1,0,0,0,0|0,0,0]=2 1164 B5R0.1 CC=CC(C)C MCULE-9898453837 [1,1,0,0,0,0|1,0,1]=4 1165 B5R0.1 CC=CC(C)O MCULE-4806592836 [1,1,0,0,0,0|0,1,1]=4 1166 B5R0.1 CCC=C(C)C MCULE-2405063894 [1,1,0,0,0,0|1,0,1]=4 1167 B5R0.1 CCCC(=O)C MCULE-7174095676 [1,1,0,0,0,0|0,1,1]=4 1168 B5R0.1 CCCC(C)Br MCULE-3178073667 [1,1,0,0,0,0|1,0,0]=3 1169 B5R0.1 CCCC(C)C MCULE-9604552974 [1,1,0,0,0,0|1,0,0]=3 1170 B5R0.1 CCCC(C)N MCULE-2640298430 [1,1,0,0,0,0|1,0,0]=3 1171 B5R0.1 CCCC(C)N MCULE-7225905167 [1,1,0,0,0,0|1,0,0]=3 1172 B5R0.1 CCCC(C)O MCULE-8205906299 [1,1,0,0,0,0|0,1,0]=3 1173 B5R0.1 CCCC(C)S MCULE-1649095713 [1,1,0,0,0,0|0,0,0]=2 1174 B5R0.1 CCCC(O)Cl MCULE-3188577082 [1,1,0,0,0,0|1,1,0]=4 1175 B5R0.1 CCCN(C)C MCULE-8702643596 [1,1,0,0,0,0|2,0,0]=4 1176 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [1,1,0,0,0,0|1,0,0]=3 1177 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [1,1,0,0,0,0|1,0,0]=3 1178 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [1,1,0,0,0,0|1,0,0]=3 1179 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [1,1,0,0,0,0|1,0,0]=3 1180 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [1,1,0,0,0,0|0,1,0]=3 1181 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [1,1,0,0,0,0|1,0,0]=3 1182 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [1,1,0,0,0,0|1,0,0]=3 1183 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [1,1,0,0,0,0|1,0,0]=3 1184 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [1,1,0,0,0,0|1,0,0]=3 1185 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [1,1,0,0,0,0|0,1,0]=3 1186 B5R0.1 CCNC(=O)C MCULE-7543656350 [1,1,0,0,0,0|0,1,1]=4 1187 B5R0.1 CCNC(C)C MCULE-8064118469 [1,1,0,0,0,0|1,0,0]=3 1188 B5R0.1 CCOC(=N)C MCULE-3060267072 [1,1,0,0,0,0|1,0,1]=4 1189 B5R0.1 CCOC(=N)C MCULE-3943786182 [1,1,0,0,0,0|1,0,1]=4 1190 B5R0.1 CCOC(=O)C MCULE-6628539781 [1,1,0,0,0,0|0,1,1]=4 1191 B5R0.1 CCOC(=S)C MCULE-3358897597 [1,1,0,0,0,0|0,0,2]=4 1192 B5R0.1 CCOC(C)C MCULE-1934548340 [1,1,0,0,0,0|1,0,0]=3 1193 B5R0.1 CCOC(C)Cl MCULE-8486994638 [1,1,0,0,0,0|1,0,0]=3 1194 B5R0.1 CCSC(=O)C MCULE-8015440229 [1,1,0,0,0,0|0,1,1]=4 1195 B5R0.1 CCSC(=S)C MCULE-1502137460 [1,1,0,0,0,0|0,0,2]=4 1196 B5R0.1 CCSC(C)C MCULE-3738251898 [1,1,0,0,0,0|1,0,0]=3 1197 B5R0.1 CN(C)CCBr MCULE-4844398053 [1,1,0,0,0,0|2,0,0]=4 1198 B5R0.1 CN(C)CCCl MCULE-4297554717 [1,1,0,0,0,0|2,0,0]=4 1199 B5R0.1 CN(C)CCCl MCULE-4465544992 [1,1,0,0,0,0|2,0,0]=4 1200 B5R0.1 CN(C)CCI MCULE-4687894526 [1,1,0,0,0,0|2,0,0]=4 1201 B5R0.1 CN(C)CCI MCULE-7464680246 [1,1,0,0,0,0|2,0,0]=4 1202 B5R0.1 CN(C)CCI MCULE-9051868668 [1,1,0,0,0,0|2,0,0]=4 1203 B5R0.1 CN(C)CCN MCULE-6693759372 [1,1,0,0,0,0|2,0,0]=4 1204 B5R0.1 CN(C)CCN MCULE-6929925748 [1,1,0,0,0,0|2,0,0]=4 1205 B5R0.1 CN(C)CCN MCULE-7881547574 [1,1,0,0,0,0|2,0,0]=4 1206 B5R0.1 CN(C)CCO MCULE-5715813465 [1,1,0,0,0,0|2,0,0]=4 1207 B5R0.1 CN(C)CCO MCULE-7567469160 [1,1,0,0,0,0|2,0,0]=4 1208 B5R0.1 CN(C)CCO MCULE-9024108074 [1,1,0,0,0,0|2,0,0]=4 1209 B5R0.1 CN(C)CCS MCULE-4356815596 [1,1,0,0,0,0|2,0,0]=4 1210 B5R0.1 CN(C)CCS MCULE-4611688723 [1,1,0,0,0,0|2,0,0]=4 1211 B5R0.1 CN(C)CCS MCULE-6259585517 [1,1,0,0,0,0|2,0,0]=4 1212 B5R0.1 CN(N)CCN MCULE-2782966878 [1,1,0,0,0,0|2,0,0]=4 1213 B5R0.1 CNCC(=O)C MCULE-3695443024 [1,1,0,0,0,0|0,1,1]=4 1214 B5R0.1 CNCC(=O)C MCULE-7402723072 [1,1,0,0,0,0|0,1,1]=4 1215 B5R0.1 CNCC(C)C MCULE-6582386339 [1,1,0,0,0,0|1,0,0]=3 1216 B5R0.1 CNCC(C)C MCULE-6856717783 [1,1,0,0,0,0|1,0,0]=3 1217 B5R0.1 CNCC(C)F MCULE-4381138647 [1,1,0,0,0,0|1,0,0]=3 1218 B5R0.1 CNCC(C)F MCULE-9018181183 [1,1,0,0,0,0|1,0,0]=3 1219 B5R0.1 CNCC(C)O MCULE-3671071529 [1,1,0,0,0,0|0,1,0]=3 1220 B5R0.1 CNCC(C)O MCULE-4171705304 [1,1,0,0,0,0|0,1,0]=3 1221 B5R0.1 CNCC(Cl)Cl MCULE-1176483469 [1,1,0,0,0,0|2,0,0]=4 1222 B5R0.1 CNCC(Cl)Cl MCULE-8474434261 [1,1,0,0,0,0|2,0,0]=4 1223 B5R0.1 CNCC(F)F MCULE-3004221847 [1,1,0,0,0,0|2,0,0]=4 1224 B5R0.1 CNCC(F)F MCULE-5997956111 [1,1,0,0,0,0|2,0,0]=4 1225 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [1,1,0,0,0,0|0,1,0]=3 1226 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [1,1,0,0,0,0|0,1,0]=3 1227 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [1,1,0,0,0,0|0,1,0]=3 1228 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [1,1,0,0,0,0|0,1,0]=3 1229 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [1,1,0,0,0,0|0,1,0]=3 1230 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [1,1,0,0,0,0|0,1,0]=3 1231 B5R0.1 COCC(=O)C MCULE-7262197587 [1,1,0,0,0,0|0,1,1]=4 1232 B5R0.1 COCC(C)Br MCULE-6850689931 [1,1,0,0,0,0|1,0,0]=3 1233 B5R0.1 COCC(C)I MCULE-8608265714 [1,1,0,0,0,0|1,0,0]=3 1234 B5R0.1 COCC(C)N MCULE-1896873634 [1,1,0,0,0,0|1,0,0]=3 1235 B5R0.1 COCC(C)N MCULE-2549420211 [1,1,0,0,0,0|1,0,0]=3 1236 B5R0.1 COCC(C)N MCULE-3490410444 [1,1,0,0,0,0|1,0,0]=3 1237 B5R0.1 COCC(C)N MCULE-7089888882 [1,1,0,0,0,0|1,0,0]=3 1238 B5R0.1 COCC(C)O MCULE-4022733014 [1,1,0,0,0,0|0,1,0]=3 1239 B5R0.1 COCC(C)O MCULE-7513310960 [1,1,0,0,0,0|0,1,0]=3 1240 B5R0.1 COCN(C)C MCULE-1963225930 [1,1,0,0,0,0|2,0,0]=4 1241 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [1,1,0,0,0,0|1,0,0]=3 1242 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [1,1,0,0,0,0|1,0,0]=3 1243 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [1,1,0,0,0,0|1,0,0]=3 1244 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [1,1,0,0,0,0|1,0,0]=3 1245 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [1,1,0,0,0,0|0,1,0]=3 1246 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [1,1,0,0,0,0|0,1,0]=3 1247 B5R0.1 COC[C@H](C)N MCULE-2465679418 [1,1,0,0,0,0|1,0,0]=3 1248 B5R0.1 COC[C@H](C)N MCULE-2998593539 [1,1,0,0,0,0|1,0,0]=3 1249 B5R0.1 COC[C@H](C)N MCULE-3161045661 [1,1,0,0,0,0|1,0,0]=3 1250 B5R0.1 COC[C@H](C)N MCULE-9550165578 [1,1,0,0,0,0|1,0,0]=3 1251 B5R0.1 COC[C@H](C)O MCULE-5908531683 [1,1,0,0,0,0|0,1,0]=3 1252 B5R0.1 COC[C@H](C)O MCULE-8619138238 [1,1,0,0,0,0|0,1,0]=3 1253 B5R0.1 CS(=O)CCBr MCULE-7846126230 [1,1,0,0,0,0|1,1,0]=4 1254 B5R0.1 CS(=O)CCCl MCULE-7012781505 [1,1,0,0,0,0|1,1,0]=4 1255 B5R0.1 CS(=O)CCN MCULE-6497874560 [1,1,0,0,0,0|1,1,0]=4 1256 B5R0.1 CS(=O)CCN MCULE-8275663766 [1,1,0,0,0,0|1,1,0]=4 1257 B5R0.1 CS(=O)CCN MCULE-8330490290 [1,1,0,0,0,0|1,1,0]=4 1258 B5R0.1 CS(=O)CCO MCULE-8331553582 [1,1,0,0,0,0|1,1,0]=4 1259 B5R0.1 CSCC(=O)C MCULE-4131794172 [1,1,0,0,0,0|0,1,1]=4 1260 B5R0.1 CSCC(C)N MCULE-7985946030 [1,1,0,0,0,0|1,0,0]=3 1261 B5R0.1 CSCC(C)O MCULE-2227652351 [1,1,0,0,0,0|0,1,0]=3 1262 B5R0.1 CSCN(C)C MCULE-2931143051 [1,1,0,0,0,0|2,0,0]=4 1263 B5R0.1 CSCS(=O)C MCULE-3167702486 [1,1,0,0,0,0|1,1,0]=4 1264 B5R0.1 C[C@@H](N)CC#N MCULE-1923686728 [1,1,0,0,0,0|1,0,1]=4 1265 B5R0.1 C[C@@H](N)CC#N MCULE-5694530830 [1,1,0,0,0,0|1,0,1]=4 1266 B5R0.1 C[C@@H](N)CC#N MCULE-8880445785 [1,1,0,0,0,0|1,0,1]=4 1267 B5R0.1 C[C@@H](N)CC#N MCULE-9410509782 [1,1,0,0,0,0|1,0,1]=4 1268 B5R0.1 C[C@@H](N)CCO MCULE-4224878672 [1,1,0,0,0,0|1,0,0]=3 1269 B5R0.1 C[C@@H](N)CCO MCULE-5727539473 [1,1,0,0,0,0|1,0,0]=3 1270 B5R0.1 C[C@@H](O)CC#N MCULE-2879004464 [1,1,0,0,0,0|0,1,1]=4 1271 B5R0.1 C[C@@H](O)CCN MCULE-7588849994 [1,1,0,0,0,0|0,1,0]=3 1272 B5R0.1 C[C@@H](O)CCN MCULE-7895006310 [1,1,0,0,0,0|0,1,0]=3 1273 B5R0.1 C[C@@H](O)CCN MCULE-9071323255 [1,1,0,0,0,0|0,1,0]=3 1274 B5R0.1 C[C@@H](O)CCN MCULE-9627550610 [1,1,0,0,0,0|0,1,0]=3 1275 B5R0.1 C[C@@H](O)CCO MCULE-6277947442 [1,1,0,0,0,0|0,1,0]=3 1276 B5R0.1 C[C@@H](O)CCO MCULE-9742368348 [1,1,0,0,0,0|0,1,0]=3 1277 B5R0.1 C[C@@H](O)CON MCULE-3740397343 [1,1,0,0,0,0|0,2,0]=4 1278 B5R0.1 C[C@@H](O)CON MCULE-8274376872 [1,1,0,0,0,0|0,2,0]=4 1279 B5R0.1 C[C@H](N)CC#N MCULE-1876010727 [1,1,0,0,0,0|1,0,1]=4 1280 B5R0.1 C[C@H](N)CC#N MCULE-6927344020 [1,1,0,0,0,0|1,0,1]=4 1281 B5R0.1 C[C@H](N)CC#N MCULE-9082410813 [1,1,0,0,0,0|1,0,1]=4 1282 B5R0.1 C[C@H](N)CC#N MCULE-9498047771 [1,1,0,0,0,0|1,0,1]=4 1283 B5R0.1 C[C@H](N)CCO MCULE-1496375567 [1,1,0,0,0,0|1,0,0]=3 1284 B5R0.1 C[C@H](N)CCO MCULE-4744824708 [1,1,0,0,0,0|1,0,0]=3 1285 B5R0.1 C[C@H](N)CCO MCULE-7219173683 [1,1,0,0,0,0|1,0,0]=3 1286 B5R0.1 C[C@H](N)CCO MCULE-9164942837 [1,1,0,0,0,0|1,0,0]=3 1287 B5R0.1 C[C@H](O)CC#N MCULE-1968982761 [1,1,0,0,0,0|0,1,1]=4 1288 B5R0.1 C[C@H](O)CCN MCULE-7570743309 [1,1,0,0,0,0|0,1,0]=3 1289 B5R0.1 C[C@H](O)CCN MCULE-9428853702 [1,1,0,0,0,0|0,1,0]=3 1290 B5R0.1 C[C@H](O)CCO MCULE-2504912618 [1,1,0,0,0,0|0,1,0]=3 1291 B5R0.1 C[C@H](O)CCO MCULE-2958119786 [1,1,0,0,0,0|0,1,0]=3 1292 B5R0.1 C[C@H](O)CON MCULE-4216605221 [1,1,0,0,0,0|0,2,0]=4 1293 B5R0.1 C[C@H](O)CON MCULE-9863094719 [1,1,0,0,0,0|0,2,0]=4 1294 B5R0.1 C[NH+](C)CCBr MCULE-4990293495 [1,1,0,0,0,0|2,0,0]=4 1295 B5R0.1 C[S+](C)CCCl MCULE-1305595131 [1,1,0,0,0,0|2,0,0]=4 1296 B5R0.1 C[S+](C)CCCl MCULE-9761617787 [1,1,0,0,0,0|2,0,0]=4 1297 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [1,1,0,0,0,0|1,1,0]=4 1298 B5R0.1 NCCC(F)F MCULE-3610134573 [1,1,0,0,0,0|2,0,0]=4 1299 B5R0.1 NCCC(F)F MCULE-5561095460 [1,1,0,0,0,0|2,0,0]=4 1300 B5R0.1 OCCC(F)F MCULE-9207688926 [1,1,0,0,0,0|2,0,0]=4 1301 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [1,1,0,0,0,0|0,1,0]=3 1302 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [1,1,0,0,0,0|0,1,0]=3 1303 B5R0.1 [C@H](C)(O)CC#N MCULE-6894178072 [1,1,0,0,0,0|0,1,1]=4 1304 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [1,1,0,0,0,0|0,1,0]=3 1305 B5R0.3 BrCC(Br)CBr MCULE-7323713039 [1,1,0,0,0,0|2,0,0]=4 1306 B5R0.3 C#CC(C)NC MCULE-6738130869 [1,1,0,0,0,0|2,0,0]=4 1307 B5R0.3 C#CC(C)OC MCULE-3702592933 [1,1,0,0,0,0|2,0,0]=4 1308 B5R0.3 C#CC(C)OC MCULE-3806443816 [1,1,0,0,0,0|2,0,0]=4 1309 B5R0.3 C#CC(N)CC MCULE-2327605941 [1,1,0,0,0,0|1,0,1]=4 1310 B5R0.3 C#CC(N)CC MCULE-3572771620 [1,1,0,0,0,0|1,0,1]=4 1311 B5R0.3 C#CC(O)CC MCULE-9890863731 [1,1,0,0,0,0|0,1,1]=4 1312 B5R0.3 C#C[C@H](C)OC MCULE-9002531152 [1,1,0,0,0,0|2,0,0]=4 1313 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [1,1,0,0,0,0|1,0,1]=4 1314 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [1,1,0,0,0,0|1,0,1]=4 1315 B5R0.3 C=C(CC)CBr MCULE-1652422688 [1,1,0,0,0,0|1,0,1]=4 1316 B5R0.3 C=C(CC)CC MCULE-9174509622 [1,1,0,0,0,0|1,0,1]=4 1317 B5R0.3 C=C(CC)CN MCULE-2269385026 [1,1,0,0,0,0|1,0,1]=4 1318 B5R0.3 C=C(CC)CN MCULE-3033447984 [1,1,0,0,0,0|1,0,1]=4 1319 B5R0.3 C=C(CC)CO MCULE-8127766352 [1,1,0,0,0,0|1,0,1]=4 1320 B5R0.3 C=CC(C)CC MCULE-8112547661 [1,1,0,0,0,0|1,0,0]=3 1321 B5R0.3 C=CC(C)NC MCULE-1929679074 [1,1,0,0,0,0|2,0,0]=4 1322 B5R0.3 C=CC(C)NC MCULE-6382339452 [1,1,0,0,0,0|2,0,0]=4 1323 B5R0.3 C=CC(N)CC MCULE-6270835453 [1,1,0,0,0,0|1,0,1]=4 1324 B5R0.3 C=CC(N)CC MCULE-7920121163 [1,1,0,0,0,0|1,0,1]=4 1325 B5R0.3 C=CC(O)CC MCULE-2794806228 [1,1,0,0,0,0|0,1,1]=4 1326 B5R0.3 CC(=NO)CS MCULE-9694340512 [1,1,0,0,0,0|0,1,1]=4 1327 B5R0.3 CC(C#N)CCl MCULE-9290621020 [1,1,0,0,0,0|2,0,0]=4 1328 B5R0.3 CC(C#N)CN MCULE-8151367276 [1,1,0,0,0,0|2,0,0]=4 1329 B5R0.3 CC(C#N)CO MCULE-1644391554 [1,1,0,0,0,0|1,1,0]=4 1330 B5R0.3 CC(CBr)CBr MCULE-7586113999 [1,1,0,0,0,0|2,0,0]=4 1331 B5R0.3 CC(CCl)CBr MCULE-5101754687 [1,1,0,0,0,0|2,0,0]=4 1332 B5R0.3 CC(CCl)CCl MCULE-1169456620 [1,1,0,0,0,0|2,0,0]=4 1333 B5R0.3 CC(CI)CI MCULE-4568725580 [1,1,0,0,0,0|2,0,0]=4 1334 B5R0.3 CC(CN)CCl MCULE-2423692318 [1,1,0,0,0,0|2,0,0]=4 1335 B5R0.3 CC(CN)CCl MCULE-8419541212 [1,1,0,0,0,0|2,0,0]=4 1336 B5R0.3 CC(CN)CN MCULE-1464804013 [1,1,0,0,0,0|2,0,0]=4 1337 B5R0.3 CC(CN)CN MCULE-3273307813 [1,1,0,0,0,0|2,0,0]=4 1338 B5R0.3 CC(CN)CO MCULE-5880795484 [1,1,0,0,0,0|1,1,0]=4 1339 B5R0.3 CC(CN)CO MCULE-8083007887 [1,1,0,0,0,0|1,1,0]=4 1340 B5R0.3 CC(CO)CBr MCULE-3815333295 [1,1,0,0,0,0|1,1,0]=4 1341 B5R0.3 CC(CO)CBr MCULE-5695891877 [1,1,0,0,0,0|1,1,0]=4 1342 B5R0.3 CC(CO)CO MCULE-2340730326 [1,1,0,0,0,0|0,2,0]=4 1343 B5R0.3 CC(CO)CS MCULE-1990992504 [1,1,0,0,0,0|0,1,0]=3 1344 B5R0.3 CC(CO)NN MCULE-3362748538 [1,1,0,0,0,0|1,1,0]=4 1345 B5R0.3 CC(CO)NN MCULE-4440318216 [1,1,0,0,0,0|1,1,0]=4 1346 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [1,1,0,0,0,0|0,1,1]=4 1347 B5R0.3 CC=C(C)CC MCULE-5790494157 [1,1,0,0,0,0|1,0,1]=4 1348 B5R0.3 CCC(=N)OC MCULE-4123543795 [1,1,0,0,0,0|1,0,1]=4 1349 B5R0.3 CCC(=N)OC MCULE-5346320805 [1,1,0,0,0,0|1,0,1]=4 1350 B5R0.3 CCC(=NO)C MCULE-1859652505 [1,1,0,0,0,0|0,1,1]=4 1351 B5R0.3 CCC(=O)CBr MCULE-7825573294 [1,1,0,0,0,0|0,1,1]=4 1352 B5R0.3 CCC(=O)CC MCULE-8236549739 [1,1,0,0,0,0|0,1,1]=4 1353 B5R0.3 CCC(=O)CCl MCULE-9019890380 [1,1,0,0,0,0|0,1,1]=4 1354 B5R0.3 CCC(=O)CN MCULE-1863418812 [1,1,0,0,0,0|0,1,1]=4 1355 B5R0.3 CCC(=O)CN MCULE-5831164340 [1,1,0,0,0,0|0,1,1]=4 1356 B5R0.3 CCC(=O)CO MCULE-8674894820 [1,1,0,0,0,0|0,1,1]=4 1357 B5R0.3 CCC(=O)NC MCULE-5612060170 [1,1,0,0,0,0|0,1,1]=4 1358 B5R0.3 CCC(=O)OC MCULE-7384824725 [1,1,0,0,0,0|0,1,1]=4 1359 B5R0.3 CCC(=O)SC MCULE-9712192191 [1,1,0,0,0,0|0,1,1]=4 1360 B5R0.3 CCC(Br)C#N MCULE-4015907163 [1,1,0,0,0,0|1,0,1]=4 1361 B5R0.3 CCC(Br)C=O MCULE-3064952987 [1,1,0,0,0,0|1,0,1]=4 1362 B5R0.3 CCC(Br)CBr MCULE-5254958560 [1,1,0,0,0,0|1,0,0]=3 1363 B5R0.3 CCC(Br)CC MCULE-7435628721 [1,1,0,0,0,0|1,0,0]=3 1364 B5R0.3 CCC(Br)CO MCULE-7211805716 [1,1,0,0,0,0|1,0,0]=3 1365 B5R0.3 CCC(C)C#N MCULE-6204122967 [1,1,0,0,0,0|1,0,0]=3 1366 B5R0.3 CCC(C)C=O MCULE-2523669899 [1,1,0,0,0,0|0,1,0]=3 1367 B5R0.3 CCC(C)CBr MCULE-5451416952 [1,1,0,0,0,0|1,0,0]=3 1368 B5R0.3 CCC(C)CC MCULE-2542807917 [1,1,0,0,0,0|1,0,0]=3 1369 B5R0.3 CCC(C)CCl MCULE-7450386476 [1,1,0,0,0,0|1,0,0]=3 1370 B5R0.3 CCC(C)CI MCULE-5444509280 [1,1,0,0,0,0|1,0,0]=3 1371 B5R0.3 CCC(C)CN MCULE-2777327284 [1,1,0,0,0,0|1,0,0]=3 1372 B5R0.3 CCC(C)CN MCULE-7014901600 [1,1,0,0,0,0|1,0,0]=3 1373 B5R0.3 CCC(C)CO MCULE-6521026296 [1,1,0,0,0,0|0,1,0]=3 1374 B5R0.3 CCC(C)CS MCULE-7795095685 [1,1,0,0,0,0|0,0,0]=2 1375 B5R0.3 CCC(C)NC MCULE-2676584804 [1,1,0,0,0,0|1,0,0]=3 1376 B5R0.3 CCC(C)NC MCULE-6158046887 [1,1,0,0,0,0|1,0,0]=3 1377 B5R0.3 CCC(C)NN MCULE-6074476998 [1,1,0,0,0,0|1,0,0]=3 1378 B5R0.3 CCC(C)NN MCULE-8130021960 [1,1,0,0,0,0|1,0,0]=3 1379 B5R0.3 CCC(C)NN MCULE-8519369369 [1,1,0,0,0,0|1,0,0]=3 1380 B5R0.3 CCC(C)NO MCULE-1247092627 [1,1,0,0,0,0|0,1,0]=3 1381 B5R0.3 CCC(C)NO MCULE-6169819668 [1,1,0,0,0,0|0,1,0]=3 1382 B5R0.3 CCC(C)OC MCULE-7354431606 [1,1,0,0,0,0|0,1,0]=3 1383 B5R0.3 CCC(C)ON MCULE-2907890438 [1,1,0,0,0,0|0,1,0]=3 1384 B5R0.3 CCC(C)ON MCULE-4364205813 [1,1,0,0,0,0|0,1,0]=3 1385 B5R0.3 CCC(Cl)C#N MCULE-7185233128 [1,1,0,0,0,0|1,0,1]=4 1386 B5R0.3 CCC(Cl)C=O MCULE-5238776091 [1,1,0,0,0,0|1,0,1]=4 1387 B5R0.3 CCC(Cl)CCl MCULE-5122022797 [1,1,0,0,0,0|1,0,0]=3 1388 B5R0.3 CCC(Cl)CO MCULE-1756262629 [1,1,0,0,0,0|1,0,0]=3 1389 B5R0.3 CCC(F)CBr MCULE-3226052264 [1,1,0,0,0,0|1,0,0]=3 1390 B5R0.3 CCC(F)CN MCULE-1291385596 [1,1,0,0,0,0|1,0,0]=3 1391 B5R0.3 CCC(F)CN MCULE-7421331323 [1,1,0,0,0,0|1,0,0]=3 1392 B5R0.3 CCC(I)CC MCULE-1119844552 [1,1,0,0,0,0|1,0,0]=3 1393 B5R0.3 CCC(N)C#N MCULE-1350483203 [1,1,0,0,0,0|1,0,1]=4 1394 B5R0.3 CCC(N)C#N MCULE-3867024162 [1,1,0,0,0,0|1,0,1]=4 1395 B5R0.3 CCC(N)CBr MCULE-3567691924 [1,1,0,0,0,0|1,0,0]=3 1396 B5R0.3 CCC(N)CC MCULE-4261937519 [1,1,0,0,0,0|1,0,0]=3 1397 B5R0.3 CCC(N)CC MCULE-5899128891 [1,1,0,0,0,0|1,0,0]=3 1398 B5R0.3 CCC(N)CN MCULE-6911484065 [1,1,0,0,0,0|1,0,0]=3 1399 B5R0.3 CCC(N)CN MCULE-8376506697 [1,1,0,0,0,0|1,0,0]=3 1400 B5R0.3 CCC(N)CO MCULE-1135809021 [1,1,0,0,0,0|1,0,0]=3 1401 B5R0.3 CCC(N)CO MCULE-7588854111 [1,1,0,0,0,0|1,0,0]=3 1402 B5R0.3 CCC(O)C#N MCULE-5389816542 [1,1,0,0,0,0|0,1,1]=4 1403 B5R0.3 CCC(O)CBr MCULE-4205031860 [1,1,0,0,0,0|0,1,0]=3 1404 B5R0.3 CCC(O)CC MCULE-5553645045 [1,1,0,0,0,0|0,1,0]=3 1405 B5R0.3 CCC(O)CCl MCULE-8359810208 [1,1,0,0,0,0|0,1,0]=3 1406 B5R0.3 CCC(O)CN MCULE-5197026448 [1,1,0,0,0,0|0,1,0]=3 1407 B5R0.3 CCC(O)CO MCULE-2488753438 [1,1,0,0,0,0|0,1,0]=3 1408 B5R0.3 CCC(O)CO MCULE-7297282094 [1,1,0,0,0,0|0,1,0]=3 1409 B5R0.3 CCC(S)CC MCULE-2556259434 [1,1,0,0,0,0|0,0,0]=2 1410 B5R0.3 CCC(S)CS MCULE-9332449950 [1,1,0,0,0,0|0,0,0]=2 1411 B5R0.3 CCC([NH3+])CBr MCULE-6971158198 [1,1,0,0,0,0|1,0,0]=3 1412 B5R0.3 CCN(C)C#N MCULE-1247613129 [1,1,0,0,0,0|2,0,0]=4 1413 B5R0.3 CCN(C)C=O MCULE-2308681384 [1,1,0,0,0,0|1,1,0]=4 1414 B5R0.3 CCN(C)CC MCULE-7207964917 [1,1,0,0,0,0|2,0,0]=4 1415 B5R0.3 CCN(N)CC MCULE-9853386945 [1,1,0,0,0,0|2,0,0]=4 1416 B5R0.3 CCN(N)CC MCULE-9962617398 [1,1,0,0,0,0|2,0,0]=4 1417 B5R0.3 CCN(O)CC MCULE-6022935768 [1,1,0,0,0,0|1,1,0]=4 1418 B5R0.3 CCP(=O)CC MCULE-2216184595 [1,1,0,0,0,0|1,1,0]=4 1419 B5R0.3 CCP(Cl)CC MCULE-4484529264 [1,1,0,0,0,0|2,0,0]=4 1420 B5R0.3 CCS(=O)CC MCULE-5102735179 [1,1,0,0,0,0|1,1,0]=4 1421 B5R0.3 CC[C@@H](C)CBr MCULE-5675886072 [1,1,0,0,0,0|1,0,0]=3 1422 B5R0.3 CC[C@@H](C)CN MCULE-7612408107 [1,1,0,0,0,0|1,0,0]=3 1423 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [1,1,0,0,0,0|0,1,0]=3 1424 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [1,1,0,0,0,0|0,1,0]=3 1425 B5R0.3 CC[C@@H](N)C#N MCULE-3696119254 [1,1,0,0,0,0|1,0,1]=4 1426 B5R0.3 CC[C@@H](N)C#N MCULE-5586041766 [1,1,0,0,0,0|1,0,1]=4 1427 B5R0.3 CC[C@@H](N)CO MCULE-3821348404 [1,1,0,0,0,0|1,0,0]=3 1428 B5R0.3 CC[C@@H](N)CO MCULE-7190248306 [1,1,0,0,0,0|1,0,0]=3 1429 B5R0.3 CC[C@@H](O)CN MCULE-2854535153 [1,1,0,0,0,0|0,1,0]=3 1430 B5R0.3 CC[C@@H](O)CN MCULE-8228547956 [1,1,0,0,0,0|0,1,0]=3 1431 B5R0.3 CC[C@@H](O)CO MCULE-3948477298 [1,1,0,0,0,0|0,1,0]=3 1432 B5R0.3 CC[C@@H](O)CO MCULE-5098109795 [1,1,0,0,0,0|0,1,0]=3 1433 B5R0.3 CC[C@H](C)C#N MCULE-9118306872 [1,1,0,0,0,0|1,0,0]=3 1434 B5R0.3 CC[C@H](C)CBr MCULE-3263714447 [1,1,0,0,0,0|1,0,0]=3 1435 B5R0.3 CC[C@H](C)CBr MCULE-3384648570 [1,1,0,0,0,0|1,0,0]=3 1436 B5R0.3 CC[C@H](C)CCl MCULE-6795758745 [1,1,0,0,0,0|1,0,0]=3 1437 B5R0.3 CC[C@H](C)CCl MCULE-8147276830 [1,1,0,0,0,0|1,0,0]=3 1438 B5R0.3 CC[C@H](C)CI MCULE-9690776923 [1,1,0,0,0,0|1,0,0]=3 1439 B5R0.3 CC[C@H](C)CN MCULE-1380819951 [1,1,0,0,0,0|1,0,0]=3 1440 B5R0.3 CC[C@H](C)CN MCULE-1396096112 [1,1,0,0,0,0|1,0,0]=3 1441 B5R0.3 CC[C@H](C)CN MCULE-2971933862 [1,1,0,0,0,0|1,0,0]=3 1442 B5R0.3 CC[C@H](C)CN MCULE-3698084674 [1,1,0,0,0,0|1,0,0]=3 1443 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [1,1,0,0,0,0|0,1,0]=3 1444 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [1,1,0,0,0,0|0,1,0]=3 1445 B5R0.3 CC[C@H](N)C#N MCULE-4431283179 [1,1,0,0,0,0|1,0,1]=4 1446 B5R0.3 CC[C@H](N)C#N MCULE-8842235277 [1,1,0,0,0,0|1,0,1]=4 1447 B5R0.3 CC[C@H](N)CF MCULE-3646304583 [1,1,0,0,0,0|1,0,0]=3 1448 B5R0.3 CC[C@H](N)CF MCULE-4493834638 [1,1,0,0,0,0|1,0,0]=3 1449 B5R0.3 CC[C@H](N)CO MCULE-5500083870 [1,1,0,0,0,0|1,0,0]=3 1450 B5R0.3 CC[C@H](N)CO MCULE-6312512384 [1,1,0,0,0,0|1,0,0]=3 1451 B5R0.3 CC[C@H](O)CN MCULE-4385930741 [1,1,0,0,0,0|0,1,0]=3 1452 B5R0.3 CC[C@H](O)CO MCULE-2194264642 [1,1,0,0,0,0|0,1,0]=3 1453 B5R0.3 CC[C@H](O)CO MCULE-5503575962 [1,1,0,0,0,0|0,1,0]=3 1454 B5R0.3 CNC(=O)CS MCULE-7032391129 [1,1,0,0,0,0|0,1,1]=4 1455 B5R0.3 CNC(C)C#N MCULE-6126262950 [1,1,0,0,0,0|2,0,0]=4 1456 B5R0.3 CNC(C)C#N MCULE-8508083404 [1,1,0,0,0,0|2,0,0]=4 1457 B5R0.3 CNC(C)CN MCULE-1599162912 [1,1,0,0,0,0|2,0,0]=4 1458 B5R0.3 CNC(C)CN MCULE-1637391260 [1,1,0,0,0,0|2,0,0]=4 1459 B5R0.3 CNC(C)CO MCULE-3841057780 [1,1,0,0,0,0|1,1,0]=4 1460 B5R0.3 CNC(C)CO MCULE-6474892275 [1,1,0,0,0,0|1,1,0]=4 1461 B5R0.3 CN[C@@H](C)CO MCULE-1633741835 [1,1,0,0,0,0|1,1,0]=4 1462 B5R0.3 CN[C@@H](C)CO MCULE-6736108875 [1,1,0,0,0,0|1,1,0]=4 1463 B5R0.3 CN[C@@H](C)CO MCULE-7554801630 [1,1,0,0,0,0|1,1,0]=4 1464 B5R0.3 CN[C@@H](C)CO MCULE-9312521497 [1,1,0,0,0,0|1,1,0]=4 1465 B5R0.3 CN[C@H](C)CO MCULE-2402322400 [1,1,0,0,0,0|1,1,0]=4 1466 B5R0.3 CN[C@H](C)CO MCULE-4362091386 [1,1,0,0,0,0|1,1,0]=4 1467 B5R0.3 CN[C@H](C)CO MCULE-5426855707 [1,1,0,0,0,0|1,1,0]=4 1468 B5R0.3 CN[C@H](C)CO MCULE-9777995604 [1,1,0,0,0,0|1,1,0]=4 1469 B5R0.3 COC(=O)CS MCULE-3020830180 [1,1,0,0,0,0|0,1,1]=4 1470 B5R0.3 COC(C)C#N MCULE-7716445717 [1,1,0,0,0,0|2,0,0]=4 1471 B5R0.3 COC(C)CBr MCULE-6831960550 [1,1,0,0,0,0|1,1,0]=4 1472 B5R0.3 COC(C)CCl MCULE-6614968111 [1,1,0,0,0,0|1,1,0]=4 1473 B5R0.3 COC(C)CI MCULE-9561627722 [1,1,0,0,0,0|1,1,0]=4 1474 B5R0.3 COC(C)CN MCULE-1378513525 [1,1,0,0,0,0|1,1,0]=4 1475 B5R0.3 COC(C)CN MCULE-6114730248 [1,1,0,0,0,0|1,1,0]=4 1476 B5R0.3 COC(C)CN MCULE-7516064224 [1,1,0,0,0,0|1,1,0]=4 1477 B5R0.3 COC(C)CN MCULE-8277408054 [1,1,0,0,0,0|1,1,0]=4 1478 B5R0.3 COC(C)CO MCULE-5269990702 [1,1,0,0,0,0|0,2,0]=4 1479 B5R0.3 COC(C)CO MCULE-7173093332 [1,1,0,0,0,0|0,2,0]=4 1480 B5R0.3 COC(C)OC MCULE-8241616143 [1,1,0,0,0,0|1,1,0]=4 1481 B5R0.3 CO[C@@H](C)C#N MCULE-1453263443 [1,1,0,0,0,0|2,0,0]=4 1482 B5R0.3 CO[C@@H](C)CN MCULE-1448950160 [1,1,0,0,0,0|1,1,0]=4 1483 B5R0.3 CO[C@@H](C)CN MCULE-3784073249 [1,1,0,0,0,0|1,1,0]=4 1484 B5R0.3 CO[C@@H](C)CN MCULE-6073633931 [1,1,0,0,0,0|1,1,0]=4 1485 B5R0.3 CO[C@@H](C)CN MCULE-9516756218 [1,1,0,0,0,0|1,1,0]=4 1486 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [1,1,0,0,0,0|0,2,0]=4 1487 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [1,1,0,0,0,0|0,2,0]=4 1488 B5R0.3 CO[C@H](C)CN MCULE-4143562009 [1,1,0,0,0,0|1,1,0]=4 1489 B5R0.3 CO[C@H](C)CN MCULE-4184510827 [1,1,0,0,0,0|1,1,0]=4 1490 B5R0.3 CO[C@H](C)CN MCULE-9625722424 [1,1,0,0,0,0|1,1,0]=4 1491 B5R0.3 CO[C@H](C)CN MCULE-9882567615 [1,1,0,0,0,0|1,1,0]=4 1492 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [1,1,0,0,0,0|0,2,0]=4 1493 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [1,1,0,0,0,0|0,2,0]=4 1494 B5R0.3 CSC(C)CN MCULE-8841622109 [1,1,0,0,0,0|1,0,0]=3 1495 B5R0.3 CSC(C)CO MCULE-4646435737 [1,1,0,0,0,0|0,1,0]=3 1496 B5R0.3 C[C@@H](CN)CO MCULE-4662215148 [1,1,0,0,0,0|1,1,0]=4 1497 B5R0.3 C[C@@H](CN)CO MCULE-7870198689 [1,1,0,0,0,0|1,1,0]=4 1498 B5R0.3 C[C@@H](CO)CBr MCULE-3691541800 [1,1,0,0,0,0|1,1,0]=4 1499 B5R0.3 C[C@@H](CO)CBr MCULE-4447849056 [1,1,0,0,0,0|1,1,0]=4 1500 B5R0.3 C[C@H](CO)CBr MCULE-4031825779 [1,1,0,0,0,0|1,1,0]=4 1501 B5R0.3 C[C@H](CO)CBr MCULE-6846167456 [1,1,0,0,0,0|1,1,0]=4 1502 B5R0.3 ClCC(Br)CBr MCULE-2454576835 [1,1,0,0,0,0|2,0,0]=4 1503 B5R0.3 ClCC(Cl)CCl MCULE-3839333809 [1,1,0,0,0,0|2,0,0]=4 1504 B5R0.3 FCC(Br)CBr MCULE-3296621964 [1,1,0,0,0,0|2,0,0]=4 1505 B5R0.3 FCC(Cl)CF MCULE-6083002482 [1,1,0,0,0,0|2,0,0]=4 1506 B5R0.3 FCC(I)CF MCULE-1837926612 [1,1,0,0,0,0|2,0,0]=4 1507 B5R0.3 NC(CF)CF MCULE-4671221738 [1,1,0,0,0,0|2,0,0]=4 1508 B5R0.3 NC(CF)CF MCULE-8916274721 [1,1,0,0,0,0|2,0,0]=4 1509 B5R0.3 NC(CO)CF MCULE-3756808200 [1,1,0,0,0,0|1,1,0]=4 1510 B5R0.3 NC(CO)CF MCULE-9468719402 [1,1,0,0,0,0|1,1,0]=4 1511 B5R0.3 NC(CO)CO MCULE-1559988016 [1,1,0,0,0,0|1,1,0]=4 1512 B5R0.3 NC(CO)CO MCULE-4954119952 [1,1,0,0,0,0|1,1,0]=4 1513 B5R0.3 NCC(Br)CBr MCULE-4507622045 [1,1,0,0,0,0|2,0,0]=4 1514 B5R0.3 NCC(Br)CBr MCULE-9707598399 [1,1,0,0,0,0|2,0,0]=4 1515 B5R0.3 NCC(F)CN MCULE-8855486562 [1,1,0,0,0,0|2,0,0]=4 1516 B5R0.3 NCC(F)CO MCULE-6156319956 [1,1,0,0,0,0|1,1,0]=4 1517 B5R0.3 NCC(F)CO MCULE-7472307328 [1,1,0,0,0,0|1,1,0]=4 1518 B5R0.3 NCC(O)CCl MCULE-1566349721 [1,1,0,0,0,0|1,1,0]=4 1519 B5R0.3 NCC(O)CCl MCULE-3532626994 [1,1,0,0,0,0|1,1,0]=4 1520 B5R0.3 NCC(O)CCl MCULE-5045913208 [1,1,0,0,0,0|1,1,0]=4 1521 B5R0.3 NCC(O)CCl MCULE-7168455596 [1,1,0,0,0,0|1,1,0]=4 1522 B5R0.3 NCC(O)CF MCULE-7529777116 [1,1,0,0,0,0|1,1,0]=4 1523 B5R0.3 NCC(O)CF MCULE-8092861019 [1,1,0,0,0,0|1,1,0]=4 1524 B5R0.3 NCC(O)CN MCULE-4689186078 [1,1,0,0,0,0|1,1,0]=4 1525 B5R0.3 NCC(O)CO MCULE-2689763818 [1,1,0,0,0,0|0,2,0]=4 1526 B5R0.3 NCC(O)CO MCULE-6096620010 [1,1,0,0,0,0|0,2,0]=4 1527 B5R0.3 NCC(O)CO MCULE-7307777212 [1,1,0,0,0,0|0,2,0]=4 1528 B5R0.3 NC[C@@H](F)CO MCULE-3273711180 [1,1,0,0,0,0|1,1,0]=4 1529 B5R0.3 NC[C@@H](F)CO MCULE-6673969522 [1,1,0,0,0,0|1,1,0]=4 1530 B5R0.3 NC[C@@H](N)CO MCULE-7333007012 [1,1,0,0,0,0|1,1,0]=4 1531 B5R0.3 NC[C@@H](N)CO MCULE-9200386635 [1,1,0,0,0,0|1,1,0]=4 1532 B5R0.3 NC[C@@H](O)CCl MCULE-1905964392 [1,1,0,0,0,0|1,1,0]=4 1533 B5R0.3 NC[C@@H](O)CCl MCULE-5592096864 [1,1,0,0,0,0|1,1,0]=4 1534 B5R0.3 NC[C@@H](O)CCl MCULE-5723497450 [1,1,0,0,0,0|1,1,0]=4 1535 B5R0.3 NC[C@@H](O)CCl MCULE-7112738263 [1,1,0,0,0,0|1,1,0]=4 1536 B5R0.3 NC[C@@H](O)CO MCULE-7897503444 [1,1,0,0,0,0|0,2,0]=4 1537 B5R0.3 NC[C@@H](O)CO MCULE-8044821624 [1,1,0,0,0,0|0,2,0]=4 1538 B5R0.3 NC[C@@H](O)CO MCULE-9443333756 [1,1,0,0,0,0|0,2,0]=4 1539 B5R0.3 NC[C@H](F)CO MCULE-2595736378 [1,1,0,0,0,0|1,1,0]=4 1540 B5R0.3 NC[C@H](F)CO MCULE-7417074078 [1,1,0,0,0,0|1,1,0]=4 1541 B5R0.3 NC[C@H](F)CO MCULE-7938231499 [1,1,0,0,0,0|1,1,0]=4 1542 B5R0.3 NC[C@H](N)CO MCULE-1060049548 [1,1,0,0,0,0|1,1,0]=4 1543 B5R0.3 NC[C@H](N)CO MCULE-9942356112 [1,1,0,0,0,0|1,1,0]=4 1544 B5R0.3 NC[C@H](O)CBr MCULE-4679771824 [1,1,0,0,0,0|1,1,0]=4 1545 B5R0.3 NC[C@H](O)CBr MCULE-4785059460 [1,1,0,0,0,0|1,1,0]=4 1546 B5R0.3 NC[C@H](O)CCl MCULE-3625478007 [1,1,0,0,0,0|1,1,0]=4 1547 B5R0.3 NC[C@H](O)CCl MCULE-6692503791 [1,1,0,0,0,0|1,1,0]=4 1548 B5R0.3 NC[C@H](O)CO MCULE-5835551322 [1,1,0,0,0,0|0,2,0]=4 1549 B5R0.3 NC[C@H](O)CO MCULE-6021133883 [1,1,0,0,0,0|0,2,0]=4 1550 B5R0.3 NC[C@H](O)CO MCULE-7461568841 [1,1,0,0,0,0|0,2,0]=4 1551 B5R0.3 NC[C@H](O)CO MCULE-8112454132 [1,1,0,0,0,0|0,2,0]=4 1552 B5R0.3 N[C@@H](CO)CF MCULE-1103631898 [1,1,0,0,0,0|1,1,0]=4 1553 B5R0.3 N[C@@H](CO)CF MCULE-1137418239 [1,1,0,0,0,0|1,1,0]=4 1554 B5R0.3 N[C@@H](CO)CF MCULE-7452275160 [1,1,0,0,0,0|1,1,0]=4 1555 B5R0.3 N[C@@H](CO)CF MCULE-9154795583 [1,1,0,0,0,0|1,1,0]=4 1556 B5R0.3 N[C@H](CO)CF MCULE-1070351343 [1,1,0,0,0,0|1,1,0]=4 1557 B5R0.3 N[C@H](CO)CF MCULE-4715788718 [1,1,0,0,0,0|1,1,0]=4 1558 B5R0.3 N[C@H](CO)CF MCULE-8220585202 [1,1,0,0,0,0|1,1,0]=4 1559 B5R0.3 N[C@H](CO)CF MCULE-8991857376 [1,1,0,0,0,0|1,1,0]=4 1560 B5R0.3 OC(CBr)CBr MCULE-9071238259 [1,1,0,0,0,0|1,1,0]=4 1561 B5R0.3 OC(CCl)CBr MCULE-3844020597 [1,1,0,0,0,0|1,1,0]=4 1562 B5R0.3 OC(CCl)CCl MCULE-7873018520 [1,1,0,0,0,0|1,1,0]=4 1563 B5R0.3 OC(CCl)CI MCULE-3276637880 [1,1,0,0,0,0|1,1,0]=4 1564 B5R0.3 OC(CF)CBr MCULE-3915880352 [1,1,0,0,0,0|1,1,0]=4 1565 B5R0.3 OC(CF)CCl MCULE-6441743377 [1,1,0,0,0,0|1,1,0]=4 1566 B5R0.3 OC(CF)CF MCULE-3360341794 [1,1,0,0,0,0|1,1,0]=4 1567 B5R0.3 OC(CI)CI MCULE-6842895270 [1,1,0,0,0,0|1,1,0]=4 1568 B5R0.3 OCC(Br)CBr MCULE-9616107956 [1,1,0,0,0,0|1,1,0]=4 1569 B5R0.3 OCC(Br)CO MCULE-9272628834 [1,1,0,0,0,0|1,1,0]=4 1570 B5R0.3 OCC(Cl)CCl MCULE-2120585852 [1,1,0,0,0,0|1,1,0]=4 1571 B5R0.3 OCC(Cl)CO MCULE-7487945326 [1,1,0,0,0,0|1,1,0]=4 1572 B5R0.3 OCC(F)CBr MCULE-2889937576 [1,1,0,0,0,0|1,1,0]=4 1573 B5R0.3 OCC(F)CO MCULE-2970537690 [1,1,0,0,0,0|1,1,0]=4 1574 B5R0.3 OCC(O)CBr MCULE-9116190245 [1,1,0,0,0,0|0,2,0]=4 1575 B5R0.3 OCC(O)CCl MCULE-7895191088 [1,1,0,0,0,0|0,2,0]=4 1576 B5R0.3 OCC(O)CCl MCULE-8992242488 [1,1,0,0,0,0|0,2,0]=4 1577 B5R0.3 OCC(O)CF MCULE-3575952891 [1,1,0,0,0,0|0,2,0]=4 1578 B5R0.3 OCC(O)CF MCULE-8981430411 [1,1,0,0,0,0|0,2,0]=4 1579 B5R0.3 OCC(O)CI MCULE-6705992930 [1,1,0,0,0,0|0,2,0]=4 1580 B5R0.3 OCC(O)CO MCULE-6349111826 [1,1,0,0,0,0|0,2,0]=4 1581 B5R0.3 OCC(O)CS MCULE-6300188207 [1,1,0,0,0,0|0,1,0]=3 1582 B5R0.3 OCC(S)CS MCULE-9735516119 [1,1,0,0,0,0|0,0,0]=2 1583 B5R0.3 OC[C@@H](O)CCl MCULE-1311776512 [1,1,0,0,0,0|0,2,0]=4 1584 B5R0.3 OC[C@@H](O)CCl MCULE-2685107404 [1,1,0,0,0,0|0,2,0]=4 1585 B5R0.3 OC[C@@H](O)CF MCULE-3274443966 [1,1,0,0,0,0|0,2,0]=4 1586 B5R0.3 OC[C@@H](O)CF MCULE-5908395855 [1,1,0,0,0,0|0,2,0]=4 1587 B5R0.3 OC[C@H](O)CBr MCULE-5035020863 [1,1,0,0,0,0|0,2,0]=4 1588 B5R0.3 OC[C@H](O)CCl MCULE-2098232262 [1,1,0,0,0,0|0,2,0]=4 1589 B5R0.3 OC[C@H](O)CCl MCULE-5801605349 [1,1,0,0,0,0|0,2,0]=4 1590 B5R0.3 OC[C@H](O)CF MCULE-3309672397 [1,1,0,0,0,0|0,2,0]=4 1591 B5R0.3 OC[C@H](O)CF MCULE-7695783253 [1,1,0,0,0,0|0,2,0]=4 1592 B5R0.3 O[C@@H](CCl)CI MCULE-5324720097 [1,1,0,0,0,0|1,1,0]=4 1593 B5R0.3 O[C@H](CCl)CI MCULE-2790157830 [1,1,0,0,0,0|1,1,0]=4 1594 B5R0.3 [C@H](O)(CN)CCl MCULE-1220791610 [1,1,0,0,0,0|1,1,0]=4 1595 B5R0.3 [C@H](O)(CN)CCl MCULE-4106901858 [1,1,0,0,0,0|1,1,0]=4 1596 B5R0.4 CC(C)(Br)CBr MCULE-2393829265 [1,1,0,0,0,0|2,0,0]=4 1597 B5R0.4 CC(C)(Br)CCl MCULE-4498591413 [1,1,0,0,0,0|2,0,0]=4 1598 B5R0.4 CC(C)(Br)CN MCULE-3220115637 [1,1,0,0,0,0|2,0,0]=4 1599 B5R0.4 CC(C)(Br)CN MCULE-3391853433 [1,1,0,0,0,0|2,0,0]=4 1600 B5R0.4 CC(C)(Br)CN MCULE-3819869078 [1,1,0,0,0,0|2,0,0]=4 1601 B5R0.4 CC(C)(Br)CO MCULE-5949221311 [1,1,0,0,0,0|1,1,0]=4 1602 B5R0.4 CC(C)(C)CBr MCULE-7545541733 [1,1,0,0,0,0|2,0,0]=4 1603 B5R0.4 CC(C)(C)CCl MCULE-1595599055 [1,1,0,0,0,0|2,0,0]=4 1604 B5R0.4 CC(C)(C)CI MCULE-6879787789 [1,1,0,0,0,0|2,0,0]=4 1605 B5R0.4 CC(C)(C)CN MCULE-1062894260 [1,1,0,0,0,0|2,0,0]=4 1606 B5R0.4 CC(C)(C)CN MCULE-2736289460 [1,1,0,0,0,0|2,0,0]=4 1607 B5R0.4 CC(C)(C)CN MCULE-5919012916 [1,1,0,0,0,0|2,0,0]=4 1608 B5R0.4 CC(C)(C)CN MCULE-6772338754 [1,1,0,0,0,0|2,0,0]=4 1609 B5R0.4 CC(C)(C)CN MCULE-8882959753 [1,1,0,0,0,0|2,0,0]=4 1610 B5R0.4 CC(C)(C)CO MCULE-4399535684 [1,1,0,0,0,0|1,1,0]=4 1611 B5R0.4 CC(C)(C)CS MCULE-7279455818 [1,1,0,0,0,0|1,0,0]=3 1612 B5R0.4 CC(C)(Cl)CCl MCULE-3251179033 [1,1,0,0,0,0|2,0,0]=4 1613 B5R0.4 CC(C)(F)CBr MCULE-3412419931 [1,1,0,0,0,0|2,0,0]=4 1614 B5R0.4 CC(C)(F)CI MCULE-8224019070 [1,1,0,0,0,0|2,0,0]=4 1615 B5R0.4 CC(C)(F)CN MCULE-3150098249 [1,1,0,0,0,0|2,0,0]=4 1616 B5R0.4 CC(C)(F)CN MCULE-8647719519 [1,1,0,0,0,0|2,0,0]=4 1617 B5R0.4 CC(C)(F)CO MCULE-1700621997 [1,1,0,0,0,0|1,1,0]=4 1618 B5R0.4 CC(C)(N)CCl MCULE-2098848089 [1,1,0,0,0,0|2,0,0]=4 1619 B5R0.4 CC(C)(N)CCl MCULE-2847180011 [1,1,0,0,0,0|2,0,0]=4 1620 B5R0.4 CC(C)(N)CF MCULE-3102233948 [1,1,0,0,0,0|2,0,0]=4 1621 B5R0.4 CC(C)(N)CF MCULE-9737357598 [1,1,0,0,0,0|2,0,0]=4 1622 B5R0.4 CC(C)(N)CN MCULE-4218187677 [1,1,0,0,0,0|2,0,0]=4 1623 B5R0.4 CC(C)(N)CN MCULE-6476068080 [1,1,0,0,0,0|2,0,0]=4 1624 B5R0.4 CC(C)(N)CO MCULE-4072416202 [1,1,0,0,0,0|1,1,0]=4 1625 B5R0.4 CC(C)(N)CO MCULE-4209651459 [1,1,0,0,0,0|1,1,0]=4 1626 B5R0.4 CC(C)(N)CO MCULE-6047079177 [1,1,0,0,0,0|1,1,0]=4 1627 B5R0.4 CC(C)(O)CBr MCULE-6366129174 [1,1,0,0,0,0|1,1,0]=4 1628 B5R0.4 CC(C)(O)CCl MCULE-3118028441 [1,1,0,0,0,0|1,1,0]=4 1629 B5R0.4 CC(C)(O)CF MCULE-6616447132 [1,1,0,0,0,0|1,1,0]=4 1630 B5R0.4 CC(C)(O)CI MCULE-5132198363 [1,1,0,0,0,0|1,1,0]=4 1631 B5R0.4 CC(C)(O)CN MCULE-5270413077 [1,1,0,0,0,0|1,1,0]=4 1632 B5R0.4 CC(C)(O)CN MCULE-7438555366 [1,1,0,0,0,0|1,1,0]=4 1633 B5R0.4 CC(C)(O)CO MCULE-6797456030 [1,1,0,0,0,0|0,2,0]=4 1634 B5R0.4 CC(C)(O)CS MCULE-2370088388 [1,1,0,0,0,0|0,1,0]=3 1635 B5R0.4 CC(C)(S)CN MCULE-4256015369 [1,1,0,0,0,0|1,0,0]=3 1636 B5R0.4 CC(C)(S)CN MCULE-8836856580 [1,1,0,0,0,0|1,0,0]=3 1637 B5R0.4 CC(C)(S)CO MCULE-6119329508 [1,1,0,0,0,0|0,1,0]=3 1638 B5R0.4 CC(Cl)(Cl)CCl MCULE-8236164177 [1,1,0,0,0,0|2,0,0]=4 1639 B5R0.4 CC(F)(F)CF MCULE-6634311008 [1,1,0,0,0,0|2,0,0]=4 1640 B5R0.4 CC(F)(F)CN MCULE-5449109500 [1,1,0,0,0,0|2,0,0]=4 1641 B5R0.4 CC(F)(F)CN MCULE-9330314243 [1,1,0,0,0,0|2,0,0]=4 1642 B5R0.4 CC(F)(F)CO MCULE-1049181656 [1,1,0,0,0,0|1,1,0]=4 1643 B5R0.4 CCC(C)(C)Br MCULE-8895489875 [1,1,0,0,0,0|1,0,0]=3 1644 B5R0.4 CCC(C)(C)C MCULE-3388707671 [1,1,0,0,0,0|1,0,0]=3 1645 B5R0.4 CCC(C)(C)Cl MCULE-9597829372 [1,1,0,0,0,0|1,0,0]=3 1646 B5R0.4 CCC(C)(C)I MCULE-3678105747 [1,1,0,0,0,0|1,0,0]=3 1647 B5R0.4 CCC(C)(C)N MCULE-5538333672 [1,1,0,0,0,0|1,0,0]=3 1648 B5R0.4 CCC(C)(C)O MCULE-7894262803 [1,1,0,0,0,0|0,1,0]=3 1649 B5R0.4 CCC(C)(Cl)Cl MCULE-7771494508 [1,1,0,0,0,0|1,0,0]=3 1650 B5R0.4 CCC(C)(F)F MCULE-9944788511 [1,1,0,0,0,0|1,0,0]=3 1651 B5R0.4 CCC(Cl)(Cl)Cl MCULE-2160409083 [1,1,0,0,0,0|2,0,0]=4 1652 B5R0.4 CCC(F)(F)F MCULE-7641898897 [1,1,0,0,0,0|2,0,0]=4 1653 B5R0.4 CCS(=N)(=O)C MCULE-6682726319 [1,1,0,0,0,0|1,1,0]=4 1654 B5R0.4 CCS(=O)(=O)C MCULE-8932195925 [1,1,0,0,0,0|1,1,0]=4 1655 B5R0.4 CC[N+](C)(C)C MCULE-6470651588 [1,1,0,0,0,0|2,0,0]=4 1656 B5R0.4 CC[N+](C)(C)C MCULE-9796203912 [1,1,0,0,0,0|2,0,0]=4 1657 B5R0.4 CC[Si](C)(C)C MCULE-3153744967 [1,1,0,0,0,0|1,1,0]=4 1658 B5R0.4 CC[Si](C)(C)Cl MCULE-8119153773 [1,1,0,0,0,0|1,1,0]=4 1659 B5R0.4 CC[Si](C)(Cl)Cl MCULE-6915255927 [1,1,0,0,0,0|1,1,0]=4 1660 B5R0.4 CNC(C)(C)C MCULE-7155937642 [1,1,0,0,0,0|2,0,0]=4 1661 B5R0.4 COC(C)(C)C MCULE-5235179974 [1,1,0,0,0,0|2,0,0]=4 1662 B5R0.4 CSC(C)(C)C MCULE-8798542499 [1,1,0,0,0,0|2,0,0]=4 1663 B5R0.4 FC(F)(F)CS MCULE-7976771174 [1,1,0,0,0,0|2,0,0]=4 1664 B7R0.2 C=CC(C)CC(C)C MCULE-9111388336 [0,1,0,0,0,1|2,0,0]=4 1665 B7R0.2 CC(C)CC(C)C=O MCULE-4209363554 [0,1,0,0,0,1|1,1,0]=4 1666 B7R0.2 CC(C)CC(C)CBr MCULE-6800285380 [0,1,0,0,0,1|2,0,0]=4 1667 B7R0.2 CC(C)CC(C)CO MCULE-5856507691 [0,1,0,0,0,1|1,1,0]=4 1668 B7R0.2 CC(C)CC(N)CF MCULE-3937400151 [0,1,0,0,0,1|2,0,0]=4 1669 B7R0.2 CC(C)CC(N)CF MCULE-7951827838 [0,1,0,0,0,1|2,0,0]=4 1670 B7R0.2 CC(C)CC(N)CN MCULE-3441513735 [0,1,0,0,0,1|2,0,0]=4 1671 B7R0.2 CC(C)CC(N)CO MCULE-6347344178 [0,1,0,0,0,1|2,0,0]=4 1672 B7R0.2 CC(C)CC(N)CO MCULE-7024759986 [0,1,0,0,0,1|2,0,0]=4 1673 B7R0.2 CC(C)CC(N)CS MCULE-8932651812 [0,1,0,0,0,1|2,0,0]=4 1674 B7R0.2 CC(C)CC(O)CN MCULE-9414833333 [0,1,0,0,0,1|1,1,0]=4 1675 B7R0.2 CC(C)CC(O)CN MCULE-9784331526 [0,1,0,0,0,1|1,1,0]=4 1676 B7R0.2 CC(C)C[C@@H](N)CBr MCULE-4869966214 [0,1,0,0,0,1|2,0,0]=4 1677 B7R0.2 CC(C)C[C@@H](N)CO MCULE-1979401982 [0,1,0,0,0,1|2,0,0]=4 1678 B7R0.2 CC(C)C[C@@H](N)CO MCULE-3025407298 [0,1,0,0,0,1|2,0,0]=4 1679 B7R0.2 CC(C)C[C@H](N)CBr MCULE-4224057266 [0,1,0,0,0,1|2,0,0]=4 1680 B7R0.2 CC(C)C[C@H](N)CO MCULE-2790872575 [0,1,0,0,0,1|2,0,0]=4 1681 B7R0.2 CC(C)C[C@H](N)CO MCULE-9198147139 [0,1,0,0,0,1|2,0,0]=4 1682 B7R0.2 CC(O)CC(C)CN MCULE-3086796159 [0,1,0,0,0,1|1,1,0]=4 1683 B7R0.2 CCC(C)CC(C)C MCULE-9492683095 [0,1,0,0,0,1|2,0,0]=4 1684 B7R0.2 CCC(C)CC(C)N MCULE-2633957870 [0,1,0,0,0,1|2,0,0]=4 1685 B7R0.2 CCC(C)CC(C)N MCULE-5740038174 [0,1,0,0,0,1|2,0,0]=4 1686 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [0,1,0,0,0,1|1,1,0]=4 1687 B7R0.2 CCC(O)CC(C)O MCULE-3115543235 [0,1,0,0,0,1|0,2,0]=4 1688 B7R0.2 CNC(C)CC(C)C MCULE-4458579180 [0,1,0,0,0,1|2,0,0]=4 1689 B7R0.2 CNC(C)CC(C)C MCULE-9768203107 [0,1,0,0,0,1|2,0,0]=4 1690 B7R0.2 COC(=O)CC(C)S MCULE-8423856471 [0,1,0,0,0,1|0,1,1]=4 1691 B7R0.2 COC(C)CC(C)O MCULE-3635789827 [0,1,0,0,0,1|0,2,0]=4 1692 B7R0.9 CC(=O)CC(C)(C)S MCULE-8901285593 [0,1,0,0,0,1|0,1,1]=4 1693 B7R0.9 CC(C)CC(C)(C)C MCULE-3330030399 [0,1,0,0,0,1|2,0,0]=4 1694 B7R0.9 CC(C)CC(C)(C)N MCULE-4922087306 [0,1,0,0,0,1|2,0,0]=4 1695 B7R0.9 CC(C)CC(C)(C)N MCULE-8133258210 [0,1,0,0,0,1|2,0,0]=4 1696 B7R0.9 CC(C)CC(C)(C)O MCULE-3204875128 [0,1,0,0,0,1|1,1,0]=4 1697 B7R0.9 CC(C)NC(C)(C)C MCULE-2203155902 [0,1,0,0,0,1|2,0,0]=4 1698 B7R0.9 CC(C)OC(C)(C)C MCULE-5031141442 [0,1,0,0,0,1|2,0,0]=4 1699 B7R0.9 CC(N)CC(C)(C)C MCULE-9078455585 [0,1,0,0,0,1|2,0,0]=4 1700 B7R0.9 CC(N)CC(C)(C)N MCULE-3037959090 [0,1,0,0,0,1|2,0,0]=4 1701 B7R0.9 CC(N)CC(C)(C)O MCULE-6122866768 [0,1,0,0,0,1|1,1,0]=4 1702 B7R0.9 CC(N)CC(C)(C)O MCULE-6808889940 [0,1,0,0,0,1|1,1,0]=4 1703 B7R0.9 CC(O)CC(C)(C)C MCULE-3536219229 [0,1,0,0,0,1|1,1,0]=4 1704 B7R0.9 CC(O)CC(C)(C)N MCULE-2860111904 [0,1,0,0,0,1|1,1,0]=4 1705 B7R0.9 CC(O)CC(C)(C)O MCULE-5281049691 [0,1,0,0,0,1|0,2,0]=4 1706 B7R0.9 CC(O)CC(C)(C)O MCULE-8163963858 [0,1,0,0,0,1|0,2,0]=4 1707 B7R0.9 C[C@@H](O)CC(C)(C)O MCULE-5779966658 [0,1,0,0,0,1|0,2,0]=4 1708 B7R0.9 C[C@H](N)CC(C)(C)C MCULE-1125553954 [0,1,0,0,0,1|2,0,0]=4 1709 B7R0.9 C[C@H](N)CC(C)(C)C MCULE-5940744306 [0,1,0,0,0,1|2,0,0]=4 1710 B7R0.9 C[C@H](N)CC(C)(C)C MCULE-8356895574 [0,1,0,0,0,1|2,0,0]=4 1711 B7R0.9 C[C@H](N)CC(C)(C)C MCULE-9507282532 [0,1,0,0,0,1|2,0,0]=4 1712 B7R0.9 C[C@H](O)CC(C)(C)O MCULE-6903579241 [0,1,0,0,0,1|0,2,0]=4 1713 B7R0.16 BN(C(C)C)C(C)C MCULE-9596820026 [0,1,0,0,0,1|2,0,0]=4 1714 B7R0.16 CC(Br)C(=O)C(C)Br MCULE-8131454981 [0,1,0,0,0,1|2,0,0]=4 1715 B7R0.16 CC(C)C(=O)C(C)Br MCULE-3431811578 [0,1,0,0,0,1|2,0,0]=4 1716 B7R0.16 CC(C)C(=O)C(C)C MCULE-2525492530 [0,1,0,0,0,1|2,0,0]=4 1717 B7R0.16 CC(C)C(C)C(C)C MCULE-2831761094 [0,1,0,0,0,1|2,0,0]=4 1718 B7R0.16 CC(C)C(N)C(C)C MCULE-2164638983 [0,1,0,0,0,1|2,0,0]=4 1719 B7R0.16 CC(C)C(N)C(C)C MCULE-8563510082 [0,1,0,0,0,1|2,0,0]=4 1720 B7R0.16 CC(C)C(O)C(C)C MCULE-3471523029 [0,1,0,0,0,1|2,0,0]=4 1721 B7R0.16 CC(C)C(O)C(C)N MCULE-1856841813 [0,1,0,0,0,1|2,0,0]=4 1722 B7R0.16 CC(C)C(S)C(C)C MCULE-3605843125 [0,1,0,0,0,1|2,0,0]=4 1723 B7R0.16 CC(C)N(C)C(C)C MCULE-6950075898 [0,1,0,0,0,1|2,0,0]=4 1724 B7R0.16 CC(C)P(Cl)C(C)C MCULE-8760220652 [0,1,0,0,0,1|2,0,0]=4 1725 B7R0.5 C#CCC(O)C(C)C MCULE-5540203369 [0,2,0,0,0,0|1,1,0]=4 1726 B7R0.5 C=CCC(C)C(C)C MCULE-8461199830 [0,2,0,0,0,0|2,0,0]=4 1727 B7R0.5 C=CCC(O)C(C)C MCULE-2334905388 [0,2,0,0,0,0|1,1,0]=4 1728 B7R0.5 CC(C)C(C)CCO MCULE-9837449555 [0,2,0,0,0,0|1,1,0]=4 1729 B7R0.5 CC(C)C(C)N=C=O MCULE-2911676446 [0,2,0,0,0,0|1,1,0]=4 1730 B7R0.5 CC(C)C(C)N=C=S MCULE-2850451977 [0,2,0,0,0,0|1,0,1]=4 1731 B7R0.5 CC(C)C(N)CCO MCULE-4571836019 [0,2,0,0,0,0|2,0,0]=4 1732 B7R0.5 CC(C)C(O)CC#N MCULE-5148911726 [0,2,0,0,0,0|1,1,0]=4 1733 B7R0.5 CC(C)C(O)CCCl MCULE-3510291624 [0,2,0,0,0,0|1,1,0]=4 1734 B7R0.5 CC(C)C(O)CCN MCULE-2039463209 [0,2,0,0,0,0|1,1,0]=4 1735 B7R0.5 CC(C)C(O)CCN MCULE-2941304015 [0,2,0,0,0,0|1,1,0]=4 1736 B7R0.5 CC(C)C(O)CCO MCULE-8819967893 [0,2,0,0,0,0|1,1,0]=4 1737 B7R0.5 CC(C)[C@@H](C)N=C=S MCULE-3092055671 [0,2,0,0,0,0|1,0,1]=4 1738 B7R0.5 CC(C)[C@@H](C)N=C=S MCULE-6664975182 [0,2,0,0,0,0|1,0,1]=4 1739 B7R0.5 CC(C)[C@H](N)CCO MCULE-5628923252 [0,2,0,0,0,0|2,0,0]=4 1740 B7R0.5 CC(C)[C@H](O)CCN MCULE-1853419872 [0,2,0,0,0,0|1,1,0]=4 1741 B7R0.5 CC(C)[C@H](O)CCN MCULE-1886424228 [0,2,0,0,0,0|1,1,0]=4 1742 B7R0.5 CC(C)[C@H](O)CCN MCULE-7762475170 [0,2,0,0,0,0|1,1,0]=4 1743 B7R0.5 CC(C)[C@H](O)CCN MCULE-8675177820 [0,2,0,0,0,0|1,1,0]=4 1744 B7R0.5 CCCC(Br)C(C)Br MCULE-4740207556 [0,2,0,0,0,0|2,0,0]=4 1745 B7R0.5 CCCC(C)C(C)C MCULE-1008931357 [0,2,0,0,0,0|2,0,0]=4 1746 B7R0.5 CCCC(C)C(C)N MCULE-3555650010 [0,2,0,0,0,0|2,0,0]=4 1747 B7R0.5 CCCC(C)C(C)N MCULE-8637319249 [0,2,0,0,0,0|2,0,0]=4 1748 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [0,2,0,0,0,0|1,1,0]=4 1749 B7R0.5 CCCC(O)C(C)C MCULE-8942406791 [0,2,0,0,0,0|1,1,0]=4 1750 B7R0.5 CCNC(C)C(C)C MCULE-4222747158 [0,2,0,0,0,0|2,0,0]=4 1751 B7R0.5 CCNC(C)C(C)C MCULE-4653009965 [0,2,0,0,0,0|2,0,0]=4 1752 B7R0.5 CCOC(=O)C(C)S MCULE-7890942953 [0,2,0,0,0,0|0,1,1]=4 1753 B7R0.5 CCOC(Cl)C(C)Cl MCULE-8602425289 [0,2,0,0,0,0|2,0,0]=4 1754 B7R0.5 CNCC(N)C(C)C MCULE-6535124409 [0,2,0,0,0,0|2,0,0]=4 1755 B7R0.5 COCC(C)C(C)N MCULE-6465669754 [0,2,0,0,0,0|1,1,0]=4 1756 B7R0.5 COCC(N)C(C)C MCULE-4185259512 [0,2,0,0,0,0|2,0,0]=4 1757 B7R0.5 COCC(N)C(C)C MCULE-6424539237 [0,2,0,0,0,0|2,0,0]=4 1758 B7R0.5 COCC(O)C(C)C MCULE-3818851772 [0,2,0,0,0,0|1,1,0]=4 1759 B7R0.5 COC[C@@H](N)C(C)C MCULE-2081062888 [0,2,0,0,0,0|2,0,0]=4 1760 B7R0.5 COC[C@@H](N)C(C)C MCULE-3286077946 [0,2,0,0,0,0|2,0,0]=4 1761 B7R0.5 COC[C@@H](N)C(C)C MCULE-3882144478 [0,2,0,0,0,0|2,0,0]=4 1762 B7R0.5 COC[C@H](N)C(C)C MCULE-3191900867 [0,2,0,0,0,0|2,0,0]=4 1763 B7R0.5 COC[C@H](N)C(C)C MCULE-3410691563 [0,2,0,0,0,0|2,0,0]=4 1764 B7R0.10 BrCC(Br)C(Br)CBr MCULE-4342639702 [0,2,0,0,0,0|2,0,0]=4 1765 B7R0.10 BrC[C@H](Br)[C@H](Br)CBr MCULE-9743935577 [0,2,0,0,0,0|2,0,0]=4 1766 B7R0.10 C=CC(C)C(C)CC MCULE-2366850706 [0,2,0,0,0,0|2,0,0]=4 1767 B7R0.10 CC(CCl)C(C)CCl MCULE-1834137730 [0,2,0,0,0,0|2,0,0]=4 1768 B7R0.10 CC(CN)C(N)CO MCULE-1520376315 [0,2,0,0,0,0|2,0,0]=4 1769 B7R0.10 CC(CN)[C@H](N)CO MCULE-9250442888 [0,2,0,0,0,0|2,0,0]=4 1770 B7R0.10 CCC(C)C(C)CC MCULE-8164178184 [0,2,0,0,0,0|2,0,0]=4 1771 B7R0.10 CCC(C)C(N)CO MCULE-3990781918 [0,2,0,0,0,0|2,0,0]=4 1772 B7R0.10 CCC(C)C(N)CO MCULE-9261445768 [0,2,0,0,0,0|2,0,0]=4 1773 B7R0.10 CCC(C)C(O)CC MCULE-3936368693 [0,2,0,0,0,0|1,1,0]=4 1774 B7R0.10 CCC(C)C(O)CN MCULE-1941564207 [0,2,0,0,0,0|1,1,0]=4 1775 B7R0.10 CCC(C)C(O)CO MCULE-9999862073 [0,2,0,0,0,0|1,1,0]=4 1776 B7R0.10 CCC(N)C(O)CC MCULE-3578258801 [0,2,0,0,0,0|1,1,0]=4 1777 B7R0.10 CCC(O)C(C)CO MCULE-3930931405 [0,2,0,0,0,0|0,2,0]=4 1778 B7R0.10 CCC(O)C(C)CO MCULE-4472852672 [0,2,0,0,0,0|0,2,0]=4 1779 B7R0.10 CCC(S)C(C)CO MCULE-1500370684 [0,2,0,0,0,0|0,1,0]=3 1780 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-2122638055 [0,2,0,0,0,0|2,0,0]=4 1781 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-7964651759 [0,2,0,0,0,0|2,0,0]=4 1782 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-8482653298 [0,2,0,0,0,0|2,0,0]=4 1783 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-3409941550 [0,2,0,0,0,0|2,0,0]=4 1784 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-9750756690 [0,2,0,0,0,0|2,0,0]=4 1785 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-3647332227 [0,2,0,0,0,0|2,0,0]=4 1786 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-5774547825 [0,2,0,0,0,0|2,0,0]=4 1787 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8401203397 [0,2,0,0,0,0|2,0,0]=4 1788 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8452836661 [0,2,0,0,0,0|2,0,0]=4 1789 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-9307589673 [0,2,0,0,0,0|2,0,0]=4 1790 B7R0.10 COC(=O)C(C)CS MCULE-2870797526 [0,2,0,0,0,0|0,1,1]=4 1791 B7R0.10 COC(=O)C(C)SC MCULE-6914204626 [0,2,0,0,0,0|0,1,1]=4 1792 B7R0.10 COC(Cl)C(Cl)OC MCULE-4404338670 [0,2,0,0,0,0|2,0,0]=4 1793 B7R0.10 ClCC(Cl)C(Cl)CCl MCULE-9682638312 [0,2,0,0,0,0|2,0,0]=4 1794 B7R0.10 ClC[C@H](Cl)[C@H](Cl)CCl MCULE-1943421741 [0,2,0,0,0,0|2,0,0]=4 1795 B7R0.10 NC[C@@H](F)[C@H](F)CF MCULE-8718491620 [0,2,0,0,0,0|2,0,0]=4 1796 B7R0.10 NC[C@H](F)[C@H](F)CF MCULE-9246801464 [0,2,0,0,0,0|2,0,0]=4 1797 B7R0.10 NC[C@H](O)[C@H](O)CN MCULE-1073397630 [0,2,0,0,0,0|0,2,0]=4 1798 B7R0.10 NC[C@H](O)[C@H](O)CN MCULE-8068595970 [0,2,0,0,0,0|0,2,0]=4 1799 B7R0.10 N[C@@H](CO)[C@@H](N)CO MCULE-2394488011 [0,2,0,0,0,0|2,0,0]=4 1800 B7R0.10 OC(CBr)C(O)CBr MCULE-4608370293 [0,2,0,0,0,0|0,2,0]=4 1801 B7R0.10 OC(CCl)C(O)CCl MCULE-9282587936 [0,2,0,0,0,0|0,2,0]=4 1802 B7R0.10 OC(CS)C(O)CS MCULE-7432075835 [0,2,0,0,0,0|0,2,0]=4 1803 B7R0.10 OCC(Br)C(Br)CO MCULE-4593943249 [0,2,0,0,0,0|2,0,0]=4 1804 B7R0.10 OCC(O)C(O)CO MCULE-9009953851 [0,2,0,0,0,0|0,2,0]=4 1805 B7R0.10 OC[C@@H](Br)[C@H](Br)CO MCULE-7293448690 [0,2,0,0,0,0|2,0,0]=4 1806 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-1593828237 [0,2,0,0,0,0|0,2,0]=4 1807 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-7577661973 [0,2,0,0,0,0|0,2,0]=4 1808 B7R0.10 OC[C@@H](O)[C@H](S)CS MCULE-1423721945 [0,2,0,0,0,0|0,1,0]=3 1809 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-7306394407 [0,2,0,0,0,0|0,2,0]=4 1810 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-8013265935 [0,2,0,0,0,0|0,2,0]=4 1811 B7R0.10 OC[C@H](O)[C@H](O)CO MCULE-6886999157 [0,2,0,0,0,0|0,2,0]=4 1812 B7R0.10 O[C@@H](CS)[C@@H](O)CS MCULE-6947486648 [0,2,0,0,0,0|0,2,0]=4 1813 B7R0.10 O[C@@H](CS)[C@@H](O)CS MCULE-8883019394 [0,2,0,0,0,0|0,2,0]=4 1814 B7R0.10 O[C@H](CBr)[C@H](O)CBr MCULE-5914686116 [0,2,0,0,0,0|0,2,0]=4 1815 B7R0.10 O[C@H](CCl)[C@@H](O)CCl MCULE-8266433235 [0,2,0,0,0,0|0,2,0]=4 1816 B7R0.10 O[C@H](CS)[C@@H](O)CS MCULE-3618084743 [0,2,0,0,0,0|0,2,0]=4 1817 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-3329450277 [0,2,0,0,0,0|0,2,0]=4 1818 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-9065556670 [0,2,0,0,0,0|0,2,0]=4 1819 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-9666091728 [0,2,0,0,0,0|0,2,0]=4 1820 B7R0.10 [C@@H](C)(CC)[C@@H](N)CO MCULE-4423825378 [0,2,0,0,0,0|2,0,0]=4 1821 B7R0.13 C#CC(C)(O)C(C)C MCULE-4336185437 [0,2,0,0,0,0|1,1,0]=4 1822 B7R0.13 CC(C)C(C)(C)C=O MCULE-5719710912 [0,2,0,0,0,0|1,1,0]=4 1823 B7R0.13 CC(C)C(C)(C)CBr MCULE-1417156153 [0,2,0,0,0,0|2,0,0]=4 1824 B7R0.13 CC(C)C(C)(C)CN MCULE-1474008645 [0,2,0,0,0,0|2,0,0]=4 1825 B7R0.13 CC(C)C(C)(C)CN MCULE-3575810096 [0,2,0,0,0,0|2,0,0]=4 1826 B7R0.13 CC(C)C(C)(C)CO MCULE-1206498909 [0,2,0,0,0,0|1,1,0]=4 1827 B7R0.13 CC(C)C(C)(N)C#N MCULE-1173643434 [0,2,0,0,0,0|2,0,0]=4 1828 B7R0.13 CC(C)C(C)(N)CN MCULE-2884198159 [0,2,0,0,0,0|2,0,0]=4 1829 B7R0.13 CC(C)C(C)(O)CN MCULE-2436598879 [0,2,0,0,0,0|1,1,0]=4 1830 B7R0.13 CC(C)C(C)(O)CO MCULE-7640109698 [0,2,0,0,0,0|1,1,0]=4 1831 B7R0.13 CC(N)C(C)(C)C#N MCULE-8101579755 [0,2,0,0,0,0|2,0,0]=4 1832 B7R0.13 CC(N)C(C)(C)C#N MCULE-9684699745 [0,2,0,0,0,0|2,0,0]=4 1833 B7R0.13 CC(O)C(C)(C)C#N MCULE-7199396443 [0,2,0,0,0,0|1,1,0]=4 1834 B7R0.13 CC(O)C(C)(C)CN MCULE-2675460571 [0,2,0,0,0,0|1,1,0]=4 1835 B7R0.13 CC(O)C(C)(C)CO MCULE-1064066796 [0,2,0,0,0,0|0,2,0]=4 1836 B7R0.13 CCC(C)(C)C(C)N MCULE-8507623985 [0,2,0,0,0,0|2,0,0]=4 1837 B7R0.13 CCC(C)(C)C(C)N MCULE-9937664897 [0,2,0,0,0,0|2,0,0]=4 1838 B7R0.13 CCC(C)(O)C(C)O MCULE-5475978311 [0,2,0,0,0,0|0,2,0]=4 1839 B7R0.13 COC(C)(C)C(C)N MCULE-1405432657 [0,2,0,0,0,0|1,1,0]=4 1840 B7R0.13 COC(C)(C)C(C)N MCULE-8658451593 [0,2,0,0,0,0|1,1,0]=4 1841 B7R0.14 C=CC(C)C(C)(C)O MCULE-5525082295 [0,2,0,0,0,0|1,1,0]=4 1842 B7R0.14 CC(C#N)C(C)(C)C MCULE-4376441875 [0,2,0,0,0,0|2,0,0]=4 1843 B7R0.14 CC(C)(C)C(N)CN MCULE-8180805916 [0,2,0,0,0,0|2,0,0]=4 1844 B7R0.14 CC(C)(C)C(N)CN MCULE-8277347683 [0,2,0,0,0,0|2,0,0]=4 1845 B7R0.14 CC(C)(C)C(N)CO MCULE-7753244981 [0,2,0,0,0,0|2,0,0]=4 1846 B7R0.14 CC(C)(C)C(N)CO MCULE-8719256669 [0,2,0,0,0,0|2,0,0]=4 1847 B7R0.14 CC(C)(C)C(O)CBr MCULE-7385281890 [0,2,0,0,0,0|1,1,0]=4 1848 B7R0.14 CC(C)(C)C(O)CCl MCULE-2463075191 [0,2,0,0,0,0|1,1,0]=4 1849 B7R0.14 CC(C)(C)C(O)CN MCULE-1008278452 [0,2,0,0,0,0|1,1,0]=4 1850 B7R0.14 CC(C)(C)C(O)CO MCULE-2952507658 [0,2,0,0,0,0|1,1,0]=4 1851 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-3982110596 [0,2,0,0,0,0|2,0,0]=4 1852 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-5537283120 [0,2,0,0,0,0|2,0,0]=4 1853 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-9278147798 [0,2,0,0,0,0|2,0,0]=4 1854 B7R0.14 CC(C)(C)[C@H](N)CO MCULE-2023958874 [0,2,0,0,0,0|2,0,0]=4 1855 B7R0.14 CC(C)(C)[C@H](N)CO MCULE-6480065609 [0,2,0,0,0,0|2,0,0]=4 1856 B7R0.14 CC(C)(O)C(F)CN MCULE-4048927334 [0,2,0,0,0,0|1,1,0]=4 1857 B7R0.14 CC(C)(O)C(F)CN MCULE-5250059338 [0,2,0,0,0,0|1,1,0]=4 1858 B7R0.14 CC(C)(O)C(F)CN MCULE-6618174177 [0,2,0,0,0,0|1,1,0]=4 1859 B7R0.14 CC(C)(O)C(O)CN MCULE-5716430192 [0,2,0,0,0,0|0,2,0]=4 1860 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-4206986361 [0,2,0,0,0,0|1,1,0]=4 1861 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-4332950642 [0,2,0,0,0,0|1,1,0]=4 1862 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-5233683424 [0,2,0,0,0,0|1,1,0]=4 1863 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-9403366864 [0,2,0,0,0,0|1,1,0]=4 1864 B7R0.14 CC(C)(O)[C@H](F)CN MCULE-3837695935 [0,2,0,0,0,0|1,1,0]=4 1865 B7R0.14 CC(C)(O)[C@H](F)CN MCULE-5691809916 [0,2,0,0,0,0|1,1,0]=4 1866 B7R0.14 CC(C)(O)[C@H](F)CN MCULE-5910344650 [0,2,0,0,0,0|1,1,0]=4 1867 B7R0.14 CC(C=O)C(C)(C)C MCULE-9604117107 [0,2,0,0,0,0|1,1,0]=4 1868 B7R0.14 CC(CBr)C(C)(C)C MCULE-6651711768 [0,2,0,0,0,0|2,0,0]=4 1869 B7R0.14 CC(CBr)C(C)(F)F MCULE-1127900198 [0,2,0,0,0,0|2,0,0]=4 1870 B7R0.14 CC(CCl)C(C)(C)C MCULE-3598136068 [0,2,0,0,0,0|2,0,0]=4 1871 B7R0.14 CC(CI)C(C)(C)C MCULE-7307944422 [0,2,0,0,0,0|2,0,0]=4 1872 B7R0.14 CC(CN)C(C)(C)C MCULE-9518533099 [0,2,0,0,0,0|2,0,0]=4 1873 B7R0.14 CC(CN)C(C)(C)C MCULE-9752514124 [0,2,0,0,0,0|2,0,0]=4 1874 B7R0.14 CC(CO)C(C)(C)C MCULE-7343676375 [0,2,0,0,0,0|1,1,0]=4 1875 B7R0.14 CC(CO)C(C)(C)O MCULE-8073024148 [0,2,0,0,0,0|0,2,0]=4 1876 B7R0.14 CC(CO)C(C)(F)F MCULE-3224311448 [0,2,0,0,0,0|1,1,0]=4 1877 B7R0.14 CC(NN)C(C)(C)C MCULE-1417533708 [0,2,0,0,0,0|2,0,0]=4 1878 B7R0.14 CC(NN)C(C)(C)C MCULE-7144410689 [0,2,0,0,0,0|2,0,0]=4 1879 B7R0.14 CCC(C)C(C)(C)C MCULE-9713655910 [0,2,0,0,0,0|2,0,0]=4 1880 B7R0.14 CCC(N)C(C)(C)O MCULE-2452246439 [0,2,0,0,0,0|1,1,0]=4 1881 B7R0.14 CCC(N)C(C)(C)O MCULE-3686970762 [0,2,0,0,0,0|1,1,0]=4 1882 B7R0.14 CCC(O)C(C)(C)C MCULE-4883174975 [0,2,0,0,0,0|1,1,0]=4 1883 B7R0.14 CC[C@@H](N)C(C)(C)C MCULE-2279581739 [0,2,0,0,0,0|2,0,0]=4 1884 B7R0.14 CC[C@@H](N)C(C)(C)C MCULE-9333884063 [0,2,0,0,0,0|2,0,0]=4 1885 B7R0.14 CC[C@@H](N)C(C)(C)O MCULE-2250873384 [0,2,0,0,0,0|1,1,0]=4 1886 B7R0.14 CC[C@@H](N)C(C)(C)O MCULE-7069208023 [0,2,0,0,0,0|1,1,0]=4 1887 B7R0.14 CC[C@H](N)C(C)(C)O MCULE-6344226071 [0,2,0,0,0,0|1,1,0]=4 1888 B7R0.14 CC[C@H](N)C(C)(C)O MCULE-7677944024 [0,2,0,0,0,0|1,1,0]=4 1889 B7R0.14 CNC(C)C(C)(C)C MCULE-4693587118 [0,2,0,0,0,0|2,0,0]=4 1890 B7R0.14 CNC(C)C(C)(C)C MCULE-9517831875 [0,2,0,0,0,0|2,0,0]=4 1891 B7R0.14 CNC(C)C(C)(C)O MCULE-9520032279 [0,2,0,0,0,0|1,1,0]=4 1892 B7R0.14 COC(=O)C(C)(C)S MCULE-7289580958 [0,2,0,0,0,0|0,1,1]=4 1893 B7R0.14 C[C@@H](CO)C(C)(C)O MCULE-1478332547 [0,2,0,0,0,0|0,2,0]=4 1894 B7R0.14 C[C@@H](CO)C(C)(C)O MCULE-2286439441 [0,2,0,0,0,0|0,2,0]=4 1895 B7R0.14 NCC(S)C(F)(F)F MCULE-3392057862 [0,2,0,0,0,0|2,0,0]=4 1896 B7R0.14 NCC(S)C(F)(F)F MCULE-8886511272 [0,2,0,0,0,0|2,0,0]=4 1897 B7R0.14 [NH3+]C(CO)C(C)(C)C MCULE-6310162573 [0,2,0,0,0,0|2,0,0]=4 1898 B7R0.15 CC(C)C(CN)CO MCULE-2517509906 [0,2,0,0,0,0|1,1,0]=4 1899 B7R0.15 CC(C)C(CO)CO MCULE-8569465631 [0,2,0,0,0,0|1,1,0]=4 1900 B7R0.15 CC(C)C(CO)ON MCULE-7037439016 [0,2,0,0,0,0|1,1,0]=4 1901 B7R0.15 CC(C)C(CO)ON MCULE-9325437885 [0,2,0,0,0,0|1,1,0]=4 1902 B7R0.15 CC(O)C(CO)CO MCULE-9986430379 [0,2,0,0,0,0|0,2,0]=4 1903 B7R0.15 CCC(C=O)C(C)C MCULE-4336481271 [0,2,0,0,0,0|1,1,0]=4 1904 B7R0.15 CCC(CC)C(C)C MCULE-3824081707 [0,2,0,0,0,0|2,0,0]=4 1905 B7R0.15 CCC(CC)C(C)N MCULE-1696057542 [0,2,0,0,0,0|2,0,0]=4 1906 B7R0.15 CCC(CC)C(C)O MCULE-9742014522 [0,2,0,0,0,0|1,1,0]=4 1907 B7R0.15 CCC(CN)C(C)C MCULE-1827845015 [0,2,0,0,0,0|2,0,0]=4 1908 B7R0.15 CCC(CO)C(C)C MCULE-5089280337 [0,2,0,0,0,0|1,1,0]=4 1909 B7R0.15 CNC(CO)C(C)C MCULE-5445088789 [0,2,0,0,0,0|1,1,0]=4 1910 B7R0.15 COC(C=O)C(C)C MCULE-9722853501 [0,2,0,0,0,0|1,1,0]=4 1911 B7R0.15 COC(CBr)C(C)C MCULE-2169119261 [0,2,0,0,0,0|1,1,0]=4 1912 B7R0.15 COC(CN)C(C)C MCULE-9651783224 [0,2,0,0,0,0|1,1,0]=4 1913 B7R0.15 COC(CO)C(C)Br MCULE-6071239484 [0,2,0,0,0,0|1,1,0]=4 1914 B7R0.15 COC(CO)C(C)C MCULE-8695619177 [0,2,0,0,0,0|1,1,0]=4 1915 B7R0.15 COC(CO)C(C)N MCULE-9816044841 [0,2,0,0,0,0|1,1,0]=4 1916 B7R0.15 COC(OC)C(C)Br MCULE-1508849258 [0,2,0,0,0,0|1,1,0]=4 1917 B7R0.15 COC(OC)C(C)C MCULE-7291024997 [0,2,0,0,0,0|1,1,0]=4 1918 B7R0.15 COC(OC)C(C)N MCULE-3100864114 [0,2,0,0,0,0|1,1,0]=4 1919 B7R0.15 COC(OC)C(C)O MCULE-9058387582 [0,2,0,0,0,0|0,2,0]=4 1920 B7R0.15 COC(OC)[C@@H](C)O MCULE-2524252240 [0,2,0,0,0,0|0,2,0]=4 1921 B7R0.15 COC(OC)[C@H](C)O MCULE-2577056762 [0,2,0,0,0,0|0,2,0]=4 1922 B7R0.15 CO[C@@H](C=O)C(C)C MCULE-6654651958 [0,2,0,0,0,0|1,1,0]=4 1923 B7R0.15 CO[C@@H](CO)C(C)C MCULE-3676351737 [0,2,0,0,0,0|1,1,0]=4 1924 B7R0.15 CO[C@H](C=O)C(C)C MCULE-4139034238 [0,2,0,0,0,0|1,1,0]=4 1925 B7R0.15 CO[C@H](CO)C(C)C MCULE-2189146072 [0,2,0,0,0,0|1,1,0]=4 1926 B7R0.15 CSC(CO)C(C)N MCULE-6491195363 [0,2,0,0,0,0|1,0,0]=3 1927 B7R0.17 CC(C)(Br)C(C)(C)Br MCULE-2338146240 [0,2,0,0,0,0|2,0,0]=4 1928 B7R0.17 CC(C)(C)C(C)(C)C MCULE-5844448145 [0,2,0,0,0,0|2,0,0]=4 1929 B7R0.17 CC(C)(C)C(C)(C)N MCULE-5033934559 [0,2,0,0,0,0|2,0,0]=4 1930 B7R0.17 CC(C)(C)C(C)(C)N MCULE-5628884853 [0,2,0,0,0,0|2,0,0]=4 1931 B7R0.17 CC(C)(C)C(C)(C)O MCULE-7949162107 [0,2,0,0,0,0|1,1,0]=4 1932 B7R0.17 CC(C)(N)C(C)(C)N MCULE-4342833377 [0,2,0,0,0,0|2,0,0]=4 1933 B7R0.17 CC(C)(N)C(C)(C)N MCULE-4738656867 [0,2,0,0,0,0|2,0,0]=4 1934 B7R0.17 CC(C)(N)C(C)(C)O MCULE-3235981746 [0,2,0,0,0,0|1,1,0]=4 1935 B7R0.17 CC(C)(N)C(C)(F)F MCULE-3351549130 [0,2,0,0,0,0|2,0,0]=4 1936 B7R0.17 CC(C)(N)C(C)(F)F MCULE-8166499841 [0,2,0,0,0,0|2,0,0]=4 1937 B7R0.17 CC(C)(O)C(C)(C)O MCULE-1577235285 [0,2,0,0,0,0|0,2,0]=4 1938 B7R0.17 CC(F)(F)C(C)(F)Cl MCULE-3297759371 [0,2,0,0,0,0|2,0,0]=4 1939 B5R1.2 BrC1CCC1 MCULE-3713567804 [1,0,0,1,0,0|1,0,0]=3 1940 B5R1.2 BrC1CNC1 MCULE-4959282437 [1,0,0,1,0,0|2,0,0]=4 1941 B5R1.2 BrC1CNC1 MCULE-5635086924 [1,0,0,1,0,0|2,0,0]=4 1942 B5R1.2 BrC1CNC1 MCULE-7561312043 [1,0,0,1,0,0|2,0,0]=4 1943 B5R1.2 BrC1COC1 MCULE-7527620035 [1,0,0,1,0,0|1,1,0]=4 1944 B5R1.2 C=C1CCC1 MCULE-8318650413 [1,0,0,1,0,0|1,0,1]=4 1945 B5R1.2 CC1CCN1 MCULE-7952714343 [1,0,0,1,0,0|1,0,0]=3 1946 B5R1.2 CC1CCN1 MCULE-9084374728 [1,0,0,1,0,0|1,0,0]=3 1947 B5R1.2 CC1CNC1 MCULE-3977066574 [1,0,0,1,0,0|2,0,0]=4 1948 B5R1.2 CC1CNC1 MCULE-7868611457 [1,0,0,1,0,0|2,0,0]=4 1949 B5R1.2 C[C@@H]1CCN1 MCULE-1326888606 [1,0,0,1,0,0|1,0,0]=3 1950 B5R1.2 C[C@@H]1CCN1 MCULE-4242598105 [1,0,0,1,0,0|1,0,0]=3 1951 B5R1.2 C[C@@H]1CCN1 MCULE-7982357684 [1,0,0,1,0,0|1,0,0]=3 1952 B5R1.2 C[C@@H]1CCN1 MCULE-9443505478 [1,0,0,1,0,0|1,0,0]=3 1953 B5R1.2 C[C@H]1CCN1 MCULE-3178162849 [1,0,0,1,0,0|1,0,0]=3 1954 B5R1.2 C[C@H]1CCN1 MCULE-4001397038 [1,0,0,1,0,0|1,0,0]=3 1955 B5R1.2 C[C@H]1CCN1 MCULE-4361200248 [1,0,0,1,0,0|1,0,0]=3 1956 B5R1.2 C[C@H]1CCN1 MCULE-6534579029 [1,0,0,1,0,0|1,0,0]=3 1957 B5R1.2 ClC1CCC1 MCULE-2602937313 [1,0,0,1,0,0|1,0,0]=3 1958 B5R1.2 ClC1CNC1 MCULE-2051705029 [1,0,0,1,0,0|2,0,0]=4 1959 B5R1.2 ClC1CNC1 MCULE-6678325694 [1,0,0,1,0,0|2,0,0]=4 1960 B5R1.2 ClC1COC1 MCULE-7266812470 [1,0,0,1,0,0|1,1,0]=4 1961 B5R1.2 FC1CNC1 MCULE-5746598794 [1,0,0,1,0,0|2,0,0]=4 1962 B5R1.2 FC1CNC1 MCULE-9427948721 [1,0,0,1,0,0|2,0,0]=4 1963 B5R1.2 FC1COC1 MCULE-7899811313 [1,0,0,1,0,0|1,1,0]=4 1964 B5R1.2 IC1CCC1 MCULE-3890796264 [1,0,0,1,0,0|1,0,0]=3 1965 B5R1.2 IC1CNC1 MCULE-5957681014 [1,0,0,1,0,0|2,0,0]=4 1966 B5R1.2 IC1CNC1 MCULE-7396587981 [1,0,0,1,0,0|2,0,0]=4 1967 B5R1.2 IC1COC1 MCULE-6736781201 [1,0,0,1,0,0|1,1,0]=4 1968 B5R1.2 NC1CCC1 MCULE-7511834789 [1,0,0,1,0,0|1,0,0]=3 1969 B5R1.2 NC1CCC1 MCULE-9118406840 [1,0,0,1,0,0|1,0,0]=3 1970 B5R1.2 NC1CNC1 MCULE-3069271350 [1,0,0,1,0,0|2,0,0]=4 1971 B5R1.2 NC1CNC1 MCULE-4785323807 [1,0,0,1,0,0|2,0,0]=4 1972 B5R1.2 NC1COC1 MCULE-3457998413 [1,0,0,1,0,0|1,1,0]=4 1973 B5R1.2 NC1COC1 MCULE-8439862131 [1,0,0,1,0,0|1,1,0]=4 1974 B5R1.2 NC1CSC1 MCULE-8155396913 [1,0,0,1,0,0|1,0,0]=3 1975 B5R1.2 NC1CSC1 MCULE-8463545676 [1,0,0,1,0,0|1,0,0]=3 1976 B5R1.2 NC1CSC1 MCULE-8920812656 [1,0,0,1,0,0|1,0,0]=3 1977 B5R1.2 NN1CCC1 MCULE-8176731673 [1,0,0,1,0,0|2,0,0]=4 1978 B5R1.2 NN1CCC1 MCULE-8382619719 [1,0,0,1,0,0|2,0,0]=4 1979 B5R1.2 O=C1CCC1 MCULE-4870967355 [1,0,0,1,0,0|0,1,1]=4 1980 B5R1.2 O=C1CSC1 MCULE-4436071261 [1,0,0,1,0,0|0,1,1]=4 1981 B5R1.2 OC1CCC1 MCULE-2856311430 [1,0,0,1,0,0|0,1,0]=3 1982 B5R1.2 OC1CNC1 MCULE-3596383447 [1,0,0,1,0,0|1,1,0]=4 1983 B5R1.2 OC1CNC1 MCULE-7913518128 [1,0,0,1,0,0|1,1,0]=4 1984 B5R1.2 OC1COC1 MCULE-2630355859 [1,0,0,1,0,0|0,2,0]=4 1985 B5R1.2 OC1CSC1 MCULE-6759275460 [1,0,0,1,0,0|0,1,0]=3 1986 B5R1.2 SC1CCC1 MCULE-1779239394 [1,0,0,1,0,0|0,0,0]=2 1987 B5R1.2 SC1CNC1 MCULE-5823473779 [1,0,0,1,0,0|1,0,0]=3 1988 B5R1.2 SC1CNC1 MCULE-9002536698 [1,0,0,1,0,0|1,0,0]=3 1989 B5R1.2 SC1COC1 MCULE-2175099379 [1,0,0,1,0,0|0,1,0]=3 1990 B5R1.3 BrCC1CC1 MCULE-6057571576 [1,0,0,1,0,0|2,0,0]=4 1991 B5R1.3 BrCC1CO1 MCULE-1054784183 [1,0,0,1,0,0|1,1,0]=4 1992 B5R1.3 C1(CO1)CCl MCULE-2239256431 [1,0,0,1,0,0|1,1,0]=4 1993 B5R1.3 CCC1CO1 MCULE-4316722229 [1,0,0,1,0,0|0,1,0]=3 1994 B5R1.3 CCC1CO1 MCULE-8341828978 [1,0,0,1,0,0|0,1,0]=3 1995 B5R1.3 CC[C@@H]1CO1 MCULE-4349820919 [1,0,0,1,0,0|0,1,0]=3 1996 B5R1.3 CC[C@@H]1CO1 MCULE-5929218989 [1,0,0,1,0,0|0,1,0]=3 1997 B5R1.3 CC[C@H]1CO1 MCULE-3647278168 [1,0,0,1,0,0|0,1,0]=3 1998 B5R1.3 CC[C@H]1CO1 MCULE-4369524443 [1,0,0,1,0,0|0,1,0]=3 1999 B5R1.3 CNC1CC1 MCULE-4055097650 [1,0,0,1,0,0|2,0,0]=4 2000 B5R1.3 CNC1CC1 MCULE-8040280524 [1,0,0,1,0,0|2,0,0]=4 2001 B5R1.3 ClCC1CC1 MCULE-3906493674 [1,0,0,1,0,0|2,0,0]=4 2002 B5R1.3 ClCC1CO1 MCULE-9759519789 [1,0,0,1,0,0|1,1,0]=4 2003 B5R1.3 ClCC1CS1 MCULE-7368175691 [1,0,0,1,0,0|1,0,0]=3 2004 B5R1.3 ClC[C@@H]1CO1 MCULE-8144448889 [1,0,0,1,0,0|1,1,0]=4 2005 B5R1.3 ClC[C@@H]1CO1 MCULE-8710235870 [1,0,0,1,0,0|1,1,0]=4 2006 B5R1.3 ClC[C@H]1CO1 MCULE-2316124162 [1,0,0,1,0,0|1,1,0]=4 2007 B5R1.3 ClC[C@H]1CO1 MCULE-6957304600 [1,0,0,1,0,0|1,1,0]=4 2008 B5R1.3 FCC1CO1 MCULE-6156138745 [1,0,0,1,0,0|1,1,0]=4 2009 B5R1.3 FC[C@@H]1CO1 MCULE-7477932707 [1,0,0,1,0,0|1,1,0]=4 2010 B5R1.3 ICC1CC1 MCULE-2390979991 [1,0,0,1,0,0|2,0,0]=4 2011 B5R1.3 ICC1CO1 MCULE-6993621560 [1,0,0,1,0,0|1,1,0]=4 2012 B5R1.3 NCC1CC1 MCULE-5832294538 [1,0,0,1,0,0|2,0,0]=4 2013 B5R1.3 NCC1CC1 MCULE-9914994928 [1,0,0,1,0,0|2,0,0]=4 2014 B5R1.3 OCC1CC1 MCULE-4492474357 [1,0,0,1,0,0|1,1,0]=4 2015 B5R1.3 OCC1CO1 MCULE-2158628585 [1,0,0,1,0,0|0,2,0]=4 2016 B5R1.3 OCC1CO1 MCULE-4063620133 [1,0,0,1,0,0|0,2,0]=4 2017 B5R1.3 OC[C@@H]1CO1 MCULE-4213198809 [1,0,0,1,0,0|0,2,0]=4 2018 B5R1.3 OC[C@@H]1CO1 MCULE-6922911793 [1,0,0,1,0,0|0,2,0]=4 2019 B5R1.3 OC[C@H]1CO1 MCULE-2018407404 [1,0,0,1,0,0|0,2,0]=4 2020 B5R1.3 OC[C@H]1CO1 MCULE-9773081927 [1,0,0,1,0,0|0,2,0]=4 2021 B5R1.3 SCC1CC1 MCULE-9557919804 [1,0,0,1,0,0|1,0,0]=3 2022 B5R1.4 CC1CC1N MCULE-4472318973 [1,0,0,1,0,0|1,0,0]=3 2023 B5R1.4 CC1CC1N MCULE-8037315228 [1,0,0,1,0,0|1,0,0]=3 2024 B5R1.4 CC1CC1O MCULE-2006758475 [1,0,0,1,0,0|0,1,0]=3 2025 B5R1.4 CC1OC1C MCULE-9780363671 [1,0,0,1,0,0|0,1,0]=3 2026 B5R1.4 C[C@@H]1C[C@@H]1N MCULE-6282896395 [1,0,0,1,0,0|1,0,0]=3 2027 B5R1.4 C[C@@H]1C[C@H]1N MCULE-1526017761 [1,0,0,1,0,0|1,0,0]=3 2028 B5R1.4 C[C@@H]1C[C@H]1N MCULE-7111745511 [1,0,0,1,0,0|1,0,0]=3 2029 B5R1.4 C[C@@H]1C[C@H]1N MCULE-7879046644 [1,0,0,1,0,0|1,0,0]=3 2030 B5R1.4 C[C@@H]1C[C@H]1N MCULE-9805986423 [1,0,0,1,0,0|1,0,0]=3 2031 B5R1.4 C[C@@H]1O[C@@H]1C MCULE-4355544092 [1,0,0,1,0,0|0,1,0]=3 2032 B5R1.4 C[C@@H]1O[C@H]1C MCULE-1930253682 [1,0,0,1,0,0|0,1,0]=3 2033 B5R1.4 C[C@H]1C[C@@H]1N MCULE-9525222696 [1,0,0,1,0,0|1,0,0]=3 2034 B5R1.4 C[C@H]1C[C@@H]1N MCULE-9658987958 [1,0,0,1,0,0|1,0,0]=3 2035 B5R1.4 C[C@H]1C[C@H]1N MCULE-4953477750 [1,0,0,1,0,0|1,0,0]=3 2036 B5R1.4 C[C@H]1C[C@H]1N MCULE-6429810931 [1,0,0,1,0,0|1,0,0]=3 2037 B5R1.4 C[C@H]1O[C@@H]1C MCULE-4354089942 [1,0,0,1,0,0|0,1,0]=3 2038 B5R1.4 C[C@H]1O[C@@H]1C MCULE-7982793342 [1,0,0,1,0,0|0,1,0]=3 2039 B5R1.4 FC1CC1Br MCULE-9881614971 [1,0,0,1,0,0|2,0,0]=4 2040 B5R1.4 NC1CC1F MCULE-8246845073 [1,0,0,1,0,0|2,0,0]=4 2041 B5R1.4 NC1CC1F MCULE-9705431616 [1,0,0,1,0,0|2,0,0]=4 2042 B5R1.4 NC1CC1N MCULE-2596247889 [1,0,0,1,0,0|2,0,0]=4 2043 B5R1.4 NC1CC1N MCULE-7859500244 [1,0,0,1,0,0|2,0,0]=4 2044 B5R1.4 NC1CC1O MCULE-2677451452 [1,0,0,1,0,0|1,1,0]=4 2045 B5R1.4 NC1CC1O MCULE-2909581707 [1,0,0,1,0,0|1,1,0]=4 2046 B5R1.4 NC1C[C@@H]1F MCULE-6104198419 [1,0,0,1,0,0|2,0,0]=4 2047 B5R1.4 NC1C[C@@H]1F MCULE-8327037761 [1,0,0,1,0,0|2,0,0]=4 2048 B5R1.4 N[C@@H]1C[C@@H]1F MCULE-1523759808 [1,0,0,1,0,0|2,0,0]=4 2049 B5R1.4 N[C@@H]1C[C@@H]1F MCULE-1966857090 [1,0,0,1,0,0|2,0,0]=4 2050 B5R1.4 N[C@@H]1C[C@@H]1F MCULE-3541599795 [1,0,0,1,0,0|2,0,0]=4 2051 B5R1.4 N[C@@H]1C[C@@H]1F MCULE-8279324103 [1,0,0,1,0,0|2,0,0]=4 2052 B5R1.4 N[C@@H]1C[C@@H]1O MCULE-1950197706 [1,0,0,1,0,0|1,1,0]=4 2053 B5R1.4 N[C@@H]1C[C@H]1F MCULE-1379839035 [1,0,0,1,0,0|2,0,0]=4 2054 B5R1.4 N[C@@H]1C[C@H]1F MCULE-7084330140 [1,0,0,1,0,0|2,0,0]=4 2055 B5R1.4 N[C@@H]1C[C@H]1F MCULE-7552076798 [1,0,0,1,0,0|2,0,0]=4 2056 B5R1.4 N[C@@H]1C[C@H]1F MCULE-7897288338 [1,0,0,1,0,0|2,0,0]=4 2057 B5R1.4 N[C@@H]1C[C@H]1N MCULE-3447984641 [1,0,0,1,0,0|2,0,0]=4 2058 B5R1.4 N[C@@H]1C[C@H]1N MCULE-6823903337 [1,0,0,1,0,0|2,0,0]=4 2059 B5R1.4 N[C@@H]1C[C@H]1N MCULE-7464483331 [1,0,0,1,0,0|2,0,0]=4 2060 B5R1.4 N[C@@H]1C[C@H]1N MCULE-8962336863 [1,0,0,1,0,0|2,0,0]=4 2061 B5R1.4 N[C@@H]1C[C@H]1O MCULE-5188790849 [1,0,0,1,0,0|1,1,0]=4 2062 B5R1.4 N[C@@H]1C[C@H]1O MCULE-8531829585 [1,0,0,1,0,0|1,1,0]=4 2063 B5R1.4 N[C@H]1C[C@@H]1F MCULE-2098980306 [1,0,0,1,0,0|2,0,0]=4 2064 B5R1.4 N[C@H]1C[C@@H]1F MCULE-4142129455 [1,0,0,1,0,0|2,0,0]=4 2065 B5R1.4 N[C@H]1C[C@@H]1F MCULE-8616633135 [1,0,0,1,0,0|2,0,0]=4 2066 B5R1.4 N[C@H]1C[C@@H]1F MCULE-8788279695 [1,0,0,1,0,0|2,0,0]=4 2067 B5R1.4 N[C@H]1C[C@@H]1N MCULE-3374448650 [1,0,0,1,0,0|2,0,0]=4 2068 B5R1.4 N[C@H]1C[C@@H]1N MCULE-3782038729 [1,0,0,1,0,0|2,0,0]=4 2069 B5R1.4 N[C@H]1C[C@@H]1N MCULE-7583094160 [1,0,0,1,0,0|2,0,0]=4 2070 B5R1.4 N[C@H]1C[C@@H]1O MCULE-4699241997 [1,0,0,1,0,0|1,1,0]=4 2071 B5R1.4 N[C@H]1C[C@H]1F MCULE-1665232627 [1,0,0,1,0,0|2,0,0]=4 2072 B5R1.4 N[C@H]1C[C@H]1F MCULE-1941678287 [1,0,0,1,0,0|2,0,0]=4 2073 B5R1.4 N[C@H]1C[C@H]1F MCULE-3275343851 [1,0,0,1,0,0|2,0,0]=4 2074 B5R1.4 N[C@H]1C[C@H]1F MCULE-5308534229 [1,0,0,1,0,0|2,0,0]=4 2075 B5R1.4 N[C@H]1C[C@H]1N MCULE-1426528738 [1,0,0,1,0,0|2,0,0]=4 2076 B5R1.4 N[C@H]1C[C@H]1N MCULE-6003446819 [1,0,0,1,0,0|2,0,0]=4 2077 B5R1.4 N[C@H]1C[C@H]1O MCULE-3609246488 [1,0,0,1,0,0|1,1,0]=4 2078 B5R1.4 N[C@H]1C[C@H]1O MCULE-3860963329 [1,0,0,1,0,0|1,1,0]=4 2079 B5R1.4 [C@@H]1(C[C@H]1N)F MCULE-5118118569 [1,0,0,1,0,0|2,0,0]=4 2080 B5R1.4 [C@H]1(C[C@H]1F)N MCULE-1071128348 [1,0,0,1,0,0|2,0,0]=4 2081 B5R1.4 [C@H]1(C[C@H]1F)N MCULE-8956631145 [1,0,0,1,0,0|2,0,0]=4 2082 B5R1.5 CC1(CC1)Br MCULE-7741990197 [1,0,0,1,0,0|1,0,0]=3 2083 B5R1.5 CC1(CC1)N MCULE-5669720871 [1,0,0,1,0,0|1,0,0]=3 2084 B5R1.5 CC1(CC1)N MCULE-6964629714 [1,0,0,1,0,0|1,0,0]=3 2085 B5R1.5 CC1(CC1)O MCULE-8472680145 [1,0,0,1,0,0|0,1,0]=3 2086 B5R1.5 CC1(CN1)C MCULE-8452595493 [1,0,0,1,0,0|2,0,0]=4 2087 B5R1.5 CC1(CO1)C MCULE-4247049920 [1,0,0,1,0,0|1,1,0]=4 2088 B5R1.5 CC1(CS1)C MCULE-7579931452 [1,0,0,1,0,0|1,0,0]=3 2089 B5R1.5 ClC1(CC1)Cl MCULE-1245940379 [1,0,0,1,0,0|2,0,0]=4 2090 B5R1.5 NC1(CC1)O MCULE-6134507215 [1,0,0,1,0,0|1,1,0]=4 2091 B5R1.5 NC1(CC1)O MCULE-9233065159 [1,0,0,1,0,0|1,1,0]=4 2092 B7R1.2 CC1=NC(CS1)C MCULE-8843957654 [0,0,0,1,0,1|1,0,1]=4 2093 B7R1.2 CC1CC(=O)CS1 MCULE-7518365363 [0,0,0,1,0,1|0,1,1]=4 2094 B7R1.2 CC1CC(CN1)F MCULE-5211772527 [0,0,0,1,0,1|2,0,0]=4 2095 B7R1.2 CC1CC(CN1)F MCULE-6845898511 [0,0,0,1,0,1|2,0,0]=4 2096 B7R1.2 CC1CC(CN1)O MCULE-5630063862 [0,0,0,1,0,1|1,1,0]=4 2097 B7R1.2 CC1CC(CN1)O MCULE-7427731937 [0,0,0,1,0,1|1,1,0]=4 2098 B7R1.2 CC1CC(CO1)N MCULE-5031195609 [0,0,0,1,0,1|1,1,0]=4 2099 B7R1.2 CC1CC(CO1)N MCULE-6627149239 [0,0,0,1,0,1|1,1,0]=4 2100 B7R1.2 CC1CC(CO1)O MCULE-1304022283 [0,0,0,1,0,1|0,2,0]=4 2101 B7R1.2 CC1CC(CS1)N MCULE-2886562999 [0,0,0,1,0,1|1,0,0]=3 2102 B7R1.2 CC1CCC(C1)Br MCULE-3834311364 [0,0,0,1,0,1|2,0,0]=4 2103 B7R1.2 CC1CCC(C1)Cl MCULE-7669391571 [0,0,0,1,0,1|2,0,0]=4 2104 B7R1.2 CC1CCC(C1)N MCULE-3681457592 [0,0,0,1,0,1|2,0,0]=4 2105 B7R1.2 CC1CCC(C1)N MCULE-8238390084 [0,0,0,1,0,1|2,0,0]=4 2106 B7R1.2 CC1CCC(C1)O MCULE-7892602703 [0,0,0,1,0,1|1,1,0]=4 2107 B7R1.2 CC1CCC(N1)C MCULE-8652550641 [0,0,0,1,0,1|2,0,0]=4 2108 B7R1.2 CC1CCC(N1)C MCULE-9945795318 [0,0,0,1,0,1|2,0,0]=4 2109 B7R1.2 CC1CCC(O1)C MCULE-6766843462 [0,0,0,1,0,1|2,0,0]=4 2110 B7R1.2 CC1CC[C@H](N1)C MCULE-7537248866 [0,0,0,1,0,1|2,0,0]=4 2111 B7R1.2 CC1CC[C@H](N1)C MCULE-8839413924 [0,0,0,1,0,1|2,0,0]=4 2112 B7R1.2 CC1CNC(C1)C MCULE-3051496448 [0,0,0,1,0,1|2,0,0]=4 2113 B7R1.2 CC1CNC(C1)C MCULE-9324057254 [0,0,0,1,0,1|2,0,0]=4 2114 B7R1.2 CC1COC(O1)C MCULE-5670718739 [0,0,0,1,0,1|1,1,0]=4 2115 B7R1.2 C[C@@H]1CC[C@@H](C1)N MCULE-9471729241 [0,0,0,1,0,1|2,0,0]=4 2116 B7R1.2 C[C@@H]1CC[C@H](C1)N MCULE-5368765184 [0,0,0,1,0,1|2,0,0]=4 2117 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-1673197449 [0,0,0,1,0,1|2,0,0]=4 2118 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-2729648845 [0,0,0,1,0,1|2,0,0]=4 2119 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-4960548681 [0,0,0,1,0,1|2,0,0]=4 2120 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-9686295802 [0,0,0,1,0,1|2,0,0]=4 2121 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-1790804170 [0,0,0,1,0,1|2,0,0]=4 2122 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-2224321786 [0,0,0,1,0,1|2,0,0]=4 2123 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6164070045 [0,0,0,1,0,1|2,0,0]=4 2124 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6870592338 [0,0,0,1,0,1|2,0,0]=4 2125 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-1211015225 [0,0,0,1,0,1|1,1,0]=4 2126 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8025231795 [0,0,0,1,0,1|1,1,0]=4 2127 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8074184383 [0,0,0,1,0,1|1,1,0]=4 2128 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8403784233 [0,0,0,1,0,1|1,1,0]=4 2129 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-1165785658 [0,0,0,1,0,1|2,0,0]=4 2130 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-2237025386 [0,0,0,1,0,1|2,0,0]=4 2131 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-4695463101 [0,0,0,1,0,1|2,0,0]=4 2132 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-9859386988 [0,0,0,1,0,1|2,0,0]=4 2133 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-4359200896 [0,0,0,1,0,1|1,1,0]=4 2134 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-5029850022 [0,0,0,1,0,1|1,1,0]=4 2135 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8880723450 [0,0,0,1,0,1|1,1,0]=4 2136 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8966000465 [0,0,0,1,0,1|1,1,0]=4 2137 B7R1.2 C[C@H]1CC[C@@H](C1)N MCULE-1080493056 [0,0,0,1,0,1|2,0,0]=4 2138 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-4583560293 [0,0,0,1,0,1|2,0,0]=4 2139 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8297612622 [0,0,0,1,0,1|2,0,0]=4 2140 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8699883146 [0,0,0,1,0,1|2,0,0]=4 2141 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8917914682 [0,0,0,1,0,1|2,0,0]=4 2142 B7R1.2 C[C@H]1CC[C@H](C1)C MCULE-8059507758 [0,0,0,1,0,1|2,0,0]=4 2143 B7R1.2 C[C@H]1CC[C@H](C1)N MCULE-7070775136 [0,0,0,1,0,1|2,0,0]=4 2144 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-1935235769 [0,0,0,1,0,1|2,0,0]=4 2145 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-9833374653 [0,0,0,1,0,1|2,0,0]=4 2146 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-1742492020 [0,0,0,1,0,1|2,0,0]=4 2147 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-4690497151 [0,0,0,1,0,1|2,0,0]=4 2148 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-7372620241 [0,0,0,1,0,1|2,0,0]=4 2149 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-8319027426 [0,0,0,1,0,1|2,0,0]=4 2150 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-1346257695 [0,0,0,1,0,1|1,1,0]=4 2151 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-3035291598 [0,0,0,1,0,1|1,1,0]=4 2152 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-8611352921 [0,0,0,1,0,1|1,1,0]=4 2153 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-9413190353 [0,0,0,1,0,1|1,1,0]=4 2154 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-1099206732 [0,0,0,1,0,1|2,0,0]=4 2155 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8257992498 [0,0,0,1,0,1|2,0,0]=4 2156 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8335445065 [0,0,0,1,0,1|2,0,0]=4 2157 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-9395416229 [0,0,0,1,0,1|2,0,0]=4 2158 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-3188785695 [0,0,0,1,0,1|1,1,0]=4 2159 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-4518572489 [0,0,0,1,0,1|1,1,0]=4 2160 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-5322353871 [0,0,0,1,0,1|1,1,0]=4 2161 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-9693826142 [0,0,0,1,0,1|1,1,0]=4 2162 B7R1.2 NC1CCC(C1)F MCULE-1052463910 [0,0,0,1,0,1|2,0,0]=4 2163 B7R1.2 NC1CCC(C1)F MCULE-1362820422 [0,0,0,1,0,1|2,0,0]=4 2164 B7R1.2 NC1CCC(C1)N MCULE-7855552124 [0,0,0,1,0,1|2,0,0]=4 2165 B7R1.2 NC1CCC(C1)N MCULE-9706705284 [0,0,0,1,0,1|2,0,0]=4 2166 B7R1.2 NC1CCC(C1)O MCULE-5821071286 [0,0,0,1,0,1|1,1,0]=4 2167 B7R1.2 NC1CCC(C1)O MCULE-9391783901 [0,0,0,1,0,1|1,1,0]=4 2168 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-1039943323 [0,0,0,1,0,1|2,0,0]=4 2169 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-3861238775 [0,0,0,1,0,1|2,0,0]=4 2170 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-4709681384 [0,0,0,1,0,1|2,0,0]=4 2171 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-2973461190 [0,0,0,1,0,1|1,1,0]=4 2172 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-5462229704 [0,0,0,1,0,1|1,1,0]=4 2173 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-6746606174 [0,0,0,1,0,1|1,1,0]=4 2174 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7196403409 [0,0,0,1,0,1|1,1,0]=4 2175 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7511735313 [0,0,0,1,0,1|1,1,0]=4 2176 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-9023897758 [0,0,0,1,0,1|1,1,0]=4 2177 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-1973308112 [0,0,0,1,0,1|2,0,0]=4 2178 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-2885294836 [0,0,0,1,0,1|2,0,0]=4 2179 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-3217124168 [0,0,0,1,0,1|2,0,0]=4 2180 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-3983968357 [0,0,0,1,0,1|2,0,0]=4 2181 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-2953432986 [0,0,0,1,0,1|2,0,0]=4 2182 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-5679004800 [0,0,0,1,0,1|2,0,0]=4 2183 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-7275989455 [0,0,0,1,0,1|2,0,0]=4 2184 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-9713633356 [0,0,0,1,0,1|2,0,0]=4 2185 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-3286276562 [0,0,0,1,0,1|1,1,0]=4 2186 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-5345953109 [0,0,0,1,0,1|1,1,0]=4 2187 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-6442703385 [0,0,0,1,0,1|1,1,0]=4 2188 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-7457197538 [0,0,0,1,0,1|1,1,0]=4 2189 B7R1.2 N[C@H]1CC[C@@H](C1)F MCULE-7847317272 [0,0,0,1,0,1|2,0,0]=4 2190 B7R1.2 N[C@H]1CC[C@@H](C1)F MCULE-8833201415 [0,0,0,1,0,1|2,0,0]=4 2191 B7R1.2 N[C@H]1CC[C@@H](C1)N MCULE-3035711729 [0,0,0,1,0,1|2,0,0]=4 2192 B7R1.2 N[C@H]1CC[C@@H](C1)N MCULE-6912512686 [0,0,0,1,0,1|2,0,0]=4 2193 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-2764158583 [0,0,0,1,0,1|1,1,0]=4 2194 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-5047569623 [0,0,0,1,0,1|1,1,0]=4 2195 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-7674066148 [0,0,0,1,0,1|1,1,0]=4 2196 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-8478778872 [0,0,0,1,0,1|1,1,0]=4 2197 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-1792150017 [0,0,0,1,0,1|2,0,0]=4 2198 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-4563758183 [0,0,0,1,0,1|2,0,0]=4 2199 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-4785441600 [0,0,0,1,0,1|2,0,0]=4 2200 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-5413630050 [0,0,0,1,0,1|2,0,0]=4 2201 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-7223746698 [0,0,0,1,0,1|2,0,0]=4 2202 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-9000616089 [0,0,0,1,0,1|2,0,0]=4 2203 B7R1.2 N[C@H]1CC[C@H](C1)N MCULE-3378648870 [0,0,0,1,0,1|2,0,0]=4 2204 B7R1.2 N[C@H]1CC[C@H](C1)N MCULE-7356571170 [0,0,0,1,0,1|2,0,0]=4 2205 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-3786824722 [0,0,0,1,0,1|1,1,0]=4 2206 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-4140170961 [0,0,0,1,0,1|1,1,0]=4 2207 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5760466174 [0,0,0,1,0,1|1,1,0]=4 2208 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5995468864 [0,0,0,1,0,1|1,1,0]=4 2209 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-6230469368 [0,0,0,1,0,1|1,1,0]=4 2210 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-9622062244 [0,0,0,1,0,1|1,1,0]=4 2211 B7R1.2 OC1CCC(C1)O MCULE-2799846813 [0,0,0,1,0,1|0,2,0]=4 2212 B7R1.2 OC1CCC(O1)O MCULE-8012370358 [0,0,0,1,0,1|0,2,0]=4 2213 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-4481324218 [0,0,0,1,0,1|0,2,0]=4 2214 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-6560672131 [0,0,0,1,0,1|0,2,0]=4 2215 B7R1.2 O[C@H]1CC[C@H](C1)O MCULE-4640874873 [0,0,0,1,0,1|0,2,0]=4 2216 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-3137346382 [0,0,0,1,0,1|1,1,0]=4 2217 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-9954737796 [0,0,0,1,0,1|1,1,0]=4 2218 B7R1.2 [C@H]1(CC[C@H](C1)O)O MCULE-4834858159 [0,0,0,1,0,1|0,2,0]=4 2219 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-1916837136 [0,0,0,1,0,1|1,1,0]=4 2220 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-8263093896 [0,0,0,1,0,1|1,1,0]=4 2221 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9065610836 [0,0,0,1,0,1|1,1,0]=4 2222 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9910248291 [0,0,0,1,0,1|1,1,0]=4 2223 B7R1.12 CC(C)[C@@H]1C[C@H]1N MCULE-1713655941 [0,0,0,1,0,1|2,0,0]=4 2224 B7R1.12 CC(C)[C@@H]1C[C@H]1N MCULE-5926317826 [0,0,0,1,0,1|2,0,0]=4 2225 B7R1.16 CC1(CC(C1)Br)C MCULE-2265471373 [0,0,0,1,0,1|2,0,0]=4 2226 B7R1.16 CC1(CC(C1)F)N MCULE-3105278585 [0,0,0,1,0,1|2,0,0]=4 2227 B7R1.16 CC1(CC(C1)F)N MCULE-3834605630 [0,0,0,1,0,1|2,0,0]=4 2228 B7R1.16 CC1(CC(C1)N)C MCULE-8450516432 [0,0,0,1,0,1|2,0,0]=4 2229 B7R1.16 CC1(CC(C1)N)C MCULE-8841891654 [0,0,0,1,0,1|2,0,0]=4 2230 B7R1.16 CC1(CC(C1)N)F MCULE-5384391828 [0,0,0,1,0,1|2,0,0]=4 2231 B7R1.16 CC1(CC(C1)N)F MCULE-7937825593 [0,0,0,1,0,1|2,0,0]=4 2232 B7R1.16 CC1(CC(C1)N)N MCULE-2832826705 [0,0,0,1,0,1|2,0,0]=4 2233 B7R1.16 CC1(CC(C1)N)N MCULE-4502863138 [0,0,0,1,0,1|2,0,0]=4 2234 B7R1.16 CC1(CC(C1)N)O MCULE-4731102959 [0,0,0,1,0,1|1,1,0]=4 2235 B7R1.16 CC1(CC(C1)N)O MCULE-9310046804 [0,0,0,1,0,1|1,1,0]=4 2236 B7R1.16 CC1(CC(C1)O)C MCULE-3648206950 [0,0,0,1,0,1|1,1,0]=4 2237 B7R1.16 CC1(CC(C1)O)N MCULE-1038746550 [0,0,0,1,0,1|1,1,0]=4 2238 B7R1.16 CC1(CC(C1)O)N MCULE-9322183723 [0,0,0,1,0,1|1,1,0]=4 2239 B7R1.16 CC1CC(N1)(C)C MCULE-4439737144 [0,0,0,1,0,1|2,0,0]=4 2240 B7R1.16 C[C@@]1(C[C@@H](C1)N)F MCULE-5389101695 [0,0,0,1,0,1|2,0,0]=4 2241 B7R1.16 C[C@@]1(C[C@@H](C1)N)F MCULE-8735569131 [0,0,0,1,0,1|2,0,0]=4 2242 B7R1.16 C[C@@]1(C[C@@H](C1)N)O MCULE-2987812366 [0,0,0,1,0,1|1,1,0]=4 2243 B7R1.16 C[C@@]1(C[C@@H](C1)N)O MCULE-7967573609 [0,0,0,1,0,1|1,1,0]=4 2244 B7R1.16 C[C@@]1(C[C@@H](C1)O)N MCULE-6217394176 [0,0,0,1,0,1|1,1,0]=4 2245 B7R1.16 C[C@@]1(C[C@@H](C1)O)N MCULE-8859357729 [0,0,0,1,0,1|1,1,0]=4 2246 B7R1.16 C[C@@]1(C[C@H](C1)N)F MCULE-5069101992 [0,0,0,1,0,1|2,0,0]=4 2247 B7R1.16 C[C@@]1(C[C@H](C1)N)F MCULE-6163056975 [0,0,0,1,0,1|2,0,0]=4 2248 B7R1.16 C[C@@]1(C[C@H](C1)N)N MCULE-1124305376 [0,0,0,1,0,1|2,0,0]=4 2249 B7R1.16 C[C@@]1(C[C@H](C1)N)N MCULE-4365271192 [0,0,0,1,0,1|2,0,0]=4 2250 B7R1.16 C[C@@]1(C[C@H](C1)N)O MCULE-4536582361 [0,0,0,1,0,1|1,1,0]=4 2251 B7R1.16 C[C@@]1(C[C@H](C1)N)O MCULE-9705176834 [0,0,0,1,0,1|1,1,0]=4 2252 B7R1.16 C[C@@]1(C[C@H](C1)O)N MCULE-4910539354 [0,0,0,1,0,1|1,1,0]=4 2253 B7R1.16 C[C@@]1(C[C@H](C1)O)N MCULE-5459432358 [0,0,0,1,0,1|1,1,0]=4 2254 B7R1.20 CC(C)CC1CO1 MCULE-7259971470 [0,0,0,1,0,1|1,1,0]=4 2255 B7R1.20 CC(C)NC1CC1 MCULE-6011790113 [0,0,0,1,0,1|2,0,0]=4 2256 B7R1.20 CC(C)NC1CC1 MCULE-8727654998 [0,0,0,1,0,1|2,0,0]=4 2257 B7R1.20 CC(N)CC1CC1 MCULE-1913565015 [0,0,0,1,0,1|2,0,0]=4 2258 B7R1.20 CC(N)CC1CC1 MCULE-2214997571 [0,0,0,1,0,1|2,0,0]=4 2259 B7R1.20 CC(O)CC1CC1 MCULE-1952195648 [0,0,0,1,0,1|1,1,0]=4 2260 B7R1.20 C[C@@H](O)CC1CC1 MCULE-2616688976 [0,0,0,1,0,1|1,1,0]=4 2261 B7R1.20 C[C@H](O)CC1CC1 MCULE-5001414363 [0,0,0,1,0,1|1,1,0]=4 2262 B7R1.32 CC1(CC1(C)C)C MCULE-6773491597 [0,0,0,1,0,1|2,0,0]=4 2263 B7R1.32 CC1(CC1(C)N)C MCULE-1970710225 [0,0,0,1,0,1|2,0,0]=4 2264 B7R1.32 CC1(CC1(C)N)C MCULE-7120484909 [0,0,0,1,0,1|2,0,0]=4 2265 B7R1.4 BrC1CCCC1Br MCULE-9172342979 [0,1,0,1,0,0|2,0,0]=4 2266 B7R1.4 Br[C@@H]1CCC[C@H]1Br MCULE-5523481790 [0,1,0,1,0,0|2,0,0]=4 2267 B7R1.4 CC1CCCC1Br MCULE-7816907673 [0,1,0,1,0,0|2,0,0]=4 2268 B7R1.4 CC1CCCC1N MCULE-4318156403 [0,1,0,1,0,0|2,0,0]=4 2269 B7R1.4 CC1CCCC1N MCULE-4434172193 [0,1,0,1,0,0|2,0,0]=4 2270 B7R1.4 CC1CCCC1O MCULE-1288711765 [0,1,0,1,0,0|1,1,0]=4 2271 B7R1.4 CC1CCNC1C MCULE-2184586167 [0,1,0,1,0,0|2,0,0]=4 2272 B7R1.4 CC1CNCC1C MCULE-5821391512 [0,1,0,1,0,0|2,0,0]=4 2273 B7R1.4 CC1CNCC1C MCULE-6626101399 [0,1,0,1,0,0|2,0,0]=4 2274 B7R1.4 CC1CNCC1F MCULE-4834888455 [0,1,0,1,0,0|2,0,0]=4 2275 B7R1.4 CC1CNCC1F MCULE-7766072724 [0,1,0,1,0,0|2,0,0]=4 2276 B7R1.4 CC1CNCC1N MCULE-2314973615 [0,1,0,1,0,0|2,0,0]=4 2277 B7R1.4 CC1CNCC1N MCULE-8542352354 [0,1,0,1,0,0|2,0,0]=4 2278 B7R1.4 CC1CNCC1O MCULE-3308447861 [0,1,0,1,0,0|1,1,0]=4 2279 B7R1.4 CC1CNCC1O MCULE-8526879323 [0,1,0,1,0,0|1,1,0]=4 2280 B7R1.4 CC1COCC1N MCULE-5453471722 [0,1,0,1,0,0|1,1,0]=4 2281 B7R1.4 CC1COCC1N MCULE-6647217023 [0,1,0,1,0,0|1,1,0]=4 2282 B7R1.4 CC1COCC1O MCULE-5925280081 [0,1,0,1,0,0|0,2,0]=4 2283 B7R1.4 CC1CSCC1=O MCULE-5611423322 [0,1,0,1,0,0|0,1,1]=4 2284 B7R1.4 CC1CSCC1N MCULE-5628200403 [0,1,0,1,0,0|1,0,0]=3 2285 B7R1.4 CC1NCCC1O MCULE-7936666458 [0,1,0,1,0,0|1,1,0]=4 2286 B7R1.4 CC1NCCC1O MCULE-8369948926 [0,1,0,1,0,0|1,1,0]=4 2287 B7R1.4 CC1OCCC1N MCULE-4343663724 [0,1,0,1,0,0|1,1,0]=4 2288 B7R1.4 CC1OCCC1N MCULE-9003879039 [0,1,0,1,0,0|1,1,0]=4 2289 B7R1.4 CC1OCCC1O MCULE-6904695721 [0,1,0,1,0,0|0,2,0]=4 2290 B7R1.4 CC1OCCC1S MCULE-9127694888 [0,1,0,1,0,0|0,1,0]=3 2291 B7R1.4 CC1OCOC1C MCULE-9497186094 [0,1,0,1,0,0|0,2,0]=4 2292 B7R1.4 CC1SCCC1=O MCULE-5264322365 [0,1,0,1,0,0|0,1,1]=4 2293 B7R1.4 CC1SCCC1N MCULE-5160182865 [0,1,0,1,0,0|1,0,0]=3 2294 B7R1.4 CC1SCCC1N MCULE-8827106279 [0,1,0,1,0,0|1,0,0]=3 2295 B7R1.4 CC1SCCC1O MCULE-4342593310 [0,1,0,1,0,0|0,1,0]=3 2296 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-6206070680 [0,1,0,1,0,0|2,0,0]=4 2297 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-9964938082 [0,1,0,1,0,0|2,0,0]=4 2298 B7R1.4 C[C@@H]1CCC[C@@H]1O MCULE-2617120620 [0,1,0,1,0,0|1,1,0]=4 2299 B7R1.4 C[C@@H]1CCC[C@H]1N MCULE-8385969474 [0,1,0,1,0,0|2,0,0]=4 2300 B7R1.4 C[C@@H]1CCC[C@H]1O MCULE-3398682980 [0,1,0,1,0,0|1,1,0]=4 2301 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-4592161485 [0,1,0,1,0,0|2,0,0]=4 2302 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-5506149631 [0,1,0,1,0,0|2,0,0]=4 2303 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-4204399527 [0,1,0,1,0,0|2,0,0]=4 2304 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-8451199903 [0,1,0,1,0,0|2,0,0]=4 2305 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2290594563 [0,1,0,1,0,0|2,0,0]=4 2306 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2611807697 [0,1,0,1,0,0|2,0,0]=4 2307 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-3707409979 [0,1,0,1,0,0|2,0,0]=4 2308 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-4317636252 [0,1,0,1,0,0|2,0,0]=4 2309 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-2015388080 [0,1,0,1,0,0|1,1,0]=4 2310 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-3625149028 [0,1,0,1,0,0|1,1,0]=4 2311 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-5773404554 [0,1,0,1,0,0|1,1,0]=4 2312 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6014391902 [0,1,0,1,0,0|1,1,0]=4 2313 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6476104556 [0,1,0,1,0,0|1,1,0]=4 2314 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6537028059 [0,1,0,1,0,0|1,1,0]=4 2315 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-2567871968 [0,1,0,1,0,0|2,0,0]=4 2316 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-5626188867 [0,1,0,1,0,0|2,0,0]=4 2317 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-7438009663 [0,1,0,1,0,0|2,0,0]=4 2318 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-8649896095 [0,1,0,1,0,0|2,0,0]=4 2319 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-4207581523 [0,1,0,1,0,0|1,1,0]=4 2320 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-6158474994 [0,1,0,1,0,0|1,1,0]=4 2321 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7380960276 [0,1,0,1,0,0|1,1,0]=4 2322 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7589629864 [0,1,0,1,0,0|1,1,0]=4 2323 B7R1.4 C[C@@H]1COC[C@@H]1O MCULE-3198029643 [0,1,0,1,0,0|0,2,0]=4 2324 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-1145772262 [0,1,0,1,0,0|1,1,0]=4 2325 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-6639849267 [0,1,0,1,0,0|1,1,0]=4 2326 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-9659959713 [0,1,0,1,0,0|1,1,0]=4 2327 B7R1.4 C[C@@H]1COC[C@H]1O MCULE-1967963278 [0,1,0,1,0,0|0,2,0]=4 2328 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-1705265213 [0,1,0,1,0,0|1,1,0]=4 2329 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-3395898129 [0,1,0,1,0,0|1,1,0]=4 2330 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-5909894286 [0,1,0,1,0,0|1,1,0]=4 2331 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-9998480727 [0,1,0,1,0,0|1,1,0]=4 2332 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-1101330824 [0,1,0,1,0,0|1,1,0]=4 2333 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3326131093 [0,1,0,1,0,0|1,1,0]=4 2334 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3941456644 [0,1,0,1,0,0|1,1,0]=4 2335 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-8944150043 [0,1,0,1,0,0|1,1,0]=4 2336 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-5910807847 [0,1,0,1,0,0|1,1,0]=4 2337 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-7586038907 [0,1,0,1,0,0|1,1,0]=4 2338 B7R1.4 C[C@H]1CCC[C@@H]1N MCULE-4150988023 [0,1,0,1,0,0|2,0,0]=4 2339 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-5212653059 [0,1,0,1,0,0|1,1,0]=4 2340 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-7997646273 [0,1,0,1,0,0|1,1,0]=4 2341 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-3329868072 [0,1,0,1,0,0|2,0,0]=4 2342 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-4186145172 [0,1,0,1,0,0|2,0,0]=4 2343 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-3291842365 [0,1,0,1,0,0|1,1,0]=4 2344 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-7570125274 [0,1,0,1,0,0|1,1,0]=4 2345 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7622265949 [0,1,0,1,0,0|2,0,0]=4 2346 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7686056776 [0,1,0,1,0,0|2,0,0]=4 2347 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2214344957 [0,1,0,1,0,0|2,0,0]=4 2348 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2877312650 [0,1,0,1,0,0|2,0,0]=4 2349 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2282810666 [0,1,0,1,0,0|1,1,0]=4 2350 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2772361871 [0,1,0,1,0,0|1,1,0]=4 2351 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3274154422 [0,1,0,1,0,0|1,1,0]=4 2352 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3608199633 [0,1,0,1,0,0|1,1,0]=4 2353 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-6069899229 [0,1,0,1,0,0|2,0,0]=4 2354 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-8539137579 [0,1,0,1,0,0|2,0,0]=4 2355 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-1988679936 [0,1,0,1,0,0|1,1,0]=4 2356 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-3451477960 [0,1,0,1,0,0|1,1,0]=4 2357 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-4396463600 [0,1,0,1,0,0|1,1,0]=4 2358 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-7975653844 [0,1,0,1,0,0|1,1,0]=4 2359 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-3765921602 [0,1,0,1,0,0|0,2,0]=4 2360 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-5201903195 [0,1,0,1,0,0|0,2,0]=4 2361 B7R1.4 C[C@H]1COC[C@H]1O MCULE-2974083166 [0,1,0,1,0,0|0,2,0]=4 2362 B7R1.4 C[C@H]1COC[C@H]1O MCULE-6725207001 [0,1,0,1,0,0|0,2,0]=4 2363 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-5499798144 [0,1,0,1,0,0|1,1,0]=4 2364 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-7401004387 [0,1,0,1,0,0|1,1,0]=4 2365 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-7469942077 [0,1,0,1,0,0|1,1,0]=4 2366 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-9976903585 [0,1,0,1,0,0|1,1,0]=4 2367 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-1432785321 [0,1,0,1,0,0|1,1,0]=4 2368 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-3008045787 [0,1,0,1,0,0|1,1,0]=4 2369 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-7656776924 [0,1,0,1,0,0|1,1,0]=4 2370 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-8087379612 [0,1,0,1,0,0|1,1,0]=4 2371 B7R1.4 ClC1CCCC1Cl MCULE-1176916477 [0,1,0,1,0,0|2,0,0]=4 2372 B7R1.4 ClC1CCOC1Cl MCULE-1186010832 [0,1,0,1,0,0|2,0,0]=4 2373 B7R1.4 FC1CNCC1F MCULE-2795759224 [0,1,0,1,0,0|2,0,0]=4 2374 B7R1.4 FC1CNCC1F MCULE-4642260114 [0,1,0,1,0,0|2,0,0]=4 2375 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-1572445063 [0,1,0,1,0,0|2,0,0]=4 2376 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-4177562777 [0,1,0,1,0,0|2,0,0]=4 2377 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-4519639793 [0,1,0,1,0,0|2,0,0]=4 2378 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-5389552975 [0,1,0,1,0,0|2,0,0]=4 2379 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-6385794790 [0,1,0,1,0,0|2,0,0]=4 2380 B7R1.4 F[C@@H]1CNC[C@H]1F MCULE-7723721112 [0,1,0,1,0,0|2,0,0]=4 2381 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-1910510712 [0,1,0,1,0,0|2,0,0]=4 2382 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-1939514822 [0,1,0,1,0,0|2,0,0]=4 2383 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-7688312295 [0,1,0,1,0,0|2,0,0]=4 2384 B7R1.4 F[C@H]1CNC[C@@H]1F MCULE-9195313321 [0,1,0,1,0,0|2,0,0]=4 2385 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-1191772323 [0,1,0,1,0,0|2,0,0]=4 2386 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-1441165331 [0,1,0,1,0,0|2,0,0]=4 2387 B7R1.4 F[C@H]1CNC[C@H]1F MCULE-2941635831 [0,1,0,1,0,0|2,0,0]=4 2388 B7R1.4 NC1CCCC1F MCULE-2221939717 [0,1,0,1,0,0|2,0,0]=4 2389 B7R1.4 NC1CCCC1F MCULE-7473190715 [0,1,0,1,0,0|2,0,0]=4 2390 B7R1.4 NC1CCCC1N MCULE-5161769230 [0,1,0,1,0,0|2,0,0]=4 2391 B7R1.4 NC1CCCC1N MCULE-7834445190 [0,1,0,1,0,0|2,0,0]=4 2392 B7R1.4 NC1CCCC1O MCULE-1657591641 [0,1,0,1,0,0|1,1,0]=4 2393 B7R1.4 NC1CCCC1O MCULE-6248992494 [0,1,0,1,0,0|1,1,0]=4 2394 B7R1.4 NC1CNCC1F MCULE-1177091135 [0,1,0,1,0,0|2,0,0]=4 2395 B7R1.4 NC1CNCC1F MCULE-8259596061 [0,1,0,1,0,0|2,0,0]=4 2396 B7R1.4 NC1COCC1Br MCULE-5821692966 [0,1,0,1,0,0|2,0,0]=4 2397 B7R1.4 NC1COCC1F MCULE-5032224318 [0,1,0,1,0,0|2,0,0]=4 2398 B7R1.4 NC1COCC1F MCULE-8302920845 [0,1,0,1,0,0|2,0,0]=4 2399 B7R1.4 NC1COCC1N MCULE-1202195361 [0,1,0,1,0,0|2,0,0]=4 2400 B7R1.4 NC1COCC1N MCULE-4117465167 [0,1,0,1,0,0|2,0,0]=4 2401 B7R1.4 NC1COCC1O MCULE-3115911209 [0,1,0,1,0,0|1,1,0]=4 2402 B7R1.4 NC1COCC1O MCULE-9837103399 [0,1,0,1,0,0|1,1,0]=4 2403 B7R1.4 NC1CSCC1O MCULE-4474934833 [0,1,0,1,0,0|1,1,0]=4 2404 B7R1.4 NC1CSCC1O MCULE-5059305463 [0,1,0,1,0,0|1,1,0]=4 2405 B7R1.4 NC1CSCC1O MCULE-8633680588 [0,1,0,1,0,0|1,1,0]=4 2406 B7R1.4 N[C@@H]1CCC[C@@H]1F MCULE-5918995947 [0,1,0,1,0,0|2,0,0]=4 2407 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-3619202671 [0,1,0,1,0,0|1,1,0]=4 2408 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-5588562063 [0,1,0,1,0,0|1,1,0]=4 2409 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-8937650915 [0,1,0,1,0,0|1,1,0]=4 2410 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9550479411 [0,1,0,1,0,0|1,1,0]=4 2411 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9908988904 [0,1,0,1,0,0|1,1,0]=4 2412 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-1389039924 [0,1,0,1,0,0|2,0,0]=4 2413 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-2197861570 [0,1,0,1,0,0|2,0,0]=4 2414 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-3318849776 [0,1,0,1,0,0|2,0,0]=4 2415 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-5395257521 [0,1,0,1,0,0|2,0,0]=4 2416 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-8318262942 [0,1,0,1,0,0|2,0,0]=4 2417 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-9877401480 [0,1,0,1,0,0|2,0,0]=4 2418 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-1630250066 [0,1,0,1,0,0|2,0,0]=4 2419 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5738867214 [0,1,0,1,0,0|2,0,0]=4 2420 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5794367720 [0,1,0,1,0,0|2,0,0]=4 2421 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-6079002018 [0,1,0,1,0,0|2,0,0]=4 2422 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7332231839 [0,1,0,1,0,0|2,0,0]=4 2423 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7604406385 [0,1,0,1,0,0|2,0,0]=4 2424 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-2283352070 [0,1,0,1,0,0|1,1,0]=4 2425 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-3279782742 [0,1,0,1,0,0|1,1,0]=4 2426 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-6823698796 [0,1,0,1,0,0|1,1,0]=4 2427 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-7752087047 [0,1,0,1,0,0|1,1,0]=4 2428 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-8823714511 [0,1,0,1,0,0|1,1,0]=4 2429 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-9789739251 [0,1,0,1,0,0|1,1,0]=4 2430 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-1708344428 [0,1,0,1,0,0|2,0,0]=4 2431 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-3614628548 [0,1,0,1,0,0|2,0,0]=4 2432 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-5868430910 [0,1,0,1,0,0|2,0,0]=4 2433 B7R1.4 N[C@@H]1CNC[C@H]1F MCULE-9283549047 [0,1,0,1,0,0|2,0,0]=4 2434 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-1582887664 [0,1,0,1,0,0|2,0,0]=4 2435 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-3978694929 [0,1,0,1,0,0|2,0,0]=4 2436 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-4503972605 [0,1,0,1,0,0|2,0,0]=4 2437 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-6640537480 [0,1,0,1,0,0|2,0,0]=4 2438 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5625344145 [0,1,0,1,0,0|2,0,0]=4 2439 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5743565778 [0,1,0,1,0,0|2,0,0]=4 2440 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-7916026303 [0,1,0,1,0,0|2,0,0]=4 2441 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-2891920420 [0,1,0,1,0,0|1,1,0]=4 2442 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-5764643856 [0,1,0,1,0,0|1,1,0]=4 2443 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3183837574 [0,1,0,1,0,0|2,0,0]=4 2444 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3329511858 [0,1,0,1,0,0|2,0,0]=4 2445 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3234416434 [0,1,0,1,0,0|2,0,0]=4 2446 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3421021007 [0,1,0,1,0,0|2,0,0]=4 2447 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-1399984261 [0,1,0,1,0,0|1,1,0]=4 2448 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-2321912677 [0,1,0,1,0,0|1,1,0]=4 2449 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-4422404071 [0,1,0,1,0,0|1,1,0]=4 2450 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-7801515292 [0,1,0,1,0,0|1,1,0]=4 2451 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9112718041 [0,1,0,1,0,0|1,1,0]=4 2452 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9447703783 [0,1,0,1,0,0|1,1,0]=4 2453 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-4507133192 [0,1,0,1,0,0|1,1,0]=4 2454 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-9327920188 [0,1,0,1,0,0|1,1,0]=4 2455 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-5323319055 [0,1,0,1,0,0|1,1,0]=4 2456 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-8008053411 [0,1,0,1,0,0|1,1,0]=4 2457 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-6629056296 [0,1,0,1,0,0|1,1,0]=4 2458 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-7682114350 [0,1,0,1,0,0|1,1,0]=4 2459 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-8554796061 [0,1,0,1,0,0|1,1,0]=4 2460 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-9329258920 [0,1,0,1,0,0|1,1,0]=4 2461 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-1361897949 [0,1,0,1,0,0|2,0,0]=4 2462 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-4545374374 [0,1,0,1,0,0|2,0,0]=4 2463 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-1156997833 [0,1,0,1,0,0|1,1,0]=4 2464 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-2524879699 [0,1,0,1,0,0|1,1,0]=4 2465 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-7034968971 [0,1,0,1,0,0|1,1,0]=4 2466 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9262461574 [0,1,0,1,0,0|1,1,0]=4 2467 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9904485750 [0,1,0,1,0,0|1,1,0]=4 2468 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-1031359839 [0,1,0,1,0,0|2,0,0]=4 2469 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-6239060869 [0,1,0,1,0,0|2,0,0]=4 2470 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-4495433095 [0,1,0,1,0,0|2,0,0]=4 2471 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-6217406845 [0,1,0,1,0,0|2,0,0]=4 2472 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-9762071646 [0,1,0,1,0,0|2,0,0]=4 2473 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-1604156911 [0,1,0,1,0,0|1,1,0]=4 2474 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-3157811195 [0,1,0,1,0,0|1,1,0]=4 2475 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-4377495223 [0,1,0,1,0,0|1,1,0]=4 2476 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-8412403655 [0,1,0,1,0,0|1,1,0]=4 2477 B7R1.4 N[C@H]1COC[C@H]1F MCULE-7980939593 [0,1,0,1,0,0|2,0,0]=4 2478 B7R1.4 N[C@H]1COC[C@H]1F MCULE-8990550970 [0,1,0,1,0,0|2,0,0]=4 2479 B7R1.4 N[C@H]1COC[C@H]1O MCULE-5907972681 [0,1,0,1,0,0|1,1,0]=4 2480 B7R1.4 N[C@H]1COC[C@H]1O MCULE-7502895716 [0,1,0,1,0,0|1,1,0]=4 2481 B7R1.4 N[C@H]1COC[C@H]1O MCULE-8985833831 [0,1,0,1,0,0|1,1,0]=4 2482 B7R1.4 N[C@H]1COC[C@H]1O MCULE-9971794275 [0,1,0,1,0,0|1,1,0]=4 2483 B7R1.4 O=C1OCCC1S MCULE-2130434062 [0,1,0,1,0,0|0,1,1]=4 2484 B7R1.4 OC1CCCC1Br MCULE-9027030471 [0,1,0,1,0,0|1,1,0]=4 2485 B7R1.4 OC1CCCC1Cl MCULE-5561130140 [0,1,0,1,0,0|1,1,0]=4 2486 B7R1.4 OC1CCCC1F MCULE-9111039481 [0,1,0,1,0,0|1,1,0]=4 2487 B7R1.4 OC1CCCC1O MCULE-2003945768 [0,1,0,1,0,0|0,2,0]=4 2488 B7R1.4 OC1CNCC1Br MCULE-1241091506 [0,1,0,1,0,0|1,1,0]=4 2489 B7R1.4 OC1CNCC1Br MCULE-4889737174 [0,1,0,1,0,0|1,1,0]=4 2490 B7R1.4 OC1CNCC1F MCULE-3412240528 [0,1,0,1,0,0|1,1,0]=4 2491 B7R1.4 OC1CNCC1F MCULE-7214807363 [0,1,0,1,0,0|1,1,0]=4 2492 B7R1.4 OC1CNCC1O MCULE-4416566731 [0,1,0,1,0,0|0,2,0]=4 2493 B7R1.4 OC1CNCC1O MCULE-7287658845 [0,1,0,1,0,0|0,2,0]=4 2494 B7R1.4 OC1COCC1Br MCULE-8642236751 [0,1,0,1,0,0|1,1,0]=4 2495 B7R1.4 OC1COCC1F MCULE-3255803142 [0,1,0,1,0,0|1,1,0]=4 2496 B7R1.4 OC1COCC1O MCULE-2982401803 [0,1,0,1,0,0|0,2,0]=4 2497 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-5851051143 [0,1,0,1,0,0|1,1,0]=4 2498 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-6816188915 [0,1,0,1,0,0|1,1,0]=4 2499 B7R1.4 O[C@@H]1CCC[C@H]1F MCULE-6825738824 [0,1,0,1,0,0|1,1,0]=4 2500 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-3171045763 [0,1,0,1,0,0|0,2,0]=4 2501 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-4369287998 [0,1,0,1,0,0|0,2,0]=4 2502 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-4544085940 [0,1,0,1,0,0|1,1,0]=4 2503 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-6356393045 [0,1,0,1,0,0|1,1,0]=4 2504 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-7332143154 [0,1,0,1,0,0|1,1,0]=4 2505 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8032995983 [0,1,0,1,0,0|1,1,0]=4 2506 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8052505932 [0,1,0,1,0,0|1,1,0]=4 2507 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8564653401 [0,1,0,1,0,0|1,1,0]=4 2508 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-2691246784 [0,1,0,1,0,0|1,1,0]=4 2509 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-7250968554 [0,1,0,1,0,0|1,1,0]=4 2510 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8439784112 [0,1,0,1,0,0|1,1,0]=4 2511 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8682802807 [0,1,0,1,0,0|1,1,0]=4 2512 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-2199886254 [0,1,0,1,0,0|0,2,0]=4 2513 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-3341203076 [0,1,0,1,0,0|0,2,0]=4 2514 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-5521619072 [0,1,0,1,0,0|0,2,0]=4 2515 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-2460253154 [0,1,0,1,0,0|1,1,0]=4 2516 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-3624406213 [0,1,0,1,0,0|1,1,0]=4 2517 B7R1.4 O[C@@H]1COC[C@H]1O MCULE-5846282762 [0,1,0,1,0,0|0,2,0]=4 2518 B7R1.4 O[C@H]1CCC[C@@H]1F MCULE-5487297072 [0,1,0,1,0,0|1,1,0]=4 2519 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4051443060 [0,1,0,1,0,0|0,2,0]=4 2520 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4644231649 [0,1,0,1,0,0|0,2,0]=4 2521 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-6847877597 [0,1,0,1,0,0|0,2,0]=4 2522 B7R1.4 O[C@H]1CCC[C@H]1Br MCULE-2758354858 [0,1,0,1,0,0|1,1,0]=4 2523 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-6157730443 [0,1,0,1,0,0|1,1,0]=4 2524 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-8785327416 [0,1,0,1,0,0|1,1,0]=4 2525 B7R1.4 O[C@H]1CCC[C@H]1O MCULE-7305350842 [0,1,0,1,0,0|0,2,0]=4 2526 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-3839318633 [0,1,0,1,0,0|1,1,0]=4 2527 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-4218821429 [0,1,0,1,0,0|1,1,0]=4 2528 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-7845583982 [0,1,0,1,0,0|1,1,0]=4 2529 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-9325791348 [0,1,0,1,0,0|1,1,0]=4 2530 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-5585016580 [0,1,0,1,0,0|0,2,0]=4 2531 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-6252837981 [0,1,0,1,0,0|0,2,0]=4 2532 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-7474807017 [0,1,0,1,0,0|0,2,0]=4 2533 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-8814174366 [0,1,0,1,0,0|0,2,0]=4 2534 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-9936814184 [0,1,0,1,0,0|0,2,0]=4 2535 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-2104048645 [0,1,0,1,0,0|1,1,0]=4 2536 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5086480017 [0,1,0,1,0,0|1,1,0]=4 2537 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5328004683 [0,1,0,1,0,0|1,1,0]=4 2538 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5990996560 [0,1,0,1,0,0|1,1,0]=4 2539 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-8087937166 [0,1,0,1,0,0|0,2,0]=4 2540 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-9522092804 [0,1,0,1,0,0|0,2,0]=4 2541 B7R1.4 O[C@H]1COC[C@@H]1F MCULE-7724910066 [0,1,0,1,0,0|1,1,0]=4 2542 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-2140544466 [0,1,0,1,0,0|0,2,0]=4 2543 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-9526811966 [0,1,0,1,0,0|0,2,0]=4 2544 B7R1.4 O[C@H]1COC[C@H]1O MCULE-2862505352 [0,1,0,1,0,0|0,2,0]=4 2545 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-2430440513 [0,1,0,1,0,0|2,0,0]=4 2546 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-8503171996 [0,1,0,1,0,0|2,0,0]=4 2547 B7R1.4 [C@@H]1(CCC[C@H]1N)F MCULE-5545998720 [0,1,0,1,0,0|2,0,0]=4 2548 B7R1.4 [C@@H]1(CNC[C@@H]1O)O MCULE-2661544949 [0,1,0,1,0,0|0,2,0]=4 2549 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-3635591654 [0,1,0,1,0,0|2,0,0]=4 2550 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-5914925477 [0,1,0,1,0,0|2,0,0]=4 2551 B7R1.4 [C@@H]1(COC[C@@H]1N)N MCULE-4324328112 [0,1,0,1,0,0|2,0,0]=4 2552 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-1484680203 [0,1,0,1,0,0|1,1,0]=4 2553 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-7754900549 [0,1,0,1,0,0|1,1,0]=4 2554 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-5920046767 [0,1,0,1,0,0|1,1,0]=4 2555 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-6282053067 [0,1,0,1,0,0|1,1,0]=4 2556 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-8432332245 [0,1,0,1,0,0|1,1,0]=4 2557 B7R1.4 [NH3+][C@@H]1CSC[C@@H]1O MCULE-5747970201 [0,1,0,1,0,0|1,1,0]=4 2558 B7R1.4 [NH3+][C@@H]1CSC[C@H]1O MCULE-4897701746 [0,1,0,1,0,0|1,1,0]=4 2559 B7R1.8 CC1CCC1C=O MCULE-9541644884 [0,1,0,1,0,0|1,1,0]=4 2560 B7R1.8 CC1CCC1CO MCULE-4677269341 [0,1,0,1,0,0|1,1,0]=4 2561 B7R1.8 CC1NCC1C#N MCULE-4737687321 [0,1,0,1,0,0|2,0,0]=4 2562 B7R1.8 CC1NCC1C#N MCULE-5845745422 [0,1,0,1,0,0|2,0,0]=4 2563 B7R1.8 CN[C@H]1CC[C@@H]1O MCULE-4638367588 [0,1,0,1,0,0|1,1,0]=4 2564 B7R1.8 COC1CCC1N MCULE-4537411385 [0,1,0,1,0,0|1,1,0]=4 2565 B7R1.8 COC1CCC1N MCULE-6423037026 [0,1,0,1,0,0|1,1,0]=4 2566 B7R1.8 CO[C@@H]1CC[C@@H]1N MCULE-3087283983 [0,1,0,1,0,0|1,1,0]=4 2567 B7R1.8 CO[C@@H]1CC[C@@H]1N MCULE-8723342484 [0,1,0,1,0,0|1,1,0]=4 2568 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-1324573121 [0,1,0,1,0,0|1,1,0]=4 2569 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-4430321170 [0,1,0,1,0,0|1,1,0]=4 2570 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-4876260929 [0,1,0,1,0,0|1,1,0]=4 2571 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-5060858396 [0,1,0,1,0,0|1,1,0]=4 2572 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-5711735047 [0,1,0,1,0,0|1,1,0]=4 2573 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-9952102635 [0,1,0,1,0,0|1,1,0]=4 2574 B7R1.8 CO[C@H]1CC[C@@H]1N MCULE-2991866514 [0,1,0,1,0,0|1,1,0]=4 2575 B7R1.8 CO[C@H]1CC[C@@H]1N MCULE-9729569658 [0,1,0,1,0,0|1,1,0]=4 2576 B7R1.8 CO[C@H]1CC[C@H]1N MCULE-9859722305 [0,1,0,1,0,0|1,1,0]=4 2577 B7R1.8 CO[C@H]1CC[C@H]1N MCULE-9948570347 [0,1,0,1,0,0|1,1,0]=4 2578 B7R1.8 CSC1CCC1=O MCULE-3892720319 [0,1,0,1,0,0|0,1,1]=4 2579 B7R1.8 NCC1CCC1F MCULE-6621673772 [0,1,0,1,0,0|2,0,0]=4 2580 B7R1.8 NCC1CCC1F MCULE-8982565541 [0,1,0,1,0,0|2,0,0]=4 2581 B7R1.8 OCC1CCC1F MCULE-2481035584 [0,1,0,1,0,0|1,1,0]=4 2582 B7R1.8 OCC1CCC1O MCULE-9764745395 [0,1,0,1,0,0|0,2,0]=4 2583 B7R1.8 OC[C@@H]1CC[C@H]1O MCULE-5043281368 [0,1,0,1,0,0|0,2,0]=4 2584 B7R1.8 OC[C@H]1CC[C@H]1O MCULE-1536326248 [0,1,0,1,0,0|0,2,0]=4 2585 B7R1.15 CC1CC(=O)C1C MCULE-1068922218 [0,1,0,1,0,0|1,1,0]=4 2586 B7R1.17 CC1(CCC1Br)C MCULE-2707590334 [0,1,0,1,0,0|2,0,0]=4 2587 B7R1.17 CC1(CCC1N)C MCULE-3143969489 [0,1,0,1,0,0|2,0,0]=4 2588 B7R1.17 CC1(CCC1N)C MCULE-7719131610 [0,1,0,1,0,0|2,0,0]=4 2589 B7R1.17 CC1(CCC1O)C MCULE-7385359414 [0,1,0,1,0,0|1,1,0]=4 2590 B7R1.17 CC1(CC[C@@H]1O)C MCULE-9766955692 [0,1,0,1,0,0|1,1,0]=4 2591 B7R1.17 CC1(NCC1O)C MCULE-5840741801 [0,1,0,1,0,0|1,1,0]=4 2592 B7R1.17 CC1(NCC1O)C MCULE-7044413523 [0,1,0,1,0,0|1,1,0]=4 2593 B7R1.17 CC1(OCC1N)C MCULE-2792085100 [0,1,0,1,0,0|1,1,0]=4 2594 B7R1.17 CC1(OCC1O)C MCULE-4679216060 [0,1,0,1,0,0|0,2,0]=4 2595 B7R1.17 CC1(OC[C@@H]1N)C MCULE-1806722832 [0,1,0,1,0,0|1,1,0]=4 2596 B7R1.17 CC1(SCC1N)C MCULE-2967285527 [0,1,0,1,0,0|1,0,0]=3 2597 B7R1.17 CC1(SCC1N)C MCULE-3093982180 [0,1,0,1,0,0|1,0,0]=3 2598 B7R1.17 CC1NCC1(F)F MCULE-1956414038 [0,1,0,1,0,0|2,0,0]=4 2599 B7R1.17 CC1NCC1(F)F MCULE-1970006339 [0,1,0,1,0,0|2,0,0]=4 2600 B7R1.17 C[C@@H]1NCC1(F)F MCULE-5175218628 [0,1,0,1,0,0|2,0,0]=4 2601 B7R1.17 C[C@@H]1NCC1(F)F MCULE-7899231967 [0,1,0,1,0,0|2,0,0]=4 2602 B7R1.17 C[C@@H]1NCC1(F)F MCULE-9534584245 [0,1,0,1,0,0|2,0,0]=4 2603 B7R1.17 C[C@@H]1NCC1(F)F MCULE-9843997255 [0,1,0,1,0,0|2,0,0]=4 2604 B7R1.17 C[C@H]1NCC1(F)F MCULE-1873777384 [0,1,0,1,0,0|2,0,0]=4 2605 B7R1.17 C[C@H]1NCC1(F)F MCULE-6528763696 [0,1,0,1,0,0|2,0,0]=4 2606 B7R1.17 C[C@H]1NCC1(F)F MCULE-8252201644 [0,1,0,1,0,0|2,0,0]=4 2607 B7R1.17 C[C@H]1NCC1(F)F MCULE-9118002562 [0,1,0,1,0,0|2,0,0]=4 2608 B7R1.17 NC1CCC1(F)F MCULE-4486749666 [0,1,0,1,0,0|2,0,0]=4 2609 B7R1.17 NC1CCC1(F)F MCULE-4755825201 [0,1,0,1,0,0|2,0,0]=4 2610 B7R1.17 N[C@@H]1CCC1(F)F MCULE-1150459129 [0,1,0,1,0,0|2,0,0]=4 2611 B7R1.17 N[C@@H]1CCC1(F)F MCULE-4191148082 [0,1,0,1,0,0|2,0,0]=4 2612 B7R1.17 N[C@H]1CCC1(F)F MCULE-7199799736 [0,1,0,1,0,0|2,0,0]=4 2613 B7R1.18 CC(C)C1CNC1 MCULE-4830353053 [0,1,0,1,0,0|2,0,0]=4 2614 B7R1.18 CC(C)C1CNC1 MCULE-7304386148 [0,1,0,1,0,0|2,0,0]=4 2615 B7R1.18 CC(N)C1CCC1 MCULE-1055775237 [0,1,0,1,0,0|2,0,0]=4 2616 B7R1.18 CC(N)C1CCC1 MCULE-4303681430 [0,1,0,1,0,0|2,0,0]=4 2617 B7R1.18 CC(N)C1COC1 MCULE-1380624257 [0,1,0,1,0,0|1,1,0]=4 2618 B7R1.18 CC(N)C1CSC1 MCULE-5095506053 [0,1,0,1,0,0|1,0,0]=3 2619 B7R1.18 CC(O)C1CCC1 MCULE-7846963519 [0,1,0,1,0,0|1,1,0]=4 2620 B7R1.18 CC(O)C1CNC1 MCULE-1265886795 [0,1,0,1,0,0|1,1,0]=4 2621 B7R1.18 CC(O)C1CNC1 MCULE-5108259269 [0,1,0,1,0,0|1,1,0]=4 2622 B7R1.18 CC(O)C1CNC1 MCULE-8265279011 [0,1,0,1,0,0|1,1,0]=4 2623 B7R1.18 CC(O)C1COC1 MCULE-4981198639 [0,1,0,1,0,0|0,2,0]=4 2624 B7R1.18 C[C@@H](N)C1CCC1 MCULE-4670161237 [0,1,0,1,0,0|2,0,0]=4 2625 B7R1.18 C[C@@H](N)C1CCC1 MCULE-6520272933 [0,1,0,1,0,0|2,0,0]=4 2626 B7R1.18 C[C@@H](N)C1CCC1 MCULE-8342688572 [0,1,0,1,0,0|2,0,0]=4 2627 B7R1.18 C[C@@H](N)C1CCC1 MCULE-9076983662 [0,1,0,1,0,0|2,0,0]=4 2628 B7R1.18 C[C@@H](N)C1COC1 MCULE-7669553866 [0,1,0,1,0,0|1,1,0]=4 2629 B7R1.18 C[C@@H](O)C1CCC1 MCULE-6990873960 [0,1,0,1,0,0|1,1,0]=4 2630 B7R1.18 C[C@@H](O)C1COC1 MCULE-5223611242 [0,1,0,1,0,0|0,2,0]=4 2631 B7R1.18 C[C@@H](O)C1COC1 MCULE-5819578881 [0,1,0,1,0,0|0,2,0]=4 2632 B7R1.18 C[C@H](N)C1CCC1 MCULE-2555280675 [0,1,0,1,0,0|2,0,0]=4 2633 B7R1.18 C[C@H](N)C1CCC1 MCULE-3888125434 [0,1,0,1,0,0|2,0,0]=4 2634 B7R1.18 C[C@H](N)C1CCC1 MCULE-6963105805 [0,1,0,1,0,0|2,0,0]=4 2635 B7R1.18 C[C@H](N)C1CCC1 MCULE-7483270694 [0,1,0,1,0,0|2,0,0]=4 2636 B7R1.18 C[C@H](N)C1COC1 MCULE-8337949293 [0,1,0,1,0,0|1,1,0]=4 2637 B7R1.18 C[C@H](O)C1CCC1 MCULE-5072123772 [0,1,0,1,0,0|1,1,0]=4 2638 B7R1.18 C[C@H](O)C1CCC1 MCULE-6701623925 [0,1,0,1,0,0|1,1,0]=4 2639 B7R1.18 C[C@H](O)C1CNC1 MCULE-4694154501 [0,1,0,1,0,0|1,1,0]=4 2640 B7R1.18 C[C@H](O)C1CNC1 MCULE-5870270724 [0,1,0,1,0,0|1,1,0]=4 2641 B7R1.18 C[C@H](O)C1COC1 MCULE-1396791034 [0,1,0,1,0,0|0,2,0]=4 2642 B7R1.18 C[C@H](O)C1COC1 MCULE-8805369596 [0,1,0,1,0,0|0,2,0]=4 2643 B7R1.19 CC(C)C1(CC1)N MCULE-4070811283 [0,1,0,1,0,0|2,0,0]=4 2644 B7R1.19 CC(C)C1(CC1)N MCULE-8353733005 [0,1,0,1,0,0|2,0,0]=4 2645 B7R1.19 CC(C)C1(CC1)O MCULE-3516849541 [0,1,0,1,0,0|1,1,0]=4 2646 B7R1.19 CC(C)C1(CO1)C MCULE-6945955143 [0,1,0,1,0,0|1,1,0]=4 2647 B7R1.19 CC(N)C1(CC1)C MCULE-5748183771 [0,1,0,1,0,0|2,0,0]=4 2648 B7R1.19 CC(N)C1(CC1)C MCULE-5829560197 [0,1,0,1,0,0|2,0,0]=4 2649 B7R1.19 CC(N)C1(CC1)O MCULE-9318031577 [0,1,0,1,0,0|1,1,0]=4 2650 B7R1.19 CC(O)C1(CC1)C MCULE-6644959738 [0,1,0,1,0,0|1,1,0]=4 2651 B7R1.19 CC(O)C1(CC1)N MCULE-7865299177 [0,1,0,1,0,0|1,1,0]=4 2652 B7R1.22 CC(C#N)C1CC1 MCULE-5117863339 [0,1,0,1,0,0|2,0,0]=4 2653 B7R1.22 CC(C=O)C1CC1 MCULE-9307079880 [0,1,0,1,0,0|1,1,0]=4 2654 B7R1.22 CC(CBr)C1CC1 MCULE-6817011252 [0,1,0,1,0,0|2,0,0]=4 2655 B7R1.22 CC(CN)C1CC1 MCULE-8672047249 [0,1,0,1,0,0|2,0,0]=4 2656 B7R1.22 CC(CN)C1CC1 MCULE-9115092780 [0,1,0,1,0,0|2,0,0]=4 2657 B7R1.22 CC(CO)C1CC1 MCULE-8325587009 [0,1,0,1,0,0|1,1,0]=4 2658 B7R1.22 CC(NN)C1CC1 MCULE-4645972246 [0,1,0,1,0,0|2,0,0]=4 2659 B7R1.22 CC(NN)C1CC1 MCULE-5779482348 [0,1,0,1,0,0|2,0,0]=4 2660 B7R1.22 CC(NN)C1CC1 MCULE-8729564000 [0,1,0,1,0,0|2,0,0]=4 2661 B7R1.22 CC(ON)C1CC1 MCULE-7159103218 [0,1,0,1,0,0|1,1,0]=4 2662 B7R1.22 CC(ON)C1CC1 MCULE-9475793465 [0,1,0,1,0,0|1,1,0]=4 2663 B7R1.22 CCC(N)C1CC1 MCULE-2935155085 [0,1,0,1,0,0|2,0,0]=4 2664 B7R1.22 CCC(N)C1CC1 MCULE-7295156418 [0,1,0,1,0,0|2,0,0]=4 2665 B7R1.22 CCC(O)C1CC1 MCULE-5753196768 [0,1,0,1,0,0|1,1,0]=4 2666 B7R1.22 CC[C@@H](N)C1CC1 MCULE-8184175332 [0,1,0,1,0,0|2,0,0]=4 2667 B7R1.22 CC[C@H](N)C1CC1 MCULE-5395953598 [0,1,0,1,0,0|2,0,0]=4 2668 B7R1.22 CC[C@H](N)C1CC1 MCULE-6843001585 [0,1,0,1,0,0|2,0,0]=4 2669 B7R1.22 CC[C@H](N)C1CC1 MCULE-8773009184 [0,1,0,1,0,0|2,0,0]=4 2670 B7R1.22 CNC(C)C1CC1 MCULE-3862123004 [0,1,0,1,0,0|2,0,0]=4 2671 B7R1.22 CNC(C)C1CC1 MCULE-5338638792 [0,1,0,1,0,0|2,0,0]=4 2672 B7R1.22 ClCC(Cl)C1CO1 MCULE-4739045871 [0,1,0,1,0,0|1,1,0]=4 2673 B7R1.22 NC(CO)C1CC1 MCULE-5154854421 [0,1,0,1,0,0|2,0,0]=4 2674 B7R1.22 NC(CO)C1CC1 MCULE-8775546228 [0,1,0,1,0,0|2,0,0]=4 2675 B7R1.22 NCC(N)C1CC1 MCULE-9464810605 [0,1,0,1,0,0|2,0,0]=4 2676 B7R1.22 NCC(O)C1CC1 MCULE-4953920778 [0,1,0,1,0,0|1,1,0]=4 2677 B7R1.22 NCC(O)C1CC1 MCULE-5905916662 [0,1,0,1,0,0|1,1,0]=4 2678 B7R1.22 NC[C@@H](N)C1CC1 MCULE-3450570705 [0,1,0,1,0,0|2,0,0]=4 2679 B7R1.22 NC[C@@H](N)C1CC1 MCULE-4753758413 [0,1,0,1,0,0|2,0,0]=4 2680 B7R1.22 NC[C@@H](N)C1CC1 MCULE-4823446729 [0,1,0,1,0,0|2,0,0]=4 2681 B7R1.22 NC[C@@H](N)C1CC1 MCULE-7123860849 [0,1,0,1,0,0|2,0,0]=4 2682 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5231249344 [0,1,0,1,0,0|2,0,0]=4 2683 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5233980282 [0,1,0,1,0,0|2,0,0]=4 2684 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9664157108 [0,1,0,1,0,0|2,0,0]=4 2685 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9941605288 [0,1,0,1,0,0|2,0,0]=4 2686 B7R1.22 N[C@H](CO)C1CC1 MCULE-3523450080 [0,1,0,1,0,0|2,0,0]=4 2687 B7R1.22 N[C@H](CO)C1CC1 MCULE-6097147899 [0,1,0,1,0,0|2,0,0]=4 2688 B7R1.22 N[C@H](CO)C1CC1 MCULE-9050007019 [0,1,0,1,0,0|2,0,0]=4 2689 B7R1.22 N[C@H](CO)C1CC1 MCULE-9945100855 [0,1,0,1,0,0|2,0,0]=4 2690 B7R1.22 OC(CBr)C1CC1 MCULE-1163924206 [0,1,0,1,0,0|1,1,0]=4 2691 B7R1.22 OCC(O)C1CC1 MCULE-9694056700 [0,1,0,1,0,0|1,1,0]=4 2692 B7R1.23 CC1(CC1C#N)C MCULE-6202919210 [0,1,0,1,0,0|2,0,0]=4 2693 B7R1.23 CC1(CC1C=O)Br MCULE-1505961517 [0,1,0,1,0,0|1,1,0]=4 2694 B7R1.23 CC1(CC1C=O)C MCULE-9386051771 [0,1,0,1,0,0|1,1,0]=4 2695 B7R1.23 CC1(CC1CN)C MCULE-5243006209 [0,1,0,1,0,0|2,0,0]=4 2696 B7R1.23 CC1(CC1CN)C MCULE-8803769775 [0,1,0,1,0,0|2,0,0]=4 2697 B7R1.23 CC1(CC1CO)Br MCULE-1246890004 [0,1,0,1,0,0|1,1,0]=4 2698 B7R1.23 CC1(CC1CO)C MCULE-3855230422 [0,1,0,1,0,0|1,1,0]=4 2699 B7R1.23 CC1(C[C@@H]1CO)C MCULE-2771980454 [0,1,0,1,0,0|1,1,0]=4 2700 B7R1.23 CC1(C[C@H]1CO)C MCULE-7876524457 [0,1,0,1,0,0|1,1,0]=4 2701 B7R1.23 CC1(OC1CBr)C MCULE-1797899499 [0,1,0,1,0,0|1,1,0]=4 2702 B7R1.23 CC1(OC1CCl)C MCULE-6494110934 [0,1,0,1,0,0|1,1,0]=4 2703 B7R1.23 CC1(OC1CO)C MCULE-5147602353 [0,1,0,1,0,0|1,1,0]=4 2704 B7R1.23 CNC1CC1(C)C MCULE-2392748327 [0,1,0,1,0,0|2,0,0]=4 2705 B7R1.23 CNC1CC1(C)C MCULE-6195602506 [0,1,0,1,0,0|2,0,0]=4 2706 B7R1.27 CC1(CC1Br)CN MCULE-1556714007 [0,1,0,1,0,0|2,0,0]=4 2707 B7R1.27 CC1(CC1Br)CN MCULE-5280385523 [0,1,0,1,0,0|2,0,0]=4 2708 B7R1.27 CC1(CC1Br)CO MCULE-5286402958 [0,1,0,1,0,0|1,1,0]=4 2709 B7R1.27 CC1(CC1F)CO MCULE-9626513813 [0,1,0,1,0,0|1,1,0]=4 2710 B7R1.27 CC1CC1(C)C=O MCULE-1780701123 [0,1,0,1,0,0|1,1,0]=4 2711 B7R1.27 CCC1(CC1N)C MCULE-2073505141 [0,1,0,1,0,0|2,0,0]=4 2712 B7R1.27 CCC1(CC1N)C MCULE-3927183672 [0,1,0,1,0,0|2,0,0]=4 2713 B7R1.27 COC1(CC1N)C MCULE-2779937239 [0,1,0,1,0,0|1,1,0]=4 2714 B7R1.26 CC(C)(C)C1CO1 MCULE-7365554350 [0,1,0,1,0,0|1,1,0]=4 2715 B7R1.26 CC(C)(N)C1CC1 MCULE-1426293730 [0,1,0,1,0,0|2,0,0]=4 2716 B7R1.26 CC(C)(N)C1CC1 MCULE-1800665492 [0,1,0,1,0,0|2,0,0]=4 2717 B7R1.26 CC(C)(O)C1CC1 MCULE-8228565189 [0,1,0,1,0,0|1,1,0]=4 2718 B7R1.26 CC(C)(O)C1CO1 MCULE-7074440148 [0,1,0,1,0,0|0,2,0]=4 2719 B7R2.3 BrC1CC12CC2 MCULE-6919212225 [0,0,0,2,0,0|2,0,0]=4 2720 B7R2.3 NC1CC12CC2 MCULE-4664631556 [0,0,0,2,0,0|2,0,0]=4 2721 B7R2.3 NC1CC12CC2 MCULE-7886006711 [0,0,0,2,0,0|2,0,0]=4 2722 B7R2.1 C1CC1C2CO2 MCULE-9859676878 [0,0,0,2,0,0|1,1,0]=4 2723 B7R2.1 C1O[C@@H]1[C@@H]2CO2 MCULE-3158496673 [0,0,0,2,0,0|0,2,0]=4 2724 B7R2.1 C1O[C@@H]1[C@@H]2CO2 MCULE-4139336692 [0,0,0,2,0,0|0,2,0]=4 2725 B7R0.6 CC(Br)CCC(C)Br MCULE-4511070452 [0,0,0,0,0,2|2,0,0]=4 2726 B7R0.6 CC(C)CCC(C)Br MCULE-4005079361 [0,0,0,0,0,2|2,0,0]=4 2727 B7R0.6 CC(C)CCC(C)C MCULE-4093485278 [0,0,0,0,0,2|2,0,0]=4 2728 B7R0.6 CC(C)CCC(C)N MCULE-3038746969 [0,0,0,0,0,2|2,0,0]=4 2729 B7R0.6 CC(C)CCC(C)N MCULE-7972635029 [0,0,0,0,0,2|2,0,0]=4 2730 B7R0.6 CC(C)CCC(C)O MCULE-6292509345 [0,0,0,0,0,2|1,1,0]=4 2731 B7R0.6 CC(C)CNC(C)C MCULE-1556200503 [0,0,0,0,0,2|2,0,0]=4 2732 B7R0.6 CC(C)CNC(C)C MCULE-9703437877 [0,0,0,0,0,2|2,0,0]=4 2733 B7R0.6 CC(C)NNC(C)C MCULE-3764729342 [0,0,0,0,0,2|2,0,0]=4 2734 B7R0.6 CC(C)NNC(C)C MCULE-4843652600 [0,0,0,0,0,2|2,0,0]=4 2735 B7R0.6 CC(C)OC[C@H](C)O MCULE-2195035455 [0,0,0,0,0,2|1,1,0]=4 2736 B7R0.6 CC(C)SSC(C)C MCULE-1405616566 [0,0,0,0,0,2|2,0,0]=4 2737 B7R0.6 CC(O)C#CC(C)O MCULE-5307271719 [0,0,0,0,0,2|0,2,0]=4 2738 B7R0.6 CC(O)C=CC(C)O MCULE-1362403822 [0,0,0,0,0,2|0,2,0]=4 2739 B7R0.6 CC(O)CCC(C)O MCULE-6170497684 [0,0,0,0,0,2|0,2,0]=4 2740 B7R0.6 CC(O)CNC(C)C MCULE-9932831006 [0,0,0,0,0,2|1,1,0]=4 2741 B7R0.6 CC(O)COC(C)C MCULE-3357280817 [0,0,0,0,0,2|1,1,0]=4 2742 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-3982464496 [0,0,0,0,0,2|0,2,0]=4 2743 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-6083261012 [0,0,0,0,0,2|0,2,0]=4 2744 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-8142548171 [0,0,0,0,0,2|0,2,0]=4 2745 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-5867971604 [0,0,0,0,0,2|0,2,0]=4 2746 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-7024859164 [0,0,0,0,0,2|0,2,0]=4