0 B8R1.7 C1(CCCN1)C(=O)N MCULE-2539007211 [0,0,0,0,0,0|2,0,0]=2 1 B8R1.7 C1(CCCN1)C(=O)N MCULE-7289713183 [0,0,0,0,0,0|2,0,0]=2 2 B8R1.7 C1(CCCN1)C(C)C MCULE-1193597619 [0,0,0,0,0,0|3,0,1]=4 3 B8R1.7 C1(CCCN1)C(C)C MCULE-5005043134 [0,0,0,0,0,0|3,0,1]=4 4 B8R1.7 C1(CCCN1)C(F)F MCULE-5617460277 [0,0,0,0,0,0|3,0,1]=4 5 B8R1.7 C1(CCCN1)C(F)F MCULE-7529295267 [0,0,0,0,0,0|3,0,1]=4 6 B8R1.7 C1(CCNC1)C(=O)N MCULE-4476688014 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.7 C1(CCNC1)C(=O)N MCULE-8592806332 [0,0,0,0,0,0|3,0,0]=3 8 B8R1.7 C1(CCNC1)C(=O)O MCULE-3210241958 [0,0,0,0,0,0|2,0,0]=2 9 B8R1.7 C1(CCNC1)C(=O)O MCULE-6517290754 [0,0,0,0,0,0|2,0,0]=2 10 B8R1.7 C1(CCOC1)C(=O)O MCULE-4859263225 [0,0,0,0,0,0|2,0,0]=2 11 B8R1.7 C=C(C)C1=NCCO1 MCULE-8164273045 [0,0,0,0,0,0|3,0,1]=4 12 B8R1.7 CC(=O)C1=CCCC1 MCULE-9623046872 [0,0,0,0,0,0|2,0,1]=3 13 B8R1.7 CC(=O)C1=NCCS1 MCULE-8548990347 [0,0,0,0,0,0|2,1,1]=4 14 B8R1.7 CC(=O)C1CCC=N1 MCULE-5434976735 [0,0,0,0,0,0|2,0,1]=3 15 B8R1.7 CC(=O)C1CCCC1 MCULE-7952211819 [0,0,0,0,0,0|2,0,0]=2 16 B8R1.7 CC(=O)C1CCCN1 MCULE-2528977871 [0,0,0,0,0,0|2,0,0]=2 17 B8R1.7 CC(=O)C1CCCN1 MCULE-9222880225 [0,0,0,0,0,0|2,0,0]=2 18 B8R1.7 CC(=O)C1CCCO1 MCULE-7518147693 [0,0,0,0,0,0|1,0,0]=1 19 B8R1.7 CC(=O)C1CCNC1 MCULE-2147779518 [0,0,0,0,0,0|3,0,0]=3 20 B8R1.7 CC(=O)C1CCNC1 MCULE-2964372059 [0,0,0,0,0,0|3,0,0]=3 21 B8R1.7 CC(=O)C1CCOC1 MCULE-2105633909 [0,0,0,0,0,0|3,0,0]=3 22 B8R1.7 CC(=O)C1NCCS1 MCULE-4092674646 [0,0,0,0,0,0|2,1,0]=3 23 B8R1.7 CC(=O)C1NCCS1 MCULE-8660367055 [0,0,0,0,0,0|2,1,0]=3 24 B8R1.7 CC(=O)N1CCCC1 MCULE-6839528034 [0,0,0,0,0,0|3,0,0]=3 25 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-1290635339 [0,0,0,0,0,0|2,0,0]=2 26 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2855198659 [0,0,0,0,0,0|2,0,0]=2 27 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2944662012 [0,0,0,0,0,0|2,0,0]=2 28 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-4806473466 [0,0,0,0,0,0|2,0,0]=2 29 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-2015960170 [0,0,0,0,0,0|1,0,0]=1 30 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-3381319090 [0,0,0,0,0,0|1,0,0]=1 31 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-2095368644 [0,0,0,0,0,0|2,0,0]=2 32 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-5460066005 [0,0,0,0,0,0|2,0,0]=2 33 B8R1.7 CC(=O)[C@H]1CCCO1 MCULE-5637204370 [0,0,0,0,0,0|1,0,0]=1 34 B8R1.7 CC(Br)C1CCCC1 MCULE-9104958283 [0,0,0,0,0,0|3,0,1]=4 35 B8R1.7 CC(C)C1CCCC1 MCULE-4905120936 [0,0,0,0,0,0|3,0,1]=4 36 B8R1.7 CC(C)C1CCCN1 MCULE-2880698089 [0,0,0,0,0,0|3,0,1]=4 37 B8R1.7 CC(C)C1CCCN1 MCULE-8748321913 [0,0,0,0,0,0|3,0,1]=4 38 B8R1.7 CC(C)C1NCCO1 MCULE-8813624423 [0,0,0,0,0,0|3,0,1]=4 39 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-1080192326 [0,0,0,0,0,0|3,0,1]=4 40 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-7041423474 [0,0,0,0,0,0|3,0,1]=4 41 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-8923460014 [0,0,0,0,0,0|3,0,1]=4 42 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-9332303275 [0,0,0,0,0,0|3,0,1]=4 43 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-2217061634 [0,0,0,0,0,0|3,0,1]=4 44 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-7316037645 [0,0,0,0,0,0|3,0,1]=4 45 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-7382792334 [0,0,0,0,0,0|3,0,1]=4 46 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-9823510614 [0,0,0,0,0,0|3,0,1]=4 47 B8R1.7 CC(N)C1CCCC1 MCULE-1576719851 [0,0,0,0,0,0|3,0,1]=4 48 B8R1.7 CC(N)C1CCCC1 MCULE-9047229690 [0,0,0,0,0,0|3,0,1]=4 49 B8R1.7 CC(N)C1CCCO1 MCULE-2883137296 [0,0,0,0,0,0|2,0,1]=3 50 B8R1.7 CC(N)C1CCCO1 MCULE-3041511194 [0,0,0,0,0,0|2,0,1]=3 51 B8R1.7 CC(O)C1CCCC1 MCULE-6730583511 [0,0,0,0,0,0|2,0,1]=3 52 B8R1.7 CC(O)C1CCCO1 MCULE-2804362263 [0,0,0,0,0,0|1,0,1]=2 53 B8R1.7 CC(O)C1CCNC1 MCULE-3316354505 [0,0,0,0,0,0|3,0,1]=4 54 B8R1.7 CC(O)C1CCNC1 MCULE-6188875194 [0,0,0,0,0,0|3,0,1]=4 55 B8R1.7 CC(O)C1CCOC1 MCULE-1059653145 [0,0,0,0,0,0|3,0,1]=4 56 B8R1.7 CN(C)C1CCCC1 MCULE-2157359156 [0,0,0,0,0,0|4,0,0]=4 57 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-2532670333 [0,0,0,0,0,0|3,0,1]=4 58 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-7828853056 [0,0,0,0,0,0|3,0,1]=4 59 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-8150036197 [0,0,0,0,0,0|3,0,1]=4 60 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-8243361407 [0,0,0,0,0,0|3,0,1]=4 61 B8R1.7 C[C@@H](O)C1CCCC1 MCULE-2530250478 [0,0,0,0,0,0|2,0,1]=3 62 B8R1.7 C[C@@H](O)[C@H]1CCCO1 MCULE-6393902221 [0,0,0,0,0,0|1,0,1]=2 63 B8R1.7 C[C@H](N)C1CCCC1 MCULE-4224874512 [0,0,0,0,0,0|3,0,1]=4 64 B8R1.7 C[C@H](N)C1CCCC1 MCULE-6435654240 [0,0,0,0,0,0|3,0,1]=4 65 B8R1.7 C[C@H](N)C1CCCC1 MCULE-8124130642 [0,0,0,0,0,0|3,0,1]=4 66 B8R1.7 C[C@H](N)C1CCCC1 MCULE-9554309821 [0,0,0,0,0,0|3,0,1]=4 67 B8R1.7 C[C@H](N)C1CCCO1 MCULE-6245058799 [0,0,0,0,0,0|2,0,1]=3 68 B8R1.7 C[C@H](N)C1CCCO1 MCULE-6470683195 [0,0,0,0,0,0|2,0,1]=3 69 B8R1.7 C[C@H](O)C1CCCC1 MCULE-9054245488 [0,0,0,0,0,0|2,0,1]=3 70 B8R1.7 C[C@H](O)C1CCCO1 MCULE-5402066981 [0,0,0,0,0,0|1,0,1]=2 71 B8R1.7 C[C@H](O)C1CCOC1 MCULE-9092941508 [0,0,0,0,0,0|3,0,1]=4 72 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5014228849 [0,0,0,0,0,0|2,0,1]=3 73 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5063876687 [0,0,0,0,0,0|2,0,1]=3 74 B8R1.7 C[C@H](O)[C@@H]1CCCO1 MCULE-3917713920 [0,0,0,0,0,0|1,0,1]=2 75 B8R1.7 ClC(Cl)C1OCCO1 MCULE-4727598443 [0,0,0,0,0,0|3,0,1]=4 76 B8R1.7 FC(F)C1CCCN1 MCULE-2679624104 [0,0,0,0,0,0|3,0,1]=4 77 B8R1.7 FC(F)C1CCCN1 MCULE-6665318434 [0,0,0,0,0,0|3,0,1]=4 78 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-4550665710 [0,0,0,0,0,0|3,0,1]=4 79 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-5404733637 [0,0,0,0,0,0|3,0,1]=4 80 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-5465380229 [0,0,0,0,0,0|3,0,1]=4 81 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-6799321789 [0,0,0,0,0,0|3,0,1]=4 82 B8R1.7 FC(F)[C@H]1CCCN1 MCULE-5217394450 [0,0,0,0,0,0|3,0,1]=4 83 B8R1.7 FC(F)[C@H]1CCCN1 MCULE-9580378678 [0,0,0,0,0,0|3,0,1]=4 84 B8R1.7 N=C(N)C1CCCC1 MCULE-3526902612 [0,0,0,0,0,0|3,0,0]=3 85 B8R1.7 N=C(N)C1CCCC1 MCULE-7613986881 [0,0,0,0,0,0|3,0,0]=3 86 B8R1.7 N=C(N)C1CCCN1 MCULE-3357684433 [0,0,0,0,0,0|3,0,0]=3 87 B8R1.7 N=C(N)C1CCCN1 MCULE-7506606085 [0,0,0,0,0,0|3,0,0]=3 88 B8R1.7 N=C(N)C1CCCO1 MCULE-1348627071 [0,0,0,0,0,0|2,0,0]=2 89 B8R1.7 N=C(N)C1CCCO1 MCULE-4359589378 [0,0,0,0,0,0|2,0,0]=2 90 B8R1.7 N=C(N)C1CCOC1 MCULE-1442525298 [0,0,0,0,0,0|4,0,0]=4 91 B8R1.7 N=C(N)C1CCOC1 MCULE-2289256622 [0,0,0,0,0,0|4,0,0]=4 92 B8R1.7 N=C(N)C1CCOC1 MCULE-6644963466 [0,0,0,0,0,0|4,0,0]=4 93 B8R1.7 N=C(N)N1CCCC1 MCULE-1081237301 [0,0,0,0,0,0|4,0,0]=4 94 B8R1.7 N=C(N)N1CCCC1 MCULE-2310711826 [0,0,0,0,0,0|4,0,0]=4 95 B8R1.7 N=C(N)N1CCCC1 MCULE-5860683743 [0,0,0,0,0,0|4,0,0]=4 96 B8R1.7 N=C(N)N1CCCC1 MCULE-9334495491 [0,0,0,0,0,0|4,0,0]=4 97 B8R1.7 NC(=O)C1=NCCN1 MCULE-8784849906 [0,0,0,0,0,0|3,0,1]=4 98 B8R1.7 NC(=O)C1CC=CC1 MCULE-5556484257 [0,0,0,0,0,0|2,0,2]=4 99 B8R1.7 NC(=O)C1CCCC1 MCULE-3900666396 [0,0,0,0,0,0|2,0,0]=2 100 B8R1.7 NC(=O)C1CCCN1 MCULE-4159463416 [0,0,0,0,0,0|2,0,0]=2 101 B8R1.7 NC(=O)C1CCCN1 MCULE-4804910089 [0,0,0,0,0,0|2,0,0]=2 102 B8R1.7 NC(=O)C1CCCO1 MCULE-9101921416 [0,0,0,0,0,0|1,0,0]=1 103 B8R1.7 NC(=O)C1CCNC1 MCULE-6035608651 [0,0,0,0,0,0|3,0,0]=3 104 B8R1.7 NC(=O)C1CCNC1 MCULE-8602888952 [0,0,0,0,0,0|3,0,0]=3 105 B8R1.7 NC(=O)C1CCOC1 MCULE-7120435380 [0,0,0,0,0,0|3,0,0]=3 106 B8R1.7 NC(=O)C1CSCN1 MCULE-7557874523 [0,0,0,0,0,0|3,0,0]=3 107 B8R1.7 NC(=O)N1CCCC1 MCULE-2282948234 [0,0,0,0,0,0|3,0,0]=3 108 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-2894820708 [0,0,0,0,0,0|2,0,2]=4 109 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-3478764941 [0,0,0,0,0,0|2,0,2]=4 110 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-6696620969 [0,0,0,0,0,0|2,0,2]=4 111 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-7629009072 [0,0,0,0,0,0|2,0,2]=4 112 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2635874022 [0,0,0,0,0,0|2,0,0]=2 113 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2652734118 [0,0,0,0,0,0|2,0,0]=2 114 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-4692992308 [0,0,0,0,0,0|2,0,0]=2 115 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-6463625531 [0,0,0,0,0,0|2,0,0]=2 116 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-3181755658 [0,0,0,0,0,0|1,0,0]=1 117 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-9348376356 [0,0,0,0,0,0|1,0,0]=1 118 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1320057579 [0,0,0,0,0,0|3,0,0]=3 119 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1678228480 [0,0,0,0,0,0|3,0,0]=3 120 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-3340066069 [0,0,0,0,0,0|3,0,0]=3 121 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-8833406496 [0,0,0,0,0,0|3,0,0]=3 122 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-1391877694 [0,0,0,0,0,0|2,0,0]=2 123 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-2636422628 [0,0,0,0,0,0|2,0,0]=2 124 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-3135852117 [0,0,0,0,0,0|2,0,0]=2 125 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-9661392945 [0,0,0,0,0,0|2,0,0]=2 126 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-1673594093 [0,0,0,0,0,0|3,0,0]=3 127 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-6725123306 [0,0,0,0,0,0|3,0,0]=3 128 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-7222756259 [0,0,0,0,0,0|3,0,0]=3 129 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-8100234071 [0,0,0,0,0,0|3,0,0]=3 130 B8R1.7 NC(=O)[C@H]1CCOC1 MCULE-1231475693 [0,0,0,0,0,0|3,0,0]=3 131 B8R1.7 NC(=S)C1CCCC1 MCULE-8081902896 [0,0,0,0,0,0|2,1,0]=3 132 B8R1.7 NC(=S)C1CCCO1 MCULE-7906949480 [0,0,0,0,0,0|1,1,0]=2 133 B8R1.7 NC(=S)C1CCNC1 MCULE-4169836111 [0,0,0,0,0,0|3,1,0]=4 134 B8R1.7 NC(=S)C1CCOC1 MCULE-1942658620 [0,0,0,0,0,0|3,1,0]=4 135 B8R1.7 NC(=S)N1CCCC1 MCULE-1483517657 [0,0,0,0,0,0|3,1,0]=4 136 B8R1.7 O=C(Cl)C1CC=CC1 MCULE-8148758182 [0,0,0,0,0,0|2,0,2]=4 137 B8R1.7 O=C(Cl)C1CCCC1 MCULE-1337538941 [0,0,0,0,0,0|2,0,0]=2 138 B8R1.7 O=C(Cl)C1CCCO1 MCULE-9691919934 [0,0,0,0,0,0|1,0,0]=1 139 B8R1.7 O=C(Cl)C1CCOC1 MCULE-9071234830 [0,0,0,0,0,0|3,0,0]=3 140 B8R1.7 O=C(Cl)N1CCCC1 MCULE-2201729080 [0,0,0,0,0,0|3,0,0]=3 141 B8R1.7 O=C(O)C1=CC=CO1 MCULE-5132845727 [0,0,0,0,0,0|0,0,4]=4 142 B8R1.7 O=C(O)C1=CC=NO1 MCULE-4061809739 [0,0,0,0,0,0|1,0,3]=4 143 B8R1.7 O=C(O)C1=CCCC1 MCULE-2928571993 [0,0,0,0,0,0|1,0,1]=2 144 B8R1.7 O=C(O)C1=CCCO1 MCULE-8380391200 [0,0,0,0,0,0|0,0,2]=2 145 B8R1.7 O=C(O)C1=CCCS1 MCULE-9231409703 [0,0,0,0,0,0|0,1,2]=3 146 B8R1.7 O=C(O)C1=CCNC1 MCULE-2391284266 [0,0,0,0,0,0|2,0,1]=3 147 B8R1.7 O=C(O)C1=CCNC1 MCULE-5725335930 [0,0,0,0,0,0|2,0,1]=3 148 B8R1.7 O=C(O)C1=CCOC1 MCULE-3209603870 [0,0,0,0,0,0|2,0,1]=3 149 B8R1.7 O=C(O)C1=CCSC1 MCULE-3187835692 [0,0,0,0,0,0|2,0,1]=3 150 B8R1.7 O=C(O)C1=CN=CO1 MCULE-9125638838 [0,0,0,0,0,0|1,0,3]=4 151 B8R1.7 O=C(O)C1=COCC1 MCULE-7263072561 [0,0,0,0,0,0|2,0,1]=3 152 B8R1.7 O=C(O)C1=CSCS1 MCULE-2399429418 [0,0,0,0,0,0|1,1,2]=4 153 B8R1.7 O=C(O)C1=NC=CO1 MCULE-3527449990 [0,0,0,0,0,0|1,0,3]=4 154 B8R1.7 O=C(O)C1=NCCC1 MCULE-2664768755 [0,0,0,0,0,0|1,0,1]=2 155 B8R1.7 O=C(O)C1=NOCC1 MCULE-3126584315 [0,0,0,0,0,0|2,0,1]=3 156 B8R1.7 O=C(O)C1C=CCC1 MCULE-8870546284 [0,0,0,0,0,0|1,0,1]=2 157 B8R1.7 O=C(O)C1C=CCN1 MCULE-2141949922 [0,0,0,0,0,0|1,0,2]=3 158 B8R1.7 O=C(O)C1C=CCN1 MCULE-3068035697 [0,0,0,0,0,0|1,0,2]=3 159 B8R1.7 O=C(O)C1C=CCN1 MCULE-4825351403 [0,0,0,0,0,0|1,0,2]=3 160 B8R1.7 O=C(O)C1C=CCN1 MCULE-9928071710 [0,0,0,0,0,0|1,0,2]=3 161 B8R1.7 O=C(O)C1C=CCO1 MCULE-7417068170 [0,0,0,0,0,0|0,0,2]=2 162 B8R1.7 O=C(O)C1CC=CC1 MCULE-7876630177 [0,0,0,0,0,0|1,0,2]=3 163 B8R1.7 O=C(O)C1CCC=N1 MCULE-1792151957 [0,0,0,0,0,0|1,0,1]=2 164 B8R1.7 O=C(O)C1CCCC1 MCULE-6415159340 [0,0,0,0,0,0|1,0,0]=1 165 B8R1.7 O=C(O)C1CCCN1 MCULE-2229401513 [0,0,0,0,0,0|1,0,0]=1 166 B8R1.7 O=C(O)C1CCCN1 MCULE-6305507014 [0,0,0,0,0,0|1,0,0]=1 167 B8R1.7 O=C(O)C1CCCN1 MCULE-8387491590 [0,0,0,0,0,0|1,0,0]=1 168 B8R1.7 O=C(O)C1CCCN1 MCULE-8611160929 [0,0,0,0,0,0|1,0,0]=1 169 B8R1.7 O=C(O)C1CCCO1 MCULE-1952289090 [0,0,0,0,0,0|0,0,0]=0 170 B8R1.7 O=C(O)C1CCCO1 MCULE-5387481824 [0,0,0,0,0,0|0,0,0]=0 171 B8R1.7 O=C(O)C1CCCS1 MCULE-7760686042 [0,0,0,0,0,0|0,1,0]=1 172 B8R1.7 O=C(O)C1CCNC1 MCULE-4976520029 [0,0,0,0,0,0|2,0,0]=2 173 B8R1.7 O=C(O)C1CCNC1 MCULE-5937045785 [0,0,0,0,0,0|2,0,0]=2 174 B8R1.7 O=C(O)C1CCNC1 MCULE-6983695276 [0,0,0,0,0,0|2,0,0]=2 175 B8R1.7 O=C(O)C1CCOC1 MCULE-3567941338 [0,0,0,0,0,0|2,0,0]=2 176 B8R1.7 O=C(O)C1CCSC1 MCULE-7898686734 [0,0,0,0,0,0|2,0,0]=2 177 B8R1.7 O=C(O)C1COCN1 MCULE-4997392610 [0,0,0,0,0,0|2,0,0]=2 178 B8R1.7 O=C(O)C1COCN1 MCULE-7001651226 [0,0,0,0,0,0|2,0,0]=2 179 B8R1.7 O=C(O)C1CSCN1 MCULE-2391637686 [0,0,0,0,0,0|2,0,0]=2 180 B8R1.7 O=C(O)C1CSCN1 MCULE-9622331370 [0,0,0,0,0,0|2,0,0]=2 181 B8R1.7 O=C(O)C1CSSC1 MCULE-8231952386 [0,0,0,0,0,0|3,0,0]=3 182 B8R1.7 O=C(O)C1NCCS1 MCULE-2504435743 [0,0,0,0,0,0|1,1,0]=2 183 B8R1.7 O=C(O)C1SCCS1 MCULE-4466563646 [0,0,0,0,0,0|1,1,0]=2 184 B8R1.7 O=C(O)N1CCCC1 MCULE-7984061130 [0,0,0,0,0,0|2,0,0]=2 185 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-2515045579 [0,0,0,0,0,0|1,0,2]=3 186 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-3589058117 [0,0,0,0,0,0|1,0,2]=3 187 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-7995918745 [0,0,0,0,0,0|1,0,2]=3 188 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-8155212892 [0,0,0,0,0,0|1,0,2]=3 189 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-1020921088 [0,0,0,0,0,0|1,0,0]=1 190 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6398060480 [0,0,0,0,0,0|1,0,0]=1 191 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6772131264 [0,0,0,0,0,0|1,0,0]=1 192 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-8415049837 [0,0,0,0,0,0|1,0,0]=1 193 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-5193388500 [0,0,0,0,0,0|0,0,0]=0 194 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-8181760406 [0,0,0,0,0,0|0,0,0]=0 195 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-3068007507 [0,0,0,0,0,0|2,0,0]=2 196 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4477578687 [0,0,0,0,0,0|2,0,0]=2 197 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4524201006 [0,0,0,0,0,0|2,0,0]=2 198 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4868292658 [0,0,0,0,0,0|2,0,0]=2 199 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-4807765276 [0,0,0,0,0,0|2,0,0]=2 200 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-7912413581 [0,0,0,0,0,0|2,0,0]=2 201 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1547472283 [0,0,0,0,0,0|2,0,0]=2 202 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1876089066 [0,0,0,0,0,0|2,0,0]=2 203 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1926856350 [0,0,0,0,0,0|2,0,0]=2 204 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-9876695932 [0,0,0,0,0,0|2,0,0]=2 205 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-4243406881 [0,0,0,0,0,0|2,0,0]=2 206 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-6343154165 [0,0,0,0,0,0|2,0,0]=2 207 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-2145380755 [0,0,0,0,0,0|1,0,2]=3 208 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-5768283844 [0,0,0,0,0,0|1,0,2]=3 209 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-8522372891 [0,0,0,0,0,0|1,0,2]=3 210 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-5856142508 [0,0,0,0,0,0|1,0,0]=1 211 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-7748032436 [0,0,0,0,0,0|1,0,0]=1 212 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-2258024439 [0,0,0,0,0,0|0,0,0]=0 213 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-5143953192 [0,0,0,0,0,0|0,0,0]=0 214 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2003400674 [0,0,0,0,0,0|2,0,0]=2 215 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2851087395 [0,0,0,0,0,0|2,0,0]=2 216 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7223432888 [0,0,0,0,0,0|2,0,0]=2 217 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7610384670 [0,0,0,0,0,0|2,0,0]=2 218 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-3213766488 [0,0,0,0,0,0|2,0,0]=2 219 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-9627397250 [0,0,0,0,0,0|2,0,0]=2 220 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-6095527710 [0,0,0,0,0,0|2,0,0]=2 221 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-9117444908 [0,0,0,0,0,0|2,0,0]=2 222 B8R1.7 O=C([O-])C1CCC=N1 MCULE-3235635441 [0,0,0,0,0,0|1,0,2]=3 223 B8R1.7 O=C([O-])C1CCCN1 MCULE-9155494525 [0,0,0,0,0,0|1,0,1]=2 224 B8R1.7 O=C([O-])C1CSCN1 MCULE-9836043803 [0,0,0,0,0,0|2,0,1]=3 225 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-2694821396 [0,0,0,0,0,0|1,0,1]=2 226 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-8353601451 [0,0,0,0,0,0|1,0,1]=2 227 B8R1.7 O=N(=O)C1CCCC1 MCULE-6499665829 [0,0,0,0,0,0|2,0,1]=3 228 B8R1.7 O=S([O-])C1CCCC1 MCULE-4973639131 [0,0,0,0,0,0|2,0,1]=3 229 B8R1.7 O=S([O-])C1CCCC1 MCULE-9227389818 [0,0,0,0,0,0|2,0,1]=3 230 B8R1.7 O=S([O-])C1CCOC1 MCULE-2574399704 [0,0,0,0,0,0|3,0,1]=4 231 B8R1.7 O=S([O-])C1CCOC1 MCULE-8651987419 [0,0,0,0,0,0|3,0,1]=4 232 B8R1.7 OB(O)C1=CCCC1 MCULE-9719215712 [0,0,0,0,0,0|2,0,2]=4 233 B8R1.7 OB(O)C1=CCCO1 MCULE-7551054803 [0,0,0,0,0,0|1,0,3]=4 234 B8R1.7 OB(O)C1CCCC1 MCULE-7101191940 [0,0,0,0,0,0|2,0,1]=3 235 B8R1.7 OB(O)C1CCCN1 MCULE-5123578937 [0,0,0,0,0,0|2,0,1]=3 236 B8R1.7 OB(O)C1CCCN1 MCULE-6072524963 [0,0,0,0,0,0|2,0,1]=3 237 B8R1.7 OB(O)C1CCOC1 MCULE-6097210028 [0,0,0,0,0,0|3,0,1]=4 238 B8R1.7 S=C(S)N1CCCC1 MCULE-1085952223 [0,0,0,0,0,0|2,2,0]=4 239 B8R1.7 S=C([S-])N1CCCC1 MCULE-9299211770 [0,0,0,0,0,0|2,2,0]=4 240 B8R1.7 S=C([S-])N1CCCC1 MCULE-9637056918 [0,0,0,0,0,0|2,2,0]=4 241 B8R1.7 [C@@H]1(CSCN1)C(=O)[O-] MCULE-3895380806 [0,0,0,0,0,0|2,0,1]=3 242 B8R1.7 [NH2+]=C(N)N1CCCC1 MCULE-9887365479 [0,0,0,0,0,0|4,0,0]=4 243 B7R1.1 BrCC1CCCC1 MCULE-2472505847 [1,0,0,0,0,0|2,0,1]=4 244 B7R1.1 BrCC1CCCN1 MCULE-2152950124 [1,0,0,0,0,0|2,0,1]=4 245 B7R1.1 BrCC1CCCN1 MCULE-6083580584 [1,0,0,0,0,0|2,0,1]=4 246 B7R1.1 BrCC1CCCN1 MCULE-8116807965 [1,0,0,0,0,0|2,0,1]=4 247 B7R1.1 BrCC1CCCO1 MCULE-6801721633 [1,0,0,0,0,0|1,0,1]=3 248 B7R1.1 BrCC1OCCO1 MCULE-4843503125 [1,0,0,0,0,0|2,0,1]=4 249 B7R1.1 BrC[C@@H]1CCCN1 MCULE-2609238545 [1,0,0,0,0,0|2,0,1]=4 250 B7R1.1 BrC[C@@H]1CCCN1 MCULE-4300877722 [1,0,0,0,0,0|2,0,1]=4 251 B7R1.1 BrC[C@@H]1CCCN1 MCULE-7501559292 [1,0,0,0,0,0|2,0,1]=4 252 B7R1.1 BrC[C@@H]1CCCN1 MCULE-9528927495 [1,0,0,0,0,0|2,0,1]=4 253 B7R1.1 BrC[C@H]1CCCO1 MCULE-3468061610 [1,0,0,0,0,0|1,0,1]=3 254 B7R1.1 BrC[C@H]1CCCO1 MCULE-9305844681 [1,0,0,0,0,0|1,0,1]=3 255 B7R1.1 C#CC1CCCC1 MCULE-2058689962 [1,0,0,0,0,0|2,0,1]=4 256 B7R1.1 C#CC1CCCN1 MCULE-2312235714 [1,0,0,0,0,0|2,0,1]=4 257 B7R1.1 C#CC1CCCN1 MCULE-2368649911 [1,0,0,0,0,0|2,0,1]=4 258 B7R1.1 C#CC1CCCO1 MCULE-5501627253 [1,0,0,0,0,0|1,0,1]=3 259 B7R1.1 C#C[C@@H]1CCCN1 MCULE-1635908608 [1,0,0,0,0,0|2,0,1]=4 260 B7R1.1 C#C[C@@H]1CCCN1 MCULE-4766446168 [1,0,0,0,0,0|2,0,1]=4 261 B7R1.1 C#C[C@@H]1CCCN1 MCULE-7265052825 [1,0,0,0,0,0|2,0,1]=4 262 B7R1.1 C#C[C@@H]1CCCN1 MCULE-8496158135 [1,0,0,0,0,0|2,0,1]=4 263 B7R1.1 C#C[C@H]1CCCN1 MCULE-1874586489 [1,0,0,0,0,0|2,0,1]=4 264 B7R1.1 C#C[C@H]1CCCN1 MCULE-8338634355 [1,0,0,0,0,0|2,0,1]=4 265 B7R1.1 C1(CCCN1)CF MCULE-2705678622 [1,0,0,0,0,0|2,0,1]=4 266 B7R1.1 C1(CCCN1)CF MCULE-3175080744 [1,0,0,0,0,0|2,0,1]=4 267 B7R1.1 C1(CCCN1)CN MCULE-3568349121 [1,0,0,0,0,0|2,0,1]=4 268 B7R1.1 C1(CCCN1)CN MCULE-9944820727 [1,0,0,0,0,0|2,0,1]=4 269 B7R1.1 C1(CCCN1)CO MCULE-7277085817 [1,0,0,0,0,0|1,0,1]=3 270 B7R1.1 C1(CCNC1)CO MCULE-7897000858 [1,0,0,0,0,0|2,0,1]=4 271 B7R1.1 C1(CCNC1)CO MCULE-9939548436 [1,0,0,0,0,0|2,0,1]=4 272 B7R1.1 C1(CCOC1)CO MCULE-2350780678 [1,0,0,0,0,0|2,0,1]=4 273 B7R1.1 C=CC1CCCC1 MCULE-6144532155 [1,0,0,0,0,0|2,0,0]=3 274 B7R1.1 C=CC1CCCN1 MCULE-5736974496 [1,0,0,0,0,0|2,0,0]=3 275 B7R1.1 C=CC1CCCN1 MCULE-7626074228 [1,0,0,0,0,0|2,0,0]=3 276 B7R1.1 C=CC1CCNC1 MCULE-7703785367 [1,0,0,0,0,0|3,0,0]=4 277 B7R1.1 CC=C1CCCC1 MCULE-9763131004 [1,0,0,0,0,0|2,0,1]=4 278 B7R1.1 CCC1CCCC1 MCULE-1974854934 [1,0,0,0,0,0|2,0,1]=4 279 B7R1.1 CCC1CCCN1 MCULE-1775351089 [1,0,0,0,0,0|2,0,1]=4 280 B7R1.1 CCC1CCCN1 MCULE-2065682250 [1,0,0,0,0,0|2,0,1]=4 281 B7R1.1 CCC1CCCN1 MCULE-8326168982 [1,0,0,0,0,0|2,0,1]=4 282 B7R1.1 CCC1CCCN1 MCULE-9831560442 [1,0,0,0,0,0|2,0,1]=4 283 B7R1.1 CCC1OCCO1 MCULE-3434568584 [1,0,0,0,0,0|2,0,1]=4 284 B7R1.1 CC[C@@H]1CCCN1 MCULE-1829706908 [1,0,0,0,0,0|2,0,1]=4 285 B7R1.1 CC[C@@H]1CCCN1 MCULE-6310895621 [1,0,0,0,0,0|2,0,1]=4 286 B7R1.1 CC[C@@H]1CCCN1 MCULE-6770634475 [1,0,0,0,0,0|2,0,1]=4 287 B7R1.1 CC[C@@H]1CCCN1 MCULE-9259891597 [1,0,0,0,0,0|2,0,1]=4 288 B7R1.1 CC[C@H]1CCCN1 MCULE-2347458277 [1,0,0,0,0,0|2,0,1]=4 289 B7R1.1 CC[C@H]1CCCN1 MCULE-3796565634 [1,0,0,0,0,0|2,0,1]=4 290 B7R1.1 CC[C@H]1CCCN1 MCULE-6193768639 [1,0,0,0,0,0|2,0,1]=4 291 B7R1.1 CC[C@H]1CCCN1 MCULE-9679619003 [1,0,0,0,0,0|2,0,1]=4 292 B7R1.1 CNC1CCCC1 MCULE-1391832163 [1,0,0,0,0,0|3,0,0]=4 293 B7R1.1 CNC1CCCC1 MCULE-8242451793 [1,0,0,0,0,0|3,0,0]=4 294 B7R1.1 COC1CCCC1 MCULE-7539347010 [1,0,0,0,0,0|3,0,0]=4 295 B7R1.1 COC1CCCO1 MCULE-8363423240 [1,0,0,0,0,0|2,0,0]=3 296 B7R1.1 COC1OCCO1 MCULE-9935127218 [1,0,0,0,0,0|3,0,0]=4 297 B7R1.1 ClCC1CCCC1 MCULE-7652893931 [1,0,0,0,0,0|2,0,1]=4 298 B7R1.1 ClCC1CCCN1 MCULE-3656101962 [1,0,0,0,0,0|2,0,1]=4 299 B7R1.1 ClCC1CCCN1 MCULE-9792407426 [1,0,0,0,0,0|2,0,1]=4 300 B7R1.1 ClCC1CCCO1 MCULE-9816764842 [1,0,0,0,0,0|1,0,1]=3 301 B7R1.1 ClCC1OCCO1 MCULE-2722734837 [1,0,0,0,0,0|2,0,1]=4 302 B7R1.1 ClC[C@@H]1CCCN1 MCULE-1712418178 [1,0,0,0,0,0|2,0,1]=4 303 B7R1.1 ClC[C@@H]1CCCN1 MCULE-2092217865 [1,0,0,0,0,0|2,0,1]=4 304 B7R1.1 ClC[C@@H]1CCCN1 MCULE-4473753787 [1,0,0,0,0,0|2,0,1]=4 305 B7R1.1 ClC[C@@H]1CCCN1 MCULE-9545872560 [1,0,0,0,0,0|2,0,1]=4 306 B7R1.1 ClC[C@H]1CCCN1 MCULE-1186865731 [1,0,0,0,0,0|2,0,1]=4 307 B7R1.1 ClC[C@H]1CCCN1 MCULE-3107383611 [1,0,0,0,0,0|2,0,1]=4 308 B7R1.1 FCC1CCCN1 MCULE-3216030316 [1,0,0,0,0,0|2,0,1]=4 309 B7R1.1 FCC1CCCN1 MCULE-4540803550 [1,0,0,0,0,0|2,0,1]=4 310 B7R1.1 FC[C@@H]1CCCN1 MCULE-2463314208 [1,0,0,0,0,0|2,0,1]=4 311 B7R1.1 FC[C@@H]1CCCN1 MCULE-3740139569 [1,0,0,0,0,0|2,0,1]=4 312 B7R1.1 FC[C@@H]1CCCN1 MCULE-6899304468 [1,0,0,0,0,0|2,0,1]=4 313 B7R1.1 FC[C@@H]1CCCN1 MCULE-9916936373 [1,0,0,0,0,0|2,0,1]=4 314 B7R1.1 FC[C@H]1CCCN1 MCULE-1380365453 [1,0,0,0,0,0|2,0,1]=4 315 B7R1.1 FC[C@H]1CCCN1 MCULE-1512160666 [1,0,0,0,0,0|2,0,1]=4 316 B7R1.1 FC[C@H]1CCCN1 MCULE-2904385734 [1,0,0,0,0,0|2,0,1]=4 317 B7R1.1 FC[C@H]1CCCN1 MCULE-9837641384 [1,0,0,0,0,0|2,0,1]=4 318 B7R1.1 ICC1CCCC1 MCULE-5940886897 [1,0,0,0,0,0|2,0,1]=4 319 B7R1.1 ICC1CCCN1 MCULE-3467617934 [1,0,0,0,0,0|2,0,1]=4 320 B7R1.1 ICC1CCCN1 MCULE-7784862806 [1,0,0,0,0,0|2,0,1]=4 321 B7R1.1 ICC1CCCO1 MCULE-3981288245 [1,0,0,0,0,0|1,0,1]=3 322 B7R1.1 IC[C@@H]1CCCN1 MCULE-4843756038 [1,0,0,0,0,0|2,0,1]=4 323 B7R1.1 IC[C@@H]1CCCN1 MCULE-8213667136 [1,0,0,0,0,0|2,0,1]=4 324 B7R1.1 N#CC1CCCC1 MCULE-1484517612 [1,0,0,0,0,0|2,0,1]=4 325 B7R1.1 N#CC1CCCN1 MCULE-1423410021 [1,0,0,0,0,0|2,0,1]=4 326 B7R1.1 N#CC1CCCN1 MCULE-2656253866 [1,0,0,0,0,0|2,0,1]=4 327 B7R1.1 N#CC1CCCN1 MCULE-4406196575 [1,0,0,0,0,0|2,0,1]=4 328 B7R1.1 N#CC1CCCN1 MCULE-7456938108 [1,0,0,0,0,0|2,0,1]=4 329 B7R1.1 N#CC1CCCN1 MCULE-7786777677 [1,0,0,0,0,0|2,0,1]=4 330 B7R1.1 N#CC1CCCN1 MCULE-9566371551 [1,0,0,0,0,0|2,0,1]=4 331 B7R1.1 N#CC1CCCO1 MCULE-6657753631 [1,0,0,0,0,0|1,0,1]=3 332 B7R1.1 N#CC1CCCS1 MCULE-6372148360 [1,0,0,0,0,0|1,1,1]=4 333 B7R1.1 N#C[C@@H]1CCCN1 MCULE-4099952481 [1,0,0,0,0,0|2,0,1]=4 334 B7R1.1 N#C[C@@H]1CCCN1 MCULE-4644423856 [1,0,0,0,0,0|2,0,1]=4 335 B7R1.1 N#C[C@@H]1CCCN1 MCULE-5675394665 [1,0,0,0,0,0|2,0,1]=4 336 B7R1.1 N#C[C@@H]1CCCN1 MCULE-5881469353 [1,0,0,0,0,0|2,0,1]=4 337 B7R1.1 N#C[C@@H]1CCCN1 MCULE-8875516240 [1,0,0,0,0,0|2,0,1]=4 338 B7R1.1 N#C[C@@H]1CCCN1 MCULE-9993553976 [1,0,0,0,0,0|2,0,1]=4 339 B7R1.1 N#C[C@H]1CCCN1 MCULE-4472756314 [1,0,0,0,0,0|2,0,1]=4 340 B7R1.1 N#C[C@H]1CCCN1 MCULE-6157392186 [1,0,0,0,0,0|2,0,1]=4 341 B7R1.1 N#C[C@H]1CCCN1 MCULE-6672062231 [1,0,0,0,0,0|2,0,1]=4 342 B7R1.1 N#C[C@H]1CCCN1 MCULE-7774660242 [1,0,0,0,0,0|2,0,1]=4 343 B7R1.1 N#C[C@H]1CCCN1 MCULE-7910694136 [1,0,0,0,0,0|2,0,1]=4 344 B7R1.1 N#C[C@H]1CCCN1 MCULE-8564583246 [1,0,0,0,0,0|2,0,1]=4 345 B7R1.1 NCC1CCCC1 MCULE-3629796849 [1,0,0,0,0,0|2,0,1]=4 346 B7R1.1 NCC1CCCC1 MCULE-8453900433 [1,0,0,0,0,0|2,0,1]=4 347 B7R1.1 NCC1CCCN1 MCULE-4764684364 [1,0,0,0,0,0|2,0,1]=4 348 B7R1.1 NCC1CCCN1 MCULE-8971980286 [1,0,0,0,0,0|2,0,1]=4 349 B7R1.1 NCC1CCCO1 MCULE-2797516262 [1,0,0,0,0,0|1,0,1]=3 350 B7R1.1 NCC1CCCO1 MCULE-5970677903 [1,0,0,0,0,0|1,0,1]=3 351 B7R1.1 NCC1CCCO1 MCULE-6166235034 [1,0,0,0,0,0|1,0,1]=3 352 B7R1.1 NCC1CCCS1 MCULE-5278325816 [1,0,0,0,0,0|1,1,1]=4 353 B7R1.1 NCC1COCO1 MCULE-1657884847 [1,0,0,0,0,0|2,0,1]=4 354 B7R1.1 NCC1COCO1 MCULE-9310217083 [1,0,0,0,0,0|2,0,1]=4 355 B7R1.1 NCC1OCCO1 MCULE-4813269641 [1,0,0,0,0,0|2,0,1]=4 356 B7R1.1 NC[C@@H]1CCCN1 MCULE-4726727563 [1,0,0,0,0,0|2,0,1]=4 357 B7R1.1 NC[C@@H]1CCCN1 MCULE-7513400460 [1,0,0,0,0,0|2,0,1]=4 358 B7R1.1 NC[C@@H]1CCCN1 MCULE-7622329174 [1,0,0,0,0,0|2,0,1]=4 359 B7R1.1 NC[C@@H]1CCCN1 MCULE-8573395464 [1,0,0,0,0,0|2,0,1]=4 360 B7R1.1 NC[C@@H]1CCCO1 MCULE-1103643839 [1,0,0,0,0,0|1,0,1]=3 361 B7R1.1 NC[C@@H]1CCCO1 MCULE-1402571993 [1,0,0,0,0,0|1,0,1]=3 362 B7R1.1 NC[C@@H]1CCCO1 MCULE-1448381041 [1,0,0,0,0,0|1,0,1]=3 363 B7R1.1 NC[C@@H]1CCCO1 MCULE-6664501749 [1,0,0,0,0,0|1,0,1]=3 364 B7R1.1 NC[C@H]1CCCN1 MCULE-2813912286 [1,0,0,0,0,0|2,0,1]=4 365 B7R1.1 NC[C@H]1CCCN1 MCULE-5505144820 [1,0,0,0,0,0|2,0,1]=4 366 B7R1.1 NC[C@H]1CCCN1 MCULE-7325312327 [1,0,0,0,0,0|2,0,1]=4 367 B7R1.1 NC[C@H]1CCCN1 MCULE-7708925831 [1,0,0,0,0,0|2,0,1]=4 368 B7R1.1 NC[C@H]1CCCO1 MCULE-1196018690 [1,0,0,0,0,0|1,0,1]=3 369 B7R1.1 NC[C@H]1CCCO1 MCULE-2037746017 [1,0,0,0,0,0|1,0,1]=3 370 B7R1.1 NC[C@H]1CCCO1 MCULE-3470426685 [1,0,0,0,0,0|1,0,1]=3 371 B7R1.1 NC[C@H]1CCCO1 MCULE-9918683284 [1,0,0,0,0,0|1,0,1]=3 372 B7R1.1 NNC1CCCC1 MCULE-1363058529 [1,0,0,0,0,0|3,0,0]=4 373 B7R1.1 NNC1CCCC1 MCULE-2803402819 [1,0,0,0,0,0|3,0,0]=4 374 B7R1.1 NNC1CCCC1 MCULE-5556380186 [1,0,0,0,0,0|3,0,0]=4 375 B7R1.1 NOC1CCCC1 MCULE-1504814106 [1,0,0,0,0,0|3,0,0]=4 376 B7R1.1 NOC1CCCC1 MCULE-1973418119 [1,0,0,0,0,0|3,0,0]=4 377 B7R1.1 O/N=C/1\CCCN1 MCULE-9494233692 [1,0,0,0,0,0|2,0,1]=4 378 B7R1.1 O=CC1=CCCC1 MCULE-2270030217 [1,0,0,0,0,0|1,0,1]=3 379 B7R1.1 O=CC1=CCCO1 MCULE-3464963164 [1,0,0,0,0,0|0,0,2]=3 380 B7R1.1 O=CC1=CCSC1 MCULE-9591036145 [1,0,0,0,0,0|2,0,1]=4 381 B7R1.1 O=CC1CC=CC1 MCULE-1563456893 [1,0,0,0,0,0|1,0,2]=4 382 B7R1.1 O=CC1CCCC1 MCULE-4938681495 [1,0,0,0,0,0|1,0,0]=2 383 B7R1.1 O=CC1CCCO1 MCULE-4587605451 [1,0,0,0,0,0|0,0,0]=1 384 B7R1.1 O=CC1CCNC1 MCULE-5188223111 [1,0,0,0,0,0|2,0,0]=3 385 B7R1.1 O=CC1CCOC1 MCULE-9515567606 [1,0,0,0,0,0|2,0,0]=3 386 B7R1.1 O=CC1CCSC1 MCULE-1282848613 [1,0,0,0,0,0|2,0,0]=3 387 B7R1.1 O=CN1CCCC1 MCULE-1922854302 [1,0,0,0,0,0|2,0,0]=3 388 B7R1.1 O=C[C@@H]1CCOC1 MCULE-5181257964 [1,0,0,0,0,0|2,0,0]=3 389 B7R1.1 O=C[C@H]1CCOC1 MCULE-4532427366 [1,0,0,0,0,0|2,0,0]=3 390 B7R1.1 O=NN1CCCC1 MCULE-8449068120 [1,0,0,0,0,0|3,0,0]=4 391 B7R1.1 OCC1=CCCC1 MCULE-8850570361 [1,0,0,0,0,0|1,0,2]=4 392 B7R1.1 OCC1=NCCO1 MCULE-9432593363 [1,0,0,0,0,0|1,0,2]=4 393 B7R1.1 OCC1C=CCC1 MCULE-1237002603 [1,0,0,0,0,0|1,0,2]=4 394 B7R1.1 OCC1CCCC1 MCULE-2985338933 [1,0,0,0,0,0|1,0,1]=3 395 B7R1.1 OCC1CCCN1 MCULE-1016922679 [1,0,0,0,0,0|1,0,1]=3 396 B7R1.1 OCC1CCCN1 MCULE-8224535891 [1,0,0,0,0,0|1,0,1]=3 397 B7R1.1 OCC1CCCO1 MCULE-5877114547 [1,0,0,0,0,0|0,0,1]=2 398 B7R1.1 OCC1CCCO1 MCULE-5884880244 [1,0,0,0,0,0|0,0,1]=2 399 B7R1.1 OCC1CCCS1 MCULE-6106081414 [1,0,0,0,0,0|0,1,1]=3 400 B7R1.1 OCC1CCNC1 MCULE-7883947611 [1,0,0,0,0,0|2,0,1]=4 401 B7R1.1 OCC1CCNC1 MCULE-9689521155 [1,0,0,0,0,0|2,0,1]=4 402 B7R1.1 OCC1CCOC1 MCULE-8926405046 [1,0,0,0,0,0|2,0,1]=4 403 B7R1.1 OCC1CCON1 MCULE-1199975481 [1,0,0,0,0,0|2,0,1]=4 404 B7R1.1 OCC1CCON1 MCULE-4772487016 [1,0,0,0,0,0|2,0,1]=4 405 B7R1.1 OCC1CCSC1 MCULE-2226132734 [1,0,0,0,0,0|2,0,1]=4 406 B7R1.1 OCC1COCO1 MCULE-3470022742 [1,0,0,0,0,0|1,0,1]=3 407 B7R1.1 OCC1OCCO1 MCULE-8334027179 [1,0,0,0,0,0|1,0,1]=3 408 B7R1.1 OC[C@@H]1CCCN1 MCULE-1791547752 [1,0,0,0,0,0|1,0,1]=3 409 B7R1.1 OC[C@@H]1CCCN1 MCULE-6448856585 [1,0,0,0,0,0|1,0,1]=3 410 B7R1.1 OC[C@@H]1CCCN1 MCULE-7214801659 [1,0,0,0,0,0|1,0,1]=3 411 B7R1.1 OC[C@@H]1CCCN1 MCULE-7248451975 [1,0,0,0,0,0|1,0,1]=3 412 B7R1.1 OC[C@@H]1CCCO1 MCULE-1788377708 [1,0,0,0,0,0|0,0,1]=2 413 B7R1.1 OC[C@@H]1CCCO1 MCULE-3533553137 [1,0,0,0,0,0|0,0,1]=2 414 B7R1.1 OC[C@@H]1CCNC1 MCULE-3126404140 [1,0,0,0,0,0|2,0,1]=4 415 B7R1.1 OC[C@@H]1CCNC1 MCULE-4876549629 [1,0,0,0,0,0|2,0,1]=4 416 B7R1.1 OC[C@@H]1CCNC1 MCULE-7050415145 [1,0,0,0,0,0|2,0,1]=4 417 B7R1.1 OC[C@@H]1CCNC1 MCULE-8785146407 [1,0,0,0,0,0|2,0,1]=4 418 B7R1.1 OC[C@@H]1CCOC1 MCULE-2004616524 [1,0,0,0,0,0|2,0,1]=4 419 B7R1.1 OC[C@@H]1CCOC1 MCULE-3801423698 [1,0,0,0,0,0|2,0,1]=4 420 B7R1.1 OC[C@H]1CCCN1 MCULE-1266532697 [1,0,0,0,0,0|1,0,1]=3 421 B7R1.1 OC[C@H]1CCCN1 MCULE-1724166794 [1,0,0,0,0,0|1,0,1]=3 422 B7R1.1 OC[C@H]1CCCN1 MCULE-7513431964 [1,0,0,0,0,0|1,0,1]=3 423 B7R1.1 OC[C@H]1CCCN1 MCULE-8398083695 [1,0,0,0,0,0|1,0,1]=3 424 B7R1.1 OC[C@H]1CCCO1 MCULE-3501680239 [1,0,0,0,0,0|0,0,1]=2 425 B7R1.1 OC[C@H]1CCCO1 MCULE-4925106568 [1,0,0,0,0,0|0,0,1]=2 426 B7R1.1 OC[C@H]1CCNC1 MCULE-3909770597 [1,0,0,0,0,0|2,0,1]=4 427 B7R1.1 OC[C@H]1CCNC1 MCULE-5006682123 [1,0,0,0,0,0|2,0,1]=4 428 B7R1.1 OC[C@H]1CCNC1 MCULE-8265382423 [1,0,0,0,0,0|2,0,1]=4 429 B7R1.1 OC[C@H]1CCNC1 MCULE-8371969680 [1,0,0,0,0,0|2,0,1]=4 430 B7R1.1 OC[C@H]1CCOC1 MCULE-4226412289 [1,0,0,0,0,0|2,0,1]=4 431 B7R1.1 OC[C@H]1CCOC1 MCULE-9076004118 [1,0,0,0,0,0|2,0,1]=4 432 B7R1.1 ON=C1CCCC1 MCULE-9338449832 [1,0,0,0,0,0|2,0,1]=4 433 B7R1.1 ONC1CCCC1 MCULE-1143510043 [1,0,0,0,0,0|2,0,0]=3 434 B7R1.1 ONC1CCCC1 MCULE-7548854169 [1,0,0,0,0,0|2,0,0]=3 435 B7R1.1 SCC1CCCC1 MCULE-7973872166 [1,0,0,0,0,0|1,1,1]=4 436 B7R1.1 SCC1CCCO1 MCULE-5962232488 [1,0,0,0,0,0|0,1,1]=3 437 B9R1.11 C#CC(=O)N1CCCC1 MCULE-1552230131 [0,1,0,0,0,0|3,0,0]=4 438 B9R1.11 C#CC(N)C1CCCO1 MCULE-8411524832 [0,1,0,0,0,0|2,0,1]=4 439 B9R1.11 C#CC(O)C1CCCC1 MCULE-2991189926 [0,1,0,0,0,0|2,0,1]=4 440 B9R1.11 C1(CCNC1)C(=O)OC MCULE-6356797990 [0,1,0,0,0,0|2,0,0]=3 441 B9R1.11 C1(CCNC1)C(=O)OC MCULE-7101201723 [0,1,0,0,0,0|2,0,0]=3 442 B9R1.11 C1(CCNC1)C(=O)OC MCULE-8951983412 [0,1,0,0,0,0|2,0,0]=3 443 B9R1.11 C1(CCOC1)C(=O)OC MCULE-6831054690 [0,1,0,0,0,0|2,0,0]=3 444 B9R1.11 C=CC(=O)N1CCCC1 MCULE-9314569500 [0,1,0,0,0,0|3,0,0]=4 445 B9R1.11 C=CC(O)C1CCCC1 MCULE-8096299119 [0,1,0,0,0,0|2,0,1]=4 446 B9R1.11 CC(C#N)C1CCCO1 MCULE-5098650494 [0,1,0,0,0,0|2,0,1]=4 447 B9R1.11 CCC(=O)C1=NCCC1 MCULE-4283707985 [0,1,0,0,0,0|2,0,1]=4 448 B9R1.11 CCC(=O)C1CCCC1 MCULE-4431631098 [0,1,0,0,0,0|2,0,0]=3 449 B9R1.11 CCC(=O)C1CCOC1 MCULE-1322014645 [0,1,0,0,0,0|3,0,0]=4 450 B9R1.11 CCC(=O)[C@@H]1CCCN1 MCULE-1661804964 [0,1,0,0,0,0|2,0,0]=3 451 B9R1.11 CCC(=O)[C@@H]1CCCN1 MCULE-8456135152 [0,1,0,0,0,0|2,0,0]=3 452 B9R1.11 CCC(N)C1CCCO1 MCULE-7946594021 [0,1,0,0,0,0|2,0,1]=4 453 B9R1.11 CNC(=O)C1CCCC1 MCULE-1170525718 [0,1,0,0,0,0|2,0,0]=3 454 B9R1.11 CNC(=O)C1CCCN1 MCULE-1783490658 [0,1,0,0,0,0|2,0,0]=3 455 B9R1.11 CNC(=O)C1CCCN1 MCULE-5014608316 [0,1,0,0,0,0|2,0,0]=3 456 B9R1.11 CNC(=O)C1CCNC1 MCULE-2945338804 [0,1,0,0,0,0|3,0,0]=4 457 B9R1.11 CNC(=O)C1CCNC1 MCULE-8215086073 [0,1,0,0,0,0|3,0,0]=4 458 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-3668444015 [0,1,0,0,0,0|2,0,0]=3 459 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-7344672390 [0,1,0,0,0,0|2,0,0]=3 460 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-7586915644 [0,1,0,0,0,0|2,0,0]=3 461 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-8093231474 [0,1,0,0,0,0|2,0,0]=3 462 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-9455499550 [0,1,0,0,0,0|2,0,0]=3 463 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-1131638831 [0,1,0,0,0,0|2,0,0]=3 464 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-4056775238 [0,1,0,0,0,0|2,0,0]=3 465 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-4223546600 [0,1,0,0,0,0|2,0,0]=3 466 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-6583071684 [0,1,0,0,0,0|2,0,0]=3 467 B9R1.11 COC(=N)C1CCCC1 MCULE-3923627958 [0,1,0,0,0,0|2,0,0]=3 468 B9R1.11 COC(=N)C1CCCC1 MCULE-5894752285 [0,1,0,0,0,0|2,0,0]=3 469 B9R1.11 COC(=O)C1=CCCC1 MCULE-3606282792 [0,1,0,0,0,0|1,0,1]=3 470 B9R1.11 COC(=O)C1=CCSC1 MCULE-2255227686 [0,1,0,0,0,0|2,0,1]=4 471 B9R1.11 COC(=O)C1=COCC1 MCULE-7180516511 [0,1,0,0,0,0|2,0,1]=4 472 B9R1.11 COC(=O)C1C=CCN1 MCULE-5230080312 [0,1,0,0,0,0|1,0,2]=4 473 B9R1.11 COC(=O)C1C=CCN1 MCULE-8144796741 [0,1,0,0,0,0|1,0,2]=4 474 B9R1.11 COC(=O)C1CC=CC1 MCULE-9983636796 [0,1,0,0,0,0|1,0,2]=4 475 B9R1.11 COC(=O)C1CCCC1 MCULE-6212031690 [0,1,0,0,0,0|1,0,0]=2 476 B9R1.11 COC(=O)C1CCCN1 MCULE-3132842932 [0,1,0,0,0,0|1,0,0]=2 477 B9R1.11 COC(=O)C1CCCN1 MCULE-5268897425 [0,1,0,0,0,0|1,0,0]=2 478 B9R1.11 COC(=O)C1CCCN1 MCULE-6168730709 [0,1,0,0,0,0|1,0,0]=2 479 B9R1.11 COC(=O)C1CCCN1 MCULE-8316785654 [0,1,0,0,0,0|1,0,0]=2 480 B9R1.11 COC(=O)C1CCCO1 MCULE-2538391455 [0,1,0,0,0,0|0,0,0]=1 481 B9R1.11 COC(=O)C1CCCS1 MCULE-8875125328 [0,1,0,0,0,0|0,1,0]=2 482 B9R1.11 COC(=O)C1CCNC1 MCULE-1630900792 [0,1,0,0,0,0|2,0,0]=3 483 B9R1.11 COC(=O)C1CCNC1 MCULE-5845908055 [0,1,0,0,0,0|2,0,0]=3 484 B9R1.11 COC(=O)C1CCNC1 MCULE-8849407954 [0,1,0,0,0,0|2,0,0]=3 485 B9R1.11 COC(=O)C1CCOC1 MCULE-8088199992 [0,1,0,0,0,0|2,0,0]=3 486 B9R1.11 COC(=O)C1CNC=N1 MCULE-8028237108 [0,1,0,0,0,0|2,0,1]=4 487 B9R1.11 COC(=O)C1CSCN1 MCULE-5351052142 [0,1,0,0,0,0|2,0,0]=3 488 B9R1.11 COC(=O)C1CSCN1 MCULE-9093296447 [0,1,0,0,0,0|2,0,0]=3 489 B9R1.11 COC(=O)C1NCCS1 MCULE-8142325663 [0,1,0,0,0,0|1,1,0]=3 490 B9R1.11 COC(=O)C1[NH2+]CCS1 MCULE-5863059145 [0,1,0,0,0,0|1,1,0]=3 491 B9R1.11 COC(=O)N1CCCC1 MCULE-1240116216 [0,1,0,0,0,0|2,0,0]=3 492 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-1869723316 [0,1,0,0,0,0|1,0,2]=4 493 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-5370163237 [0,1,0,0,0,0|1,0,2]=4 494 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-5818736163 [0,1,0,0,0,0|1,0,2]=4 495 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-7249261083 [0,1,0,0,0,0|1,0,2]=4 496 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-1981658590 [0,1,0,0,0,0|1,0,0]=2 497 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-6907716746 [0,1,0,0,0,0|1,0,0]=2 498 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-8031793722 [0,1,0,0,0,0|1,0,0]=2 499 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-9787777328 [0,1,0,0,0,0|1,0,0]=2 500 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-3233941315 [0,1,0,0,0,0|2,0,0]=3 501 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-4138957644 [0,1,0,0,0,0|2,0,0]=3 502 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-5401828810 [0,1,0,0,0,0|2,0,0]=3 503 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-6948701888 [0,1,0,0,0,0|2,0,0]=3 504 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-7639173642 [0,1,0,0,0,0|2,0,0]=3 505 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-9871868573 [0,1,0,0,0,0|2,0,0]=3 506 B9R1.11 COC(=O)[C@@H]1CCOC1 MCULE-2786445237 [0,1,0,0,0,0|2,0,0]=3 507 B9R1.11 COC(=O)[C@@H]1CCOC1 MCULE-6419806426 [0,1,0,0,0,0|2,0,0]=3 508 B9R1.11 COC(=O)[C@@H]1CSCN1 MCULE-5459284567 [0,1,0,0,0,0|2,0,0]=3 509 B9R1.11 COC(=O)[C@@H]1CSCN1 MCULE-6009801924 [0,1,0,0,0,0|2,0,0]=3 510 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-1925865650 [0,1,0,0,0,0|1,0,0]=2 511 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-3950222089 [0,1,0,0,0,0|1,0,0]=2 512 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-4251030243 [0,1,0,0,0,0|1,0,0]=2 513 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-8974101732 [0,1,0,0,0,0|1,0,0]=2 514 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-3002947292 [0,1,0,0,0,0|2,0,0]=3 515 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-4023088392 [0,1,0,0,0,0|2,0,0]=3 516 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-5206857621 [0,1,0,0,0,0|2,0,0]=3 517 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-7688050113 [0,1,0,0,0,0|2,0,0]=3 518 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-7976156203 [0,1,0,0,0,0|2,0,0]=3 519 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-9431553560 [0,1,0,0,0,0|2,0,0]=3 520 B9R1.11 COC(=O)[C@H]1CCOC1 MCULE-4215481469 [0,1,0,0,0,0|2,0,0]=3 521 B9R1.11 COC(=O)[C@H]1CCOC1 MCULE-9152113033 [0,1,0,0,0,0|2,0,0]=3 522 B9R1.11 N/C(=N/O)/N1CCCC1 MCULE-8007335584 [0,1,0,0,0,0|3,0,0]=4 523 B9R1.11 N/C(=N\O)/C1CCCC1 MCULE-6643830969 [0,1,0,0,0,0|2,0,0]=3 524 B9R1.11 N/C(=N\O)/C1CCCO1 MCULE-2644350923 [0,1,0,0,0,0|1,0,0]=2 525 B9R1.11 N/C(=N\O)/C1CCOC1 MCULE-1870162248 [0,1,0,0,0,0|3,0,0]=4 526 B9R1.11 NC(CO)C1CCCC1 MCULE-3542083676 [0,1,0,0,0,0|2,0,1]=4 527 B9R1.11 NC(CO)C1CCCC1 MCULE-5931245443 [0,1,0,0,0,0|2,0,1]=4 528 B9R1.11 NC(CO)C1CCCO1 MCULE-1115414738 [0,1,0,0,0,0|1,0,1]=3 529 B9R1.11 NCC(=O)C1CCCC1 MCULE-2498486150 [0,1,0,0,0,0|2,0,0]=3 530 B9R1.11 NCC(=O)C1CCCC1 MCULE-5406973286 [0,1,0,0,0,0|2,0,0]=3 531 B9R1.11 NCC(=O)N1CCCC1 MCULE-3024051267 [0,1,0,0,0,0|3,0,0]=4 532 B9R1.11 NCC(=O)N1CCCC1 MCULE-5492264097 [0,1,0,0,0,0|3,0,0]=4 533 B9R1.11 NCC(=O)N1CCCC1 MCULE-9879098395 [0,1,0,0,0,0|3,0,0]=4 534 B9R1.11 NCC(=O)N1CCCO1 MCULE-2938129141 [0,1,0,0,0,0|2,0,0]=3 535 B9R1.11 NCC(=O)N1CCCO1 MCULE-4442085417 [0,1,0,0,0,0|2,0,0]=3 536 B9R1.11 NCC(O)C1CCCC1 MCULE-1826088467 [0,1,0,0,0,0|2,0,1]=4 537 B9R1.11 NCC(O)C1CCCC1 MCULE-5186127631 [0,1,0,0,0,0|2,0,1]=4 538 B9R1.11 NCC(O)C1CCCO1 MCULE-1674634827 [0,1,0,0,0,0|1,0,1]=3 539 B9R1.11 NNC(=O)C1CCCC1 MCULE-5436769120 [0,1,0,0,0,0|2,0,0]=3 540 B9R1.11 NNC(=O)C1CCCO1 MCULE-7320789673 [0,1,0,0,0,0|1,0,0]=2 541 B9R1.11 NNC(=O)C1CCCO1 MCULE-9371435722 [0,1,0,0,0,0|1,0,0]=2 542 B9R1.11 NNC(=O)C1CCCS1 MCULE-3948986935 [0,1,0,0,0,0|1,1,0]=3 543 B9R1.11 NNC(=O)C1CCOC1 MCULE-1616364111 [0,1,0,0,0,0|3,0,0]=4 544 B9R1.11 NNC(=O)[C@@H]1CCCO1 MCULE-4678621422 [0,1,0,0,0,0|1,0,0]=2 545 B9R1.11 NNC(=O)[C@H]1CCCO1 MCULE-2795201954 [0,1,0,0,0,0|1,0,0]=2 546 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-1672080667 [0,1,0,0,0,0|2,0,1]=4 547 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-2468572391 [0,1,0,0,0,0|2,0,1]=4 548 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-9200212417 [0,1,0,0,0,0|2,0,1]=4 549 B9R1.11 O=C(CBr)C1CCCC1 MCULE-4985111490 [0,1,0,0,0,0|2,0,0]=3 550 B9R1.11 O=C(CBr)C1CCCO1 MCULE-9978996372 [0,1,0,0,0,0|1,0,0]=2 551 B9R1.11 O=C(CBr)C1CCOC1 MCULE-6832037750 [0,1,0,0,0,0|3,0,0]=4 552 B9R1.11 O=C(CBr)N1CCCC1 MCULE-2041605022 [0,1,0,0,0,0|3,0,0]=4 553 B9R1.11 O=C(CCl)C1CCCC1 MCULE-7395779538 [0,1,0,0,0,0|2,0,0]=3 554 B9R1.11 O=C(CCl)C1CCCN1 MCULE-3650713124 [0,1,0,0,0,0|2,0,0]=3 555 B9R1.11 O=C(CCl)C1CCCO1 MCULE-4619044936 [0,1,0,0,0,0|1,0,0]=2 556 B9R1.11 O=C(CCl)N1CCCC1 MCULE-3675689386 [0,1,0,0,0,0|3,0,0]=4 557 B9R1.11 O=C(CO)N1CCCC1 MCULE-6227389604 [0,1,0,0,0,0|2,0,0]=3 558 B9R1.11 O=C(NO)C1=CCCC1 MCULE-3789818826 [0,1,0,0,0,0|1,0,1]=3 559 B9R1.11 O=C(NO)C1CCCC1 MCULE-3511706426 [0,1,0,0,0,0|1,0,0]=2 560 B9R1.19 CC(C)(O)C1CCCC1 MCULE-5080602177 [0,1,0,0,0,0|2,0,1]=4 561 B9R1.19 CC(C)(O)C1CCCN1 MCULE-3058549783 [0,1,0,0,0,0|2,0,1]=4 562 B9R1.19 CC(C)(O)C1CCCN1 MCULE-7282873348 [0,1,0,0,0,0|2,0,1]=4 563 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-2324069180 [0,1,0,0,0,0|2,0,1]=4 564 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-3595619735 [0,1,0,0,0,0|2,0,1]=4 565 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-3842553890 [0,1,0,0,0,0|2,0,1]=4 566 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-1082062321 [0,1,0,0,0,0|2,0,1]=4 567 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-5364741590 [0,1,0,0,0,0|2,0,1]=4 568 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-8737105400 [0,1,0,0,0,0|2,0,1]=4 569 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-9021200021 [0,1,0,0,0,0|2,0,1]=4 570 B9R1.19 CS(=N)(=O)C1CCCC1 MCULE-8190422965 [0,1,0,0,0,0|3,0,0]=4 571 B9R1.19 NS(=O)(=O)C1CCCC1 MCULE-9765667947 [0,1,0,0,0,0|2,0,1]=4 572 B9R1.19 O=P(O)(O)C1CCCN1 MCULE-1507527616 [0,1,0,0,0,0|2,0,0]=3 573 B9R1.19 O=P(O)(O)C1CCCN1 MCULE-9994872613 [0,1,0,0,0,0|2,0,0]=3 574 B9R1.19 O=S(=O)(Cl)C1CCCC1 MCULE-7841465275 [0,1,0,0,0,0|2,0,1]=4 575 B9R1.19 O=S(=O)(O)C1CCCC1 MCULE-7644931575 [0,1,0,0,0,0|2,0,0]=3 576 B9R1.19 O=S(=O)([O-])C1CCCC1 MCULE-4567108567 [0,1,0,0,0,0|2,0,1]=4 577 B9R1.35 C1(CCC(=O)C1)C(=O)O MCULE-7485965564 [0,1,0,0,0,0|1,0,1]=3 578 B9R1.35 C1(CCC(=O)O1)C(=O)O MCULE-6663255579 [0,1,0,0,0,0|0,0,1]=2 579 B9R1.35 C1(CCN(C1)C(=O)C)O MCULE-2995435877 [0,1,0,0,0,0|3,0,0]=4 580 B9R1.35 C1(CCN(C1)C)C(=O)O MCULE-6561840637 [0,1,0,0,0,0|2,0,0]=3 581 B9R1.35 C1(CCN(C1)C)C(=O)O MCULE-7766846765 [0,1,0,0,0,0|2,0,0]=3 582 B9R1.35 C=C1CCC(C1)C(=O)O MCULE-7982355069 [0,1,0,0,0,0|1,0,1]=3 583 B9R1.35 CC(=O)C1CCC(=O)O1 MCULE-5049805875 [0,1,0,0,0,0|1,0,1]=3 584 B9R1.35 CC(=O)C1CCN(C1)C MCULE-4293303594 [0,1,0,0,0,0|3,0,0]=4 585 B9R1.35 CC(=O)N1CCC(C1)Br MCULE-8355936501 [0,1,0,0,0,0|3,0,0]=4 586 B9R1.35 CC(=O)N1CCC(C1)Cl MCULE-6832350132 [0,1,0,0,0,0|3,0,0]=4 587 B9R1.35 CC(=O)N1CCC(C1)I MCULE-8317311112 [0,1,0,0,0,0|3,0,0]=4 588 B9R1.35 CC(=O)N1CCC(C1)N MCULE-4859899694 [0,1,0,0,0,0|3,0,0]=4 589 B9R1.35 CC(=O)N1CCC(C1)N MCULE-5207016672 [0,1,0,0,0,0|3,0,0]=4 590 B9R1.35 CC(=O)N1CCC(C1)O MCULE-4508537142 [0,1,0,0,0,0|3,0,0]=4 591 B9R1.35 CC(=O)N1CC[C@@H](C1)Br MCULE-1322966275 [0,1,0,0,0,0|3,0,0]=4 592 B9R1.35 CC(=O)N1CC[C@@H](C1)Cl MCULE-2029967624 [0,1,0,0,0,0|3,0,0]=4 593 B9R1.35 CC(=O)N1CC[C@@H](C1)I MCULE-7320383470 [0,1,0,0,0,0|3,0,0]=4 594 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-2398948421 [0,1,0,0,0,0|3,0,0]=4 595 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-5902852942 [0,1,0,0,0,0|3,0,0]=4 596 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-7792031754 [0,1,0,0,0,0|3,0,0]=4 597 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-9501815600 [0,1,0,0,0,0|3,0,0]=4 598 B9R1.35 CC(=O)N1CC[C@@H](C1)O MCULE-4145127323 [0,1,0,0,0,0|3,0,0]=4 599 B9R1.35 CC(=O)N1CC[C@@H](C1)O MCULE-8205833952 [0,1,0,0,0,0|3,0,0]=4 600 B9R1.35 CC(=O)N1CC[C@H](C1)Br MCULE-4315476515 [0,1,0,0,0,0|3,0,0]=4 601 B9R1.35 CC(=O)N1CC[C@H](C1)Cl MCULE-4172580306 [0,1,0,0,0,0|3,0,0]=4 602 B9R1.35 CC(=O)N1CC[C@H](C1)I MCULE-1825691667 [0,1,0,0,0,0|3,0,0]=4 603 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-2775875761 [0,1,0,0,0,0|3,0,0]=4 604 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-3800389790 [0,1,0,0,0,0|3,0,0]=4 605 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-5934390450 [0,1,0,0,0,0|3,0,0]=4 606 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-6629805054 [0,1,0,0,0,0|3,0,0]=4 607 B9R1.35 CC(=O)N1CC[C@H](C1)O MCULE-1031340554 [0,1,0,0,0,0|3,0,0]=4 608 B9R1.35 CC(=O)N1CC[C@H](C1)O MCULE-1348897751 [0,1,0,0,0,0|3,0,0]=4 609 B9R1.35 CC1=CC(SC1)C(=O)O MCULE-1599288333 [0,1,0,0,0,0|0,1,2]=4 610 B9R1.35 CC1=NC(CC1)C(=O)O MCULE-1278773172 [0,1,0,0,0,0|1,0,1]=3 611 B9R1.35 CC1=NC(CC1)C(=O)O MCULE-5768248357 [0,1,0,0,0,0|1,0,1]=3 612 B9R1.35 CC1=NC(CS1)C(=O)O MCULE-2658936955 [0,1,0,0,0,0|2,0,1]=4 613 B9R1.35 CC1=NOC(C1)C(=O)O MCULE-4730152545 [0,1,0,0,0,0|1,0,1]=3 614 B9R1.35 CC1=NO[C@@H](C1)C(=O)O MCULE-4081165004 [0,1,0,0,0,0|1,0,1]=3 615 B9R1.35 CC1CC(=NO1)C(=O)O MCULE-8733803647 [0,1,0,0,0,0|2,0,1]=4 616 B9R1.35 CC1CC(CO1)C(=O)O MCULE-6422706201 [0,1,0,0,0,0|2,0,0]=3 617 B9R1.35 CC1CCC(C1)C(=O)O MCULE-5009837194 [0,1,0,0,0,0|1,0,0]=2 618 B9R1.35 CC1CCC(N1)C(=O)O MCULE-7716142893 [0,1,0,0,0,0|1,0,0]=2 619 B9R1.35 CC1CCC(N1)C(=O)O MCULE-7805688291 [0,1,0,0,0,0|1,0,0]=2 620 B9R1.35 CC1CCC(O1)C(=O)O MCULE-7354058760 [0,1,0,0,0,0|0,0,0]=1 621 B9R1.35 CC1CCN(C1)C(=O)Cl MCULE-4918001156 [0,1,0,0,0,0|3,0,0]=4 622 B9R1.35 CC1CNC(C1)C(=O)O MCULE-5999128275 [0,1,0,0,0,0|1,0,0]=2 623 B9R1.35 CC1CNC(C1)C(=O)O MCULE-9035040660 [0,1,0,0,0,0|1,0,0]=2 624 B9R1.35 CC1COC(C1)C(=O)O MCULE-4317519603 [0,1,0,0,0,0|0,0,0]=1 625 B9R1.35 CC1NC(CS1)C(=O)O MCULE-3100233154 [0,1,0,0,0,0|2,0,0]=3 626 B9R1.35 CC1N[C@H](CS1)C(=O)O MCULE-6392464999 [0,1,0,0,0,0|2,0,0]=3 627 B9R1.35 CN1C=NC(C1)C(=O)O MCULE-4940976118 [0,1,0,0,0,0|2,0,1]=4 628 B9R1.35 CN1C=NC(C1)C(=O)O MCULE-8264815969 [0,1,0,0,0,0|2,0,1]=4 629 B9R1.35 CN1CCC(C1)C(=O)O MCULE-5724245212 [0,1,0,0,0,0|2,0,0]=3 630 B9R1.35 CN1CCC(C1)C(=O)O MCULE-6263233064 [0,1,0,0,0,0|2,0,0]=3 631 B9R1.35 CN1CC[C@@H](C1)C(=O)O MCULE-1382244459 [0,1,0,0,0,0|2,0,0]=3 632 B9R1.35 CN1CC[C@@H](C1)C(=O)O MCULE-1492032594 [0,1,0,0,0,0|2,0,0]=3 633 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-1080921095 [0,1,0,0,0,0|2,0,0]=3 634 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-5145674459 [0,1,0,0,0,0|2,0,0]=3 635 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-5820812779 [0,1,0,0,0,0|2,0,0]=3 636 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-7587726735 [0,1,0,0,0,0|2,0,0]=3 637 B9R1.35 CS(=O)C1CCC(C1)N MCULE-2472662986 [0,1,0,0,0,0|3,0,0]=4 638 B9R1.35 C[C@@H]1CC[C@@H](N1)C(=O)O MCULE-1712610304 [0,1,0,0,0,0|1,0,0]=2 639 B9R1.35 C[C@@H]1CC[C@@H](N1)C(=O)O MCULE-3564743814 [0,1,0,0,0,0|1,0,0]=2 640 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O MCULE-2451266259 [0,1,0,0,0,0|0,0,0]=1 641 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O MCULE-9559412763 [0,1,0,0,0,0|0,0,0]=1 642 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-1486502980 [0,1,0,0,0,0|1,0,0]=2 643 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-2728269167 [0,1,0,0,0,0|1,0,0]=2 644 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-4518040079 [0,1,0,0,0,0|1,0,0]=2 645 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-5687588737 [0,1,0,0,0,0|1,0,0]=2 646 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-5969663507 [0,1,0,0,0,0|1,0,0]=2 647 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-7325534692 [0,1,0,0,0,0|1,0,0]=2 648 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1541572989 [0,1,0,0,0,0|1,0,0]=2 649 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1821254522 [0,1,0,0,0,0|1,0,0]=2 650 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7426280517 [0,1,0,0,0,0|1,0,0]=2 651 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8599307960 [0,1,0,0,0,0|1,0,0]=2 652 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-3116688346 [0,1,0,0,0,0|1,0,0]=2 653 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-3630959366 [0,1,0,0,0,0|1,0,0]=2 654 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-9043504063 [0,1,0,0,0,0|1,0,0]=2 655 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-9322368857 [0,1,0,0,0,0|1,0,0]=2 656 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-2036600768 [0,1,0,0,0,0|1,0,0]=2 657 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-4646350445 [0,1,0,0,0,0|1,0,0]=2 658 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-2974063836 [0,1,0,0,0,0|1,0,0]=2 659 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-7564386283 [0,1,0,0,0,0|1,0,0]=2 660 B9R1.35 NC(=O)C1CC(=NO1)Br MCULE-6809638884 [0,1,0,0,0,0|2,0,1]=4 661 B9R1.35 NC(=O)C1CC(CN1)F MCULE-8271084148 [0,1,0,0,0,0|2,0,0]=3 662 B9R1.35 NC(=O)C1CC(CN1)F MCULE-9864087367 [0,1,0,0,0,0|2,0,0]=3 663 B9R1.35 NC(=O)C1CC(CN1)O MCULE-8628888959 [0,1,0,0,0,0|2,0,0]=3 664 B9R1.35 NC(=O)C1CC(CN1)O MCULE-9327040437 [0,1,0,0,0,0|2,0,0]=3 665 B9R1.35 NC(=O)C1CCC(=O)N1 MCULE-1717146839 [0,1,0,0,0,0|2,0,1]=4 666 B9R1.35 NC(=O)N1CCC(C1)N MCULE-1767398338 [0,1,0,0,0,0|3,0,0]=4 667 B9R1.35 NC(=O)N1CCC(C1)N MCULE-2883297977 [0,1,0,0,0,0|3,0,0]=4 668 B9R1.35 NC(=O)[C@@H]1CCC(=O)N1 MCULE-5928054942 [0,1,0,0,0,0|2,0,1]=4 669 B9R1.35 NC(=O)[C@@H]1CCC(=O)N1 MCULE-8978218986 [0,1,0,0,0,0|2,0,1]=4 670 B9R1.35 NC(=O)[C@@H]1CC[C@@H](C1)N MCULE-7570889128 [0,1,0,0,0,0|2,0,0]=3 671 B9R1.35 NC(=O)[C@@H]1CC[C@@H](C1)N MCULE-8629602486 [0,1,0,0,0,0|2,0,0]=3 672 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-1115995515 [0,1,0,0,0,0|2,0,0]=3 673 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-3958905536 [0,1,0,0,0,0|2,0,0]=3 674 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-5421731805 [0,1,0,0,0,0|2,0,0]=3 675 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-9864372515 [0,1,0,0,0,0|2,0,0]=3 676 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-1506534259 [0,1,0,0,0,0|2,0,0]=3 677 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-4335155413 [0,1,0,0,0,0|2,0,0]=3 678 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)F MCULE-2111867079 [0,1,0,0,0,0|2,0,0]=3 679 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)F MCULE-2486268743 [0,1,0,0,0,0|2,0,0]=3 680 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)F MCULE-8625619596 [0,1,0,0,0,0|2,0,0]=3 681 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-1442980635 [0,1,0,0,0,0|2,0,0]=3 682 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-4854132547 [0,1,0,0,0,0|2,0,0]=3 683 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-8175631848 [0,1,0,0,0,0|2,0,0]=3 684 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-9092665787 [0,1,0,0,0,0|2,0,0]=3 685 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-1212665796 [0,1,0,0,0,0|2,0,0]=3 686 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2172080185 [0,1,0,0,0,0|2,0,0]=3 687 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2463066874 [0,1,0,0,0,0|2,0,0]=3 688 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-7245012102 [0,1,0,0,0,0|2,0,0]=3 689 B9R1.35 NC1=NC(CS1)C(=O)O MCULE-3669823666 [0,1,0,0,0,0|2,0,1]=4 690 B9R1.35 NC1=N[C@@H](CS1)C(=O)O MCULE-6192179870 [0,1,0,0,0,0|2,0,1]=4 691 B9R1.35 NC1=N[C@H](CS1)C(=O)O MCULE-7308504151 [0,1,0,0,0,0|2,0,1]=4 692 B9R1.35 NC1C=CC(C1)C(=O)O MCULE-7513224290 [0,1,0,0,0,0|1,0,1]=3 693 B9R1.35 NC1C=CC(C1)C(=O)O MCULE-8369262706 [0,1,0,0,0,0|1,0,1]=3 694 B9R1.35 NC1CC=C(C1)C(=O)O MCULE-7944190057 [0,1,0,0,0,0|1,0,1]=3 695 B9R1.35 NC1CC=C(C1)C(=O)O MCULE-9202589777 [0,1,0,0,0,0|1,0,1]=3 696 B9R1.35 NC1CCC(C1)C(=O)O MCULE-1740452568 [0,1,0,0,0,0|1,0,0]=2 697 B9R1.35 NC1CCC(C1)C(=O)O MCULE-4067702279 [0,1,0,0,0,0|1,0,0]=2 698 B9R1.35 NC1CNC(C1)C(=O)O MCULE-1416144501 [0,1,0,0,0,0|1,0,0]=2 699 B9R1.35 NC1CNC(C1)C(=O)O MCULE-4706388278 [0,1,0,0,0,0|1,0,0]=2 700 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-2058033578 [0,1,0,0,0,0|1,0,1]=3 701 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-3535904120 [0,1,0,0,0,0|1,0,1]=3 702 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-7864688668 [0,1,0,0,0,0|1,0,1]=3 703 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-9488093105 [0,1,0,0,0,0|1,0,1]=3 704 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-1729778339 [0,1,0,0,0,0|1,0,0]=2 705 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-2964730214 [0,1,0,0,0,0|1,0,0]=2 706 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-6758665117 [0,1,0,0,0,0|1,0,0]=2 707 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-8002401712 [0,1,0,0,0,0|1,0,0]=2 708 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-1941635524 [0,1,0,0,0,0|1,0,0]=2 709 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-3306995596 [0,1,0,0,0,0|1,0,0]=2 710 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-5728201062 [0,1,0,0,0,0|1,0,0]=2 711 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-8515718052 [0,1,0,0,0,0|1,0,0]=2 712 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-4990800122 [0,1,0,0,0,0|1,0,0]=2 713 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-5172267597 [0,1,0,0,0,0|1,0,0]=2 714 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7010431429 [0,1,0,0,0,0|1,0,0]=2 715 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8754522437 [0,1,0,0,0,0|1,0,0]=2 716 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-4906071490 [0,1,0,0,0,0|1,0,0]=2 717 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-7656739611 [0,1,0,0,0,0|1,0,0]=2 718 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-8732136397 [0,1,0,0,0,0|1,0,0]=2 719 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-9871023526 [0,1,0,0,0,0|1,0,0]=2 720 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-1866924065 [0,1,0,0,0,0|1,0,1]=3 721 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-5420586850 [0,1,0,0,0,0|1,0,1]=3 722 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-6933168017 [0,1,0,0,0,0|1,0,1]=3 723 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-1923367161 [0,1,0,0,0,0|1,0,1]=3 724 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-2558762790 [0,1,0,0,0,0|1,0,1]=3 725 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-2767032719 [0,1,0,0,0,0|1,0,1]=3 726 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-3230012761 [0,1,0,0,0,0|1,0,1]=3 727 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-5898455500 [0,1,0,0,0,0|1,0,1]=3 728 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-8841082803 [0,1,0,0,0,0|1,0,1]=3 729 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-3382663689 [0,1,0,0,0,0|1,0,0]=2 730 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-7889100863 [0,1,0,0,0,0|1,0,0]=2 731 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-9213747671 [0,1,0,0,0,0|1,0,0]=2 732 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-9781594017 [0,1,0,0,0,0|1,0,0]=2 733 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1569946940 [0,1,0,0,0,0|1,0,0]=2 734 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1675680486 [0,1,0,0,0,0|1,0,0]=2 735 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1903292573 [0,1,0,0,0,0|1,0,0]=2 736 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-6695566760 [0,1,0,0,0,0|1,0,0]=2 737 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-6999679319 [0,1,0,0,0,0|1,0,0]=2 738 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-8009804408 [0,1,0,0,0,0|1,0,0]=2 739 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1698400731 [0,1,0,0,0,0|1,0,0]=2 740 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1983861108 [0,1,0,0,0,0|1,0,0]=2 741 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-2838978471 [0,1,0,0,0,0|1,0,0]=2 742 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5103662767 [0,1,0,0,0,0|1,0,0]=2 743 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5299594489 [0,1,0,0,0,0|1,0,0]=2 744 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-6235136925 [0,1,0,0,0,0|1,0,0]=2 745 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-8629641721 [0,1,0,0,0,0|1,0,0]=2 746 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-2973551231 [0,1,0,0,0,0|1,0,0]=2 747 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-3190600485 [0,1,0,0,0,0|1,0,0]=2 748 B9R1.35 O=C(O)C1=CC(CC1)O MCULE-6046983646 [0,1,0,0,0,0|1,0,1]=3 749 B9R1.35 O=C(O)C1CC(=NO1)Br MCULE-8217813426 [0,1,0,0,0,0|1,0,1]=3 750 B9R1.35 O=C(O)C1CC(CN1)Br MCULE-3420644560 [0,1,0,0,0,0|1,0,0]=2 751 B9R1.35 O=C(O)C1CC(CN1)F MCULE-1909829604 [0,1,0,0,0,0|1,0,0]=2 752 B9R1.35 O=C(O)C1CC(CN1)F MCULE-4908563055 [0,1,0,0,0,0|1,0,0]=2 753 B9R1.35 O=C(O)C1CC(CN1)O MCULE-3129945874 [0,1,0,0,0,0|1,0,0]=2 754 B9R1.35 O=C(O)C1CC(CN1)O MCULE-5090896550 [0,1,0,0,0,0|1,0,0]=2 755 B9R1.35 O=C(O)C1CC(CN1)S MCULE-3928449068 [0,1,0,0,0,0|1,0,0]=2 756 B9R1.35 O=C(O)C1CC(CN1)S MCULE-7523385510 [0,1,0,0,0,0|1,0,0]=2 757 B9R1.35 O=C(O)C1CCC(C1)Br MCULE-3893521468 [0,1,0,0,0,0|1,0,0]=2 758 B9R1.35 O=C(O)C1CCC(C1)F MCULE-5981771251 [0,1,0,0,0,0|1,0,0]=2 759 B9R1.35 O=C(O)C1CCC(C1)O MCULE-3301759971 [0,1,0,0,0,0|1,0,0]=2 760 B9R1.35 O=C(O)C1CSC(=S)N1 MCULE-1769481962 [0,1,0,0,0,0|2,0,1]=4 761 B9R1.35 O=C(O)C1OC(CS1)O MCULE-2827262093 [0,1,0,0,0,0|1,0,0]=2 762 B9R1.35 O=C(O)[C@@H]1CC(CN1)O MCULE-9602889253 [0,1,0,0,0,0|1,0,0]=2 763 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6078892837 [0,1,0,0,0,0|1,0,0]=2 764 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6607761456 [0,1,0,0,0,0|1,0,0]=2 765 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-2017780821 [0,1,0,0,0,0|1,0,0]=2 766 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-8789755356 [0,1,0,0,0,0|1,0,0]=2 767 B9R1.35 O=C(O)[C@@H]1CC[C@H](C1)O MCULE-6133795580 [0,1,0,0,0,0|1,0,0]=2 768 B9R1.35 O=C(O)[C@@H]1CSC(=S)N1 MCULE-3331947152 [0,1,0,0,0,0|2,0,1]=4 769 B9R1.35 O=C(O)[C@@H]1CSC(=S)N1 MCULE-7575485678 [0,1,0,0,0,0|2,0,1]=4 770 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-2600938020 [0,1,0,0,0,0|1,0,0]=2 771 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-3945615781 [0,1,0,0,0,0|1,0,0]=2 772 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-2626475344 [0,1,0,0,0,0|1,0,0]=2 773 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-4367319835 [0,1,0,0,0,0|1,0,0]=2 774 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9011373659 [0,1,0,0,0,0|1,0,0]=2 775 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9484602400 [0,1,0,0,0,0|1,0,0]=2 776 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-2778155463 [0,1,0,0,0,0|1,0,0]=2 777 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3005368457 [0,1,0,0,0,0|1,0,0]=2 778 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3510440810 [0,1,0,0,0,0|1,0,0]=2 779 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-6982589556 [0,1,0,0,0,0|1,0,0]=2 780 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-8797295826 [0,1,0,0,0,0|1,0,0]=2 781 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-5195240463 [0,1,0,0,0,0|1,0,0]=2 782 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6442187313 [0,1,0,0,0,0|1,0,0]=2 783 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6472004515 [0,1,0,0,0,0|1,0,0]=2 784 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-8668690351 [0,1,0,0,0,0|1,0,0]=2 785 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-2784186920 [0,1,0,0,0,0|1,0,0]=2 786 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-5745425542 [0,1,0,0,0,0|1,0,0]=2 787 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9253930917 [0,1,0,0,0,0|1,0,0]=2 788 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9892414269 [0,1,0,0,0,0|1,0,0]=2 789 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-4157512603 [0,1,0,0,0,0|1,0,0]=2 790 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-5389747201 [0,1,0,0,0,0|1,0,0]=2 791 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-6465399562 [0,1,0,0,0,0|1,0,0]=2 792 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-7830616263 [0,1,0,0,0,0|1,0,0]=2 793 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-1140594774 [0,1,0,0,0,0|1,0,0]=2 794 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2383846785 [0,1,0,0,0,0|1,0,0]=2 795 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2747224270 [0,1,0,0,0,0|1,0,0]=2 796 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-5598470577 [0,1,0,0,0,0|1,0,0]=2 797 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-7268471922 [0,1,0,0,0,0|1,0,0]=2 798 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-9896850390 [0,1,0,0,0,0|1,0,0]=2 799 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-3061487094 [0,1,0,0,0,0|1,0,0]=2 800 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-8079944181 [0,1,0,0,0,0|1,0,0]=2 801 B9R1.35 O=C(O)[C@H]1CC[C@H](C1)O MCULE-2713143734 [0,1,0,0,0,0|1,0,0]=2 802 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-1499004749 [0,1,0,0,0,0|1,0,0]=2 803 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-4961028667 [0,1,0,0,0,0|1,0,0]=2 804 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-9323854334 [0,1,0,0,0,0|1,0,0]=2 805 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1222229718 [0,1,0,0,0,0|1,0,0]=2 806 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1998693022 [0,1,0,0,0,0|1,0,0]=2 807 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-3836053642 [0,1,0,0,0,0|1,0,0]=2 808 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-4545441904 [0,1,0,0,0,0|1,0,0]=2 809 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-8358409700 [0,1,0,0,0,0|1,0,0]=2 810 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-1326882154 [0,1,0,0,0,0|1,0,0]=2 811 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-4409765623 [0,1,0,0,0,0|1,0,0]=2 812 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-5169579313 [0,1,0,0,0,0|1,0,0]=2 813 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-8834390438 [0,1,0,0,0,0|1,0,0]=2 814 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-3080568728 [0,1,0,0,0,0|1,0,0]=2 815 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-4521316626 [0,1,0,0,0,0|1,0,0]=2 816 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-5972935636 [0,1,0,0,0,0|1,0,0]=2 817 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-7908625938 [0,1,0,0,0,0|1,0,0]=2 818 B9R1.35 O=C([O-])C1CC(=NO1)Br MCULE-9811393806 [0,1,0,0,0,0|1,0,2]=4 819 B9R1.35 O=C1C=C(CC1)C(=O)O MCULE-7681373121 [0,1,0,0,0,0|1,0,2]=4 820 B9R1.35 O=C1CC(CN1)C(=O)O MCULE-2190630193 [0,1,0,0,0,0|2,0,1]=4 821 B9R1.35 O=C1CC(CO1)C(=O)O MCULE-4876585769 [0,1,0,0,0,0|2,0,1]=4 822 B9R1.35 O=C1CC(CS1)C(=O)O MCULE-5763665475 [0,1,0,0,0,0|2,0,1]=4 823 B9R1.35 O=C1CC(NN1)C(=O)O MCULE-3197471189 [0,1,0,0,0,0|2,0,1]=4 824 B9R1.35 O=C1CCC(C1)C(=O)O MCULE-8715651663 [0,1,0,0,0,0|1,0,1]=3 825 B9R1.35 O=C1CCC(N1)C(=O)Cl MCULE-7943877958 [0,1,0,0,0,0|2,0,1]=4 826 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-4175874303 [0,1,0,0,0,0|1,0,1]=3 827 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-9028773140 [0,1,0,0,0,0|1,0,1]=3 828 B9R1.35 O=C1CCC(N1)C(=O)[O-] MCULE-1554748470 [0,1,0,0,0,0|1,0,2]=4 829 B9R1.35 O=C1CCC(O1)C(=O)O MCULE-1992756541 [0,1,0,0,0,0|0,0,1]=2 830 B9R1.35 O=C1CCC(S1)C(=O)O MCULE-8929436839 [0,1,0,0,0,0|0,1,1]=3 831 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-1554776363 [0,1,0,0,0,0|1,0,1]=3 832 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-4649943680 [0,1,0,0,0,0|1,0,1]=3 833 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-5900221010 [0,1,0,0,0,0|1,0,1]=3 834 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-8170238114 [0,1,0,0,0,0|1,0,1]=3 835 B9R1.35 O=C1CC[C@@H](O1)C(=O)Cl MCULE-2420158992 [0,1,0,0,0,0|1,0,1]=3 836 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-1446049605 [0,1,0,0,0,0|0,0,1]=2 837 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-6745317325 [0,1,0,0,0,0|0,0,1]=2 838 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-6597072682 [0,1,0,0,0,0|1,0,1]=3 839 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-7880064966 [0,1,0,0,0,0|1,0,1]=3 840 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4204877494 [0,1,0,0,0,0|1,0,1]=3 841 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4908547112 [0,1,0,0,0,0|1,0,1]=3 842 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-6422141688 [0,1,0,0,0,0|1,0,1]=3 843 B9R1.35 O=C1CC[C@H](N1)C(=O)[O-] MCULE-2892153827 [0,1,0,0,0,0|1,0,2]=4 844 B9R1.35 O=C1CC[C@H](N1)C(=O)[O-] MCULE-8083669516 [0,1,0,0,0,0|1,0,2]=4 845 B9R1.35 O=C1CC[C@H](O1)C(=O)Cl MCULE-2111028314 [0,1,0,0,0,0|1,0,1]=3 846 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-5669975621 [0,1,0,0,0,0|0,0,1]=2 847 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-7113736527 [0,1,0,0,0,0|0,0,1]=2 848 B9R1.35 O=C1CC[C@H](S1)C(=O)O MCULE-4843749267 [0,1,0,0,0,0|0,1,1]=3 849 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7418065190 [0,1,0,0,0,0|1,0,1]=3 850 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7697956784 [0,1,0,0,0,0|1,0,1]=3 851 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-9520720032 [0,1,0,0,0,0|1,0,1]=3 852 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-2573903934 [0,1,0,0,0,0|1,0,1]=3 853 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-3585746586 [0,1,0,0,0,0|1,0,1]=3 854 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4771747932 [0,1,0,0,0,0|1,0,1]=3 855 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4795592072 [0,1,0,0,0,0|1,0,1]=3 856 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-6928857625 [0,1,0,0,0,0|1,0,1]=3 857 B9R1.35 O=C1COC(C1)C(=O)O MCULE-4720798204 [0,1,0,0,0,0|0,0,1]=2 858 B9R1.35 O=C1CSC(C1)C(=O)O MCULE-3309649635 [0,1,0,0,0,0|0,1,1]=3 859 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-5673992530 [0,1,0,0,0,0|2,0,1]=4 860 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-8443757903 [0,1,0,0,0,0|2,0,1]=4 861 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-1024601569 [0,1,0,0,0,0|2,0,1]=4 862 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-4280238532 [0,1,0,0,0,0|2,0,1]=4 863 B9R1.35 O=C1NC(CO1)C(=O)O MCULE-5946769187 [0,1,0,0,0,0|2,0,1]=4 864 B9R1.35 O=C1NC(CS1)C(=O)O MCULE-4574359237 [0,1,0,0,0,0|2,0,1]=4 865 B9R1.35 O=C1NCC(N1)C(=O)O MCULE-5872947769 [0,1,0,0,0,0|2,0,1]=4 866 B9R1.35 O=C1NCC(O1)C(=O)O MCULE-2773613806 [0,1,0,0,0,0|1,0,1]=3 867 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-3499982275 [0,1,0,0,0,0|2,0,1]=4 868 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-9995046216 [0,1,0,0,0,0|2,0,1]=4 869 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-2524102915 [0,1,0,0,0,0|2,0,1]=4 870 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-5992511798 [0,1,0,0,0,0|2,0,1]=4 871 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-5972751457 [0,1,0,0,0,0|1,0,1]=3 872 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-6879191654 [0,1,0,0,0,0|1,0,1]=3 873 B9R1.35 O=C1N[C@@H](CO1)C(=O)O MCULE-2786614278 [0,1,0,0,0,0|2,0,1]=4 874 B9R1.35 O=C1N[C@@H](CO1)C(=O)O MCULE-8589745511 [0,1,0,0,0,0|2,0,1]=4 875 B9R1.35 O=C1N[C@@H](CS1)C(=O)O MCULE-8232416107 [0,1,0,0,0,0|2,0,1]=4 876 B9R1.35 O=C1N[C@@H](CS1)C(=O)O MCULE-9439896780 [0,1,0,0,0,0|2,0,1]=4 877 B9R1.35 O=C1N[C@H](CO1)C(=O)O MCULE-3716829138 [0,1,0,0,0,0|2,0,1]=4 878 B9R1.35 O=C1N[C@H](CO1)C(=O)O MCULE-9300998688 [0,1,0,0,0,0|2,0,1]=4 879 B9R1.35 O=C1N[C@H](CS1)C(=O)O MCULE-3120744944 [0,1,0,0,0,0|2,0,1]=4 880 B9R1.35 O=C1OCC(O1)C(=O)O MCULE-2772637927 [0,1,0,0,0,0|1,0,1]=3 881 B9R1.35 [C@@H]1(CN[C@H](C1)C(=O)O)O MCULE-3075663401 [0,1,0,0,0,0|1,0,0]=2 882 B9R1.35 [C@H]1(CC[C@H](C1)C(=O)O)N MCULE-1734860042 [0,1,0,0,0,0|1,0,0]=2 883 B9R1.35 [C@H]1(CC[C@H](C1)C(=O)O)N MCULE-3698574567 [0,1,0,0,0,0|1,0,0]=2 884 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)N)F MCULE-2355223336 [0,1,0,0,0,0|2,0,0]=3 885 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)N)F MCULE-2483830451 [0,1,0,0,0,0|2,0,0]=3 886 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)F MCULE-1784559931 [0,1,0,0,0,0|1,0,0]=2 887 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)F MCULE-8392302309 [0,1,0,0,0,0|1,0,0]=2 888 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)S MCULE-7662717521 [0,1,0,0,0,0|1,0,0]=2 889 B9R1.35 [C@H]1(CN[C@H](C1)C(=O)O)F MCULE-2026019561 [0,1,0,0,0,0|1,0,0]=2 890 B9R1.35 [C@H]1(CN[C@H](C1)C(=O)O)F MCULE-8023038198 [0,1,0,0,0,0|1,0,0]=2 891 B9R1.35 [C@H]1(C[C@H](CN1)O)C(=O)O MCULE-3462627258 [0,1,0,0,0,0|1,0,0]=2 892 B9R1.41 C1(CCCN1C)C(=O)O MCULE-7988130618 [0,1,0,0,0,0|1,0,0]=2 893 B9R1.41 CC(=O)C1=C(CCC1)C MCULE-9433038766 [0,1,0,0,0,0|2,0,1]=4 894 B9R1.41 CC(=O)C1CCCC1=O MCULE-8152440536 [0,1,0,0,0,0|2,0,0]=3 895 B9R1.41 CC(=O)C1CCOC1=O MCULE-4236075888 [0,1,0,0,0,0|3,0,0]=4 896 B9R1.41 CC(=O)N1CCCC1=O MCULE-3328735907 [0,1,0,0,0,0|3,0,0]=4 897 B9R1.41 CC(O)C1CCCN1C MCULE-1709841217 [0,1,0,0,0,0|2,0,1]=4 898 B9R1.41 CC1=C(CCC1)C(=O)O MCULE-4166872703 [0,1,0,0,0,0|1,0,1]=3 899 B9R1.41 CC1=C(CCO1)C(=O)O MCULE-2847123201 [0,1,0,0,0,0|2,0,1]=4 900 B9R1.41 CC1CCCC1C(=O)O MCULE-5150428001 [0,1,0,0,0,0|1,0,0]=2 901 B9R1.41 CC1CCNC1C(=O)O MCULE-3835684911 [0,1,0,0,0,0|1,0,0]=2 902 B9R1.41 CC1CCNC1C(=O)O MCULE-8361777649 [0,1,0,0,0,0|1,0,0]=2 903 B9R1.41 CC1CNCC1C(=O)O MCULE-1581522558 [0,1,0,0,0,0|2,0,0]=3 904 B9R1.41 CC1CNCC1C(=O)O MCULE-6848551085 [0,1,0,0,0,0|2,0,0]=3 905 B9R1.41 CC1NCCC1C(=O)O MCULE-5042669811 [0,1,0,0,0,0|2,0,0]=3 906 B9R1.41 CC1NCCC1C(=O)O MCULE-8546677468 [0,1,0,0,0,0|2,0,0]=3 907 B9R1.41 CC1OCCC1C(=O)O MCULE-4181521736 [0,1,0,0,0,0|2,0,0]=3 908 B9R1.41 CN1CC=CC1C(=O)O MCULE-5525753116 [0,1,0,0,0,0|1,0,2]=4 909 B9R1.41 CN1CC=CC1C(=O)O MCULE-8585806688 [0,1,0,0,0,0|1,0,2]=4 910 B9R1.41 CN1CCCC1C(=O)N MCULE-1474656837 [0,1,0,0,0,0|2,0,0]=3 911 B9R1.41 CN1CCCC1C(=O)O MCULE-4884381644 [0,1,0,0,0,0|1,0,0]=2 912 B9R1.41 CN1CCCC1C(=O)O MCULE-6241162207 [0,1,0,0,0,0|1,0,0]=2 913 B9R1.41 CN1CCCC1C(=O)O MCULE-7232060205 [0,1,0,0,0,0|1,0,0]=2 914 B9R1.41 CN1CCC[C@@H]1C(=O)N MCULE-1129223179 [0,1,0,0,0,0|2,0,0]=3 915 B9R1.41 CN1CCC[C@@H]1C(=O)N MCULE-1418743058 [0,1,0,0,0,0|2,0,0]=3 916 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-3947573313 [0,1,0,0,0,0|1,0,0]=2 917 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-4168419254 [0,1,0,0,0,0|1,0,0]=2 918 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-6504349835 [0,1,0,0,0,0|1,0,0]=2 919 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-9943329201 [0,1,0,0,0,0|1,0,0]=2 920 B9R1.41 CN1CCC[C@H]1C(=O)N MCULE-1155656545 [0,1,0,0,0,0|2,0,0]=3 921 B9R1.41 CN1CCC[C@H]1C(=O)N MCULE-5987152150 [0,1,0,0,0,0|2,0,0]=3 922 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-1661156416 [0,1,0,0,0,0|1,0,0]=2 923 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-2535799805 [0,1,0,0,0,0|1,0,0]=2 924 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-3283459585 [0,1,0,0,0,0|1,0,0]=2 925 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-5506159927 [0,1,0,0,0,0|1,0,0]=2 926 B9R1.41 CN1CSCC1C(=O)O MCULE-6053778396 [0,1,0,0,0,0|2,0,0]=3 927 B9R1.41 CN1CSCC1C(=O)O MCULE-8768199445 [0,1,0,0,0,0|2,0,0]=3 928 B9R1.41 CN1CSC[C@@H]1C(=O)O MCULE-9390031358 [0,1,0,0,0,0|2,0,0]=3 929 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-2295281512 [0,1,0,0,0,0|2,0,0]=3 930 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-3344236668 [0,1,0,0,0,0|2,0,0]=3 931 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-6116857567 [0,1,0,0,0,0|2,0,0]=3 932 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-7315008971 [0,1,0,0,0,0|2,0,0]=3 933 B9R1.41 C[C@@H]1CCN[C@@H]1C(=O)O MCULE-6239309390 [0,1,0,0,0,0|1,0,0]=2 934 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-1608471752 [0,1,0,0,0,0|1,0,0]=2 935 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-2896759092 [0,1,0,0,0,0|1,0,0]=2 936 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O MCULE-5338216485 [0,1,0,0,0,0|0,0,0]=1 937 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-3425733853 [0,1,0,0,0,0|2,0,0]=3 938 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-5424989009 [0,1,0,0,0,0|2,0,0]=3 939 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O MCULE-1674735474 [0,1,0,0,0,0|2,0,0]=3 940 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-8959062032 [0,1,0,0,0,0|2,0,0]=3 941 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-9340754868 [0,1,0,0,0,0|2,0,0]=3 942 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4624227681 [0,1,0,0,0,0|2,0,0]=3 943 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4653588182 [0,1,0,0,0,0|2,0,0]=3 944 B9R1.41 C[C@H](O)[C@@H]1CCCN1C MCULE-3481136719 [0,1,0,0,0,0|2,0,1]=4 945 B9R1.41 C[C@H](O)[C@@H]1CCCN1C MCULE-8355283874 [0,1,0,0,0,0|2,0,1]=4 946 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-1694933393 [0,1,0,0,0,0|1,0,0]=2 947 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-9088637113 [0,1,0,0,0,0|1,0,0]=2 948 B9R1.41 C[C@H]1CCN[C@H]1C(=O)O MCULE-1449988566 [0,1,0,0,0,0|1,0,0]=2 949 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-3190006541 [0,1,0,0,0,0|2,0,0]=3 950 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-7835079063 [0,1,0,0,0,0|2,0,0]=3 951 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-1189864899 [0,1,0,0,0,0|2,0,0]=3 952 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-8012665255 [0,1,0,0,0,0|2,0,0]=3 953 B9R1.41 NC(=O)C1CCCC1=O MCULE-2399127943 [0,1,0,0,0,0|2,0,0]=3 954 B9R1.41 NC(=O)C1CCCC1N MCULE-5593863466 [0,1,0,0,0,0|2,0,0]=3 955 B9R1.41 NC(=O)C1CCCC1N MCULE-7208597206 [0,1,0,0,0,0|2,0,0]=3 956 B9R1.41 NC(=O)C1CSCC1=O MCULE-9294547014 [0,1,0,0,0,0|3,0,0]=4 957 B9R1.41 NC(=O)C1NCCC1O MCULE-1947851170 [0,1,0,0,0,0|2,0,0]=3 958 B9R1.41 NC(=O)C1NCCC1O MCULE-8983481897 [0,1,0,0,0,0|2,0,0]=3 959 B9R1.41 NC(=O)N1CCCC1=O MCULE-5194166141 [0,1,0,0,0,0|3,0,0]=4 960 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-1275176642 [0,1,0,0,0,0|2,0,0]=3 961 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2107283008 [0,1,0,0,0,0|2,0,0]=3 962 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2865532845 [0,1,0,0,0,0|2,0,0]=3 963 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-3874121291 [0,1,0,0,0,0|2,0,0]=3 964 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O MCULE-7290076922 [0,1,0,0,0,0|2,0,0]=3 965 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-1119399523 [0,1,0,0,0,0|2,0,0]=3 966 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-4733398267 [0,1,0,0,0,0|2,0,0]=3 967 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8085547151 [0,1,0,0,0,0|2,0,0]=3 968 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8491779714 [0,1,0,0,0,0|2,0,0]=3 969 B9R1.41 NC1=C(CCC1)C(=O)O MCULE-9287668193 [0,1,0,0,0,0|1,0,1]=3 970 B9R1.41 NC1C=CCC1C(=O)O MCULE-8527386281 [0,1,0,0,0,0|1,0,2]=4 971 B9R1.41 NC1C=CCC1C(=O)O MCULE-8529743719 [0,1,0,0,0,0|1,0,2]=4 972 B9R1.41 NC1CCCC1C(=O)O MCULE-4916984038 [0,1,0,0,0,0|1,0,0]=2 973 B9R1.41 NC1CCCC1C(=O)O MCULE-7220342321 [0,1,0,0,0,0|1,0,0]=2 974 B9R1.41 NC1CCNC1C(=O)O MCULE-3789976956 [0,1,0,0,0,0|1,0,0]=2 975 B9R1.41 NC1CCNC1C(=O)O MCULE-5356536056 [0,1,0,0,0,0|1,0,0]=2 976 B9R1.41 NC1CNCC1C(=O)O MCULE-1244086282 [0,1,0,0,0,0|2,0,0]=3 977 B9R1.41 NC1COCC1C(=O)O MCULE-7325840275 [0,1,0,0,0,0|2,0,0]=3 978 B9R1.41 NC1COCC1C(=O)O MCULE-9068897815 [0,1,0,0,0,0|2,0,0]=3 979 B9R1.41 NN1CCCC1C(=O)O MCULE-1374834183 [0,1,0,0,0,0|1,0,0]=2 980 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-3446631182 [0,1,0,0,0,0|1,0,0]=2 981 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-4537266002 [0,1,0,0,0,0|1,0,0]=2 982 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9091292908 [0,1,0,0,0,0|1,0,0]=2 983 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9780104108 [0,1,0,0,0,0|1,0,0]=2 984 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-1397305924 [0,1,0,0,0,0|1,0,0]=2 985 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-5447983159 [0,1,0,0,0,0|1,0,0]=2 986 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-6345808896 [0,1,0,0,0,0|1,0,0]=2 987 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-7658809060 [0,1,0,0,0,0|1,0,0]=2 988 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-1080605796 [0,1,0,0,0,0|1,0,0]=2 989 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5666272526 [0,1,0,0,0,0|1,0,0]=2 990 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5723263979 [0,1,0,0,0,0|1,0,0]=2 991 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-6574312344 [0,1,0,0,0,0|1,0,0]=2 992 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O MCULE-9833243208 [0,1,0,0,0,0|2,0,0]=3 993 B9R1.41 N[C@@H]1COC[C@H]1C(=O)O MCULE-7323429960 [0,1,0,0,0,0|2,0,0]=3 994 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-5128495564 [0,1,0,0,0,0|1,0,0]=2 995 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-7721875754 [0,1,0,0,0,0|1,0,0]=2 996 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-8287396944 [0,1,0,0,0,0|1,0,0]=2 997 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9470915806 [0,1,0,0,0,0|1,0,0]=2 998 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9776724097 [0,1,0,0,0,0|1,0,0]=2 999 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9997148303 [0,1,0,0,0,0|1,0,0]=2 1000 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-1768949677 [0,1,0,0,0,0|1,0,0]=2 1001 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-2999200875 [0,1,0,0,0,0|1,0,0]=2 1002 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-4735278058 [0,1,0,0,0,0|1,0,0]=2 1003 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-7501259126 [0,1,0,0,0,0|1,0,0]=2 1004 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O MCULE-4396526735 [0,1,0,0,0,0|2,0,0]=3 1005 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O MCULE-9025415433 [0,1,0,0,0,0|2,0,0]=3 1006 B9R1.41 N[C@H]1COC[C@H]1C(=O)O MCULE-2956846972 [0,1,0,0,0,0|2,0,0]=3 1007 B9R1.41 N[C@H]1COC[C@H]1C(=O)O MCULE-3321988270 [0,1,0,0,0,0|2,0,0]=3 1008 B9R1.41 O=C(Cl)C1CCCC1=O MCULE-1186628152 [0,1,0,0,0,0|2,0,0]=3 1009 B9R1.41 O=C(Cl)N1CCCC1=O MCULE-4360774967 [0,1,0,0,0,0|3,0,0]=4 1010 B9R1.41 O=C(O)C1=C(CCC1)Cl MCULE-4349801654 [0,1,0,0,0,0|1,0,1]=3 1011 B9R1.41 O=C(O)C1CCCC1=O MCULE-9500236289 [0,1,0,0,0,0|1,0,0]=2 1012 B9R1.41 O=C(O)C1CCCC1O MCULE-5519958446 [0,1,0,0,0,0|1,0,0]=2 1013 B9R1.41 O=C(O)C1CCNC1=O MCULE-3110303122 [0,1,0,0,0,0|2,0,0]=3 1014 B9R1.41 O=C(O)C1CCOC1=O MCULE-1545162383 [0,1,0,0,0,0|2,0,0]=3 1015 B9R1.41 O=C(O)C1CNCC1O MCULE-4948062518 [0,1,0,0,0,0|2,0,0]=3 1016 B9R1.41 O=C(O)C1CNCC1O MCULE-8113161890 [0,1,0,0,0,0|2,0,0]=3 1017 B9R1.41 O=C(O)C1COCC1F MCULE-8830875984 [0,1,0,0,0,0|2,0,0]=3 1018 B9R1.41 O=C(O)C1CSCC1=O MCULE-2401489071 [0,1,0,0,0,0|2,0,0]=3 1019 B9R1.41 O=C(O)C1NCCC1F MCULE-2108063646 [0,1,0,0,0,0|1,0,0]=2 1020 B9R1.41 O=C(O)C1NCCC1F MCULE-6901343291 [0,1,0,0,0,0|1,0,0]=2 1021 B9R1.41 O=C(O)C1NCCC1O MCULE-3415911467 [0,1,0,0,0,0|1,0,0]=2 1022 B9R1.41 O=C(O)C1NCCC1O MCULE-3678949962 [0,1,0,0,0,0|1,0,0]=2 1023 B9R1.41 O=C(O)C1NCCC1O MCULE-6594922763 [0,1,0,0,0,0|1,0,0]=2 1024 B9R1.41 O=C(O)N1CCNC1=O MCULE-2423498210 [0,1,0,0,0,0|3,0,0]=4 1025 B9R1.41 O=C(O)N1CCOC1=O MCULE-1134006173 [0,1,0,0,0,0|3,0,0]=4 1026 B9R1.41 O=C(O)[C@@H]1CCNC1=O MCULE-2092808645 [0,1,0,0,0,0|2,0,0]=3 1027 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-3174474393 [0,1,0,0,0,0|1,0,0]=2 1028 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-5151888407 [0,1,0,0,0,0|1,0,0]=2 1029 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1216340314 [0,1,0,0,0,0|1,0,0]=2 1030 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1564327038 [0,1,0,0,0,0|1,0,0]=2 1031 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-8208546333 [0,1,0,0,0,0|1,0,0]=2 1032 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9489383113 [0,1,0,0,0,0|1,0,0]=2 1033 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9999937302 [0,1,0,0,0,0|1,0,0]=2 1034 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7001095632 [0,1,0,0,0,0|1,0,0]=2 1035 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7931619369 [0,1,0,0,0,0|1,0,0]=2 1036 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-1637514285 [0,1,0,0,0,0|1,0,0]=2 1037 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-7041138309 [0,1,0,0,0,0|1,0,0]=2 1038 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9174140225 [0,1,0,0,0,0|1,0,0]=2 1039 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9867563873 [0,1,0,0,0,0|1,0,0]=2 1040 B9R1.41 O=C(O)[C@@H]1[NH2+]CC[C@@H]1O MCULE-4350473030 [0,1,0,0,0,0|1,0,0]=2 1041 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O MCULE-7220456005 [0,1,0,0,0,0|1,0,0]=2 1042 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-1175817797 [0,1,0,0,0,0|1,0,0]=2 1043 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-5823079222 [0,1,0,0,0,0|1,0,0]=2 1044 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-6437141041 [0,1,0,0,0,0|1,0,0]=2 1045 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-8496599400 [0,1,0,0,0,0|1,0,0]=2 1046 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-1891620706 [0,1,0,0,0,0|1,0,0]=2 1047 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2757873569 [0,1,0,0,0,0|1,0,0]=2 1048 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2760733859 [0,1,0,0,0,0|1,0,0]=2 1049 B9R1.41 O=C(O)[C@H]1NCC[C@H]1F MCULE-8117073613 [0,1,0,0,0,0|1,0,0]=2 1050 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-2253713572 [0,1,0,0,0,0|1,0,0]=2 1051 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-4523708371 [0,1,0,0,0,0|1,0,0]=2 1052 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6240521801 [0,1,0,0,0,0|1,0,0]=2 1053 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6709232399 [0,1,0,0,0,0|1,0,0]=2 1054 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6746975985 [0,1,0,0,0,0|1,0,0]=2 1055 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-8268334758 [0,1,0,0,0,0|1,0,0]=2 1056 B9R1.41 [C@@H]1(CCN[C@H]1C(=O)O)O MCULE-2060265421 [0,1,0,0,0,0|1,0,0]=2 1057 B9R1.41 [C@@H]1(NCC[C@H]1O)C(=O)O MCULE-1208236317 [0,1,0,0,0,0|1,0,0]=2 1058 B9R1.41 [C@H]1(CCN[C@H]1C(=O)O)O MCULE-3906438921 [0,1,0,0,0,0|1,0,0]=2 1059 B9R1.163 CC(=O)C1(CCCC1)C MCULE-7946764519 [0,1,0,0,0,0|2,0,0]=3 1060 B9R1.163 CC(=O)C1(CCCC1)N MCULE-1766488888 [0,1,0,0,0,0|2,0,0]=3 1061 B9R1.163 CC(=O)C1(CCCC1)N MCULE-2390313394 [0,1,0,0,0,0|2,0,0]=3 1062 B9R1.163 CC(=O)C1(CCCC1)O MCULE-4607553416 [0,1,0,0,0,0|2,0,0]=3 1063 B9R1.163 CC(=O)C1(CCCO1)C MCULE-3832225855 [0,1,0,0,0,0|1,0,0]=2 1064 B9R1.163 CC(O)C1(CCCO1)C MCULE-8176746692 [0,1,0,0,0,0|1,0,1]=3 1065 B9R1.163 CC1(C=CCC1)C(=O)O MCULE-5900825388 [0,1,0,0,0,0|1,0,1]=3 1066 B9R1.163 CC1(CC=CC1)C(=O)O MCULE-6612456038 [0,1,0,0,0,0|1,0,2]=4 1067 B9R1.163 CC1(CCCC1)C(=O)Cl MCULE-6905026517 [0,1,0,0,0,0|2,0,0]=3 1068 B9R1.163 CC1(CCCC1)C(=O)O MCULE-8150530718 [0,1,0,0,0,0|1,0,0]=2 1069 B9R1.163 CC1(CCCN1)C(=O)N MCULE-1073156492 [0,1,0,0,0,0|2,0,0]=3 1070 B9R1.163 CC1(CCCN1)C(=O)N MCULE-4207908355 [0,1,0,0,0,0|2,0,0]=3 1071 B9R1.163 CC1(CCCN1)C(=O)N MCULE-5102556329 [0,1,0,0,0,0|2,0,0]=3 1072 B9R1.163 CC1(CCCN1)C(=O)O MCULE-2669113714 [0,1,0,0,0,0|1,0,0]=2 1073 B9R1.163 CC1(CCCN1)C(=O)O MCULE-3184723558 [0,1,0,0,0,0|1,0,0]=2 1074 B9R1.163 CC1(CCCN1)C(=O)O MCULE-5494365974 [0,1,0,0,0,0|1,0,0]=2 1075 B9R1.163 CC1(CCCN1)C(=O)O MCULE-9532642299 [0,1,0,0,0,0|1,0,0]=2 1076 B9R1.163 CC1(CCCN1)C(=O)O MCULE-9805069526 [0,1,0,0,0,0|1,0,0]=2 1077 B9R1.163 CC1(CCCO1)C(=O)O MCULE-9576233735 [0,1,0,0,0,0|0,0,0]=1 1078 B9R1.163 CC1(CCCS1)C(=O)O MCULE-3409370715 [0,1,0,0,0,0|0,1,0]=2 1079 B9R1.163 CC1(CCNC1)C(=O)N MCULE-9618767565 [0,1,0,0,0,0|3,0,0]=4 1080 B9R1.163 CC1(CCNC1)C(=O)O MCULE-2715430873 [0,1,0,0,0,0|2,0,0]=3 1081 B9R1.163 CC1(CCNC1)C(=O)O MCULE-4084355022 [0,1,0,0,0,0|2,0,0]=3 1082 B9R1.163 CC1(CCOC1)C(=O)O MCULE-6893882009 [0,1,0,0,0,0|2,0,0]=3 1083 B9R1.163 CC1(CSSC1)C(=O)O MCULE-1267186189 [0,1,0,0,0,0|3,0,0]=4 1084 B9R1.163 CC1(NCCS1)C(=O)O MCULE-3303237869 [0,1,0,0,0,0|1,1,0]=3 1085 B9R1.163 CC1(OCCO1)C(=O)O MCULE-6576803543 [0,1,0,0,0,0|1,0,0]=2 1086 B9R1.163 C[C@@H](O)C1(CCCO1)C MCULE-7551769191 [0,1,0,0,0,0|1,0,1]=3 1087 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-2607591453 [0,1,0,0,0,0|1,0,0]=2 1088 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-6141960789 [0,1,0,0,0,0|1,0,0]=2 1089 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-7011144386 [0,1,0,0,0,0|1,0,0]=2 1090 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-8922118927 [0,1,0,0,0,0|1,0,0]=2 1091 B9R1.163 C[C@@]1(CCCO1)C(=O)O MCULE-5169117592 [0,1,0,0,0,0|0,0,0]=1 1092 B9R1.163 C[C@@]1(CCNC1)C(=O)O MCULE-3070355045 [0,1,0,0,0,0|2,0,0]=3 1093 B9R1.163 C[C@@]1(CCNC1)C(=O)O MCULE-3719506215 [0,1,0,0,0,0|2,0,0]=3 1094 B9R1.163 C[C@@]1(CCOC1)C(=O)O MCULE-5585882923 [0,1,0,0,0,0|2,0,0]=3 1095 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-4783754920 [0,1,0,0,0,0|2,0,0]=3 1096 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-7441682522 [0,1,0,0,0,0|2,0,0]=3 1097 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-8011663424 [0,1,0,0,0,0|2,0,0]=3 1098 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-6724020872 [0,1,0,0,0,0|1,0,0]=2 1099 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-7675502884 [0,1,0,0,0,0|1,0,0]=2 1100 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-8343149548 [0,1,0,0,0,0|1,0,0]=2 1101 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-9260269719 [0,1,0,0,0,0|1,0,0]=2 1102 B9R1.163 C[C@]1(CCCO1)C(=O)O MCULE-3910400790 [0,1,0,0,0,0|0,0,0]=1 1103 B9R1.163 C[C@]1(CCNC1)C(=O)O MCULE-1423230640 [0,1,0,0,0,0|2,0,0]=3 1104 B9R1.163 C[C@]1(CCNC1)C(=O)O MCULE-7327407576 [0,1,0,0,0,0|2,0,0]=3 1105 B9R1.163 NC(=O)C1(CCCC1)N MCULE-1603183997 [0,1,0,0,0,0|2,0,0]=3 1106 B9R1.163 NC(=O)C1(CCCC1)N MCULE-6535833155 [0,1,0,0,0,0|2,0,0]=3 1107 B9R1.163 NC(=O)C1(CCCC1)O MCULE-7750018506 [0,1,0,0,0,0|2,0,0]=3 1108 B9R1.163 NC(=O)C1(CCNC1)F MCULE-2967472132 [0,1,0,0,0,0|3,0,0]=4 1109 B9R1.163 NC(=O)C1(CCNC1)O MCULE-3402125568 [0,1,0,0,0,0|3,0,0]=4 1110 B9R1.163 NC(=O)C1(CCNC1)O MCULE-4107989965 [0,1,0,0,0,0|3,0,0]=4 1111 B9R1.163 NC(=O)C1(CCSC1)N MCULE-1255795217 [0,1,0,0,0,0|3,0,0]=4 1112 B9R1.163 NC(=O)C1(CCSC1)O MCULE-2351837625 [0,1,0,0,0,0|3,0,0]=4 1113 B9R1.163 NC(=S)C1(CCCC1)N MCULE-1374309481 [0,1,0,0,0,0|2,1,0]=4 1114 B9R1.163 NC1(CC=CC1)C(=O)O MCULE-1445980877 [0,1,0,0,0,0|1,0,2]=4 1115 B9R1.163 NC1(CC=CC1)C(=O)O MCULE-5381827504 [0,1,0,0,0,0|1,0,2]=4 1116 B9R1.163 NC1(CCCC1)C(=O)O MCULE-6366286422 [0,1,0,0,0,0|1,0,0]=2 1117 B9R1.163 NC1(CCNC1)C(=O)O MCULE-1061035749 [0,1,0,0,0,0|2,0,0]=3 1118 B9R1.163 NC1(CCOC1)C(=O)O MCULE-1020331216 [0,1,0,0,0,0|2,0,0]=3 1119 B9R1.163 NC1(CCOC1)C(=O)O MCULE-3239849151 [0,1,0,0,0,0|2,0,0]=3 1120 B9R1.163 NC1(CCOC1)C(=O)O MCULE-7635316557 [0,1,0,0,0,0|2,0,0]=3 1121 B9R1.163 NC1(CCSC1)C(=O)O MCULE-2866413498 [0,1,0,0,0,0|2,0,0]=3 1122 B9R1.163 NC1(CCSC1)C(=O)O MCULE-3077570702 [0,1,0,0,0,0|2,0,0]=3 1123 B9R1.163 N[C@@]1(CCOC1)C(=O)O MCULE-4940789798 [0,1,0,0,0,0|2,0,0]=3 1124 B9R1.163 N[C@@]1(CCOC1)C(=O)O MCULE-9120207414 [0,1,0,0,0,0|2,0,0]=3 1125 B9R1.163 N[C@@]1(CCSC1)C(=O)O MCULE-3449072625 [0,1,0,0,0,0|2,0,0]=3 1126 B9R1.163 N[C@@]1(CCSC1)C(=O)O MCULE-6533506498 [0,1,0,0,0,0|2,0,0]=3 1127 B9R1.163 N[C@]1(CCNC1)C(=O)O MCULE-5112163951 [0,1,0,0,0,0|2,0,0]=3 1128 B9R1.163 N[C@]1(CCNC1)C(=O)O MCULE-7065442028 [0,1,0,0,0,0|2,0,0]=3 1129 B9R1.163 N[C@]1(CCOC1)C(=O)O MCULE-6757422211 [0,1,0,0,0,0|2,0,0]=3 1130 B9R1.163 N[C@]1(CCOC1)C(=O)O MCULE-8786481856 [0,1,0,0,0,0|2,0,0]=3 1131 B9R1.163 N[C@]1(CCSC1)C(=O)O MCULE-1832449395 [0,1,0,0,0,0|2,0,0]=3 1132 B9R1.163 N[C@]1(CCSC1)C(=O)O MCULE-1974139646 [0,1,0,0,0,0|2,0,0]=3 1133 B9R1.163 O=C(O)C1(CCCC1)Br MCULE-3131005284 [0,1,0,0,0,0|1,0,0]=2 1134 B9R1.163 O=C(O)C1(CCCC1)F MCULE-4282263280 [0,1,0,0,0,0|1,0,0]=2 1135 B9R1.163 O=C(O)C1(CCCC1)O MCULE-2147028492 [0,1,0,0,0,0|1,0,0]=2 1136 B9R1.163 O=C(O)C1(CCNC1)F MCULE-3943818123 [0,1,0,0,0,0|2,0,0]=3 1137 B9R1.163 O=C(O)C1(CCNC1)F MCULE-9385624346 [0,1,0,0,0,0|2,0,0]=3 1138 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5890399768 [0,1,0,0,0,0|2,0,0]=3 1139 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5910869185 [0,1,0,0,0,0|2,0,0]=3 1140 B9R1.163 O=C(O)C1(CCOC1)F MCULE-5718551369 [0,1,0,0,0,0|2,0,0]=3 1141 B9R1.163 O=C(O)C1(CCOC1)O MCULE-8834969992 [0,1,0,0,0,0|2,0,0]=3 1142 B9R1.163 O=C(O)C1(CCSC1)O MCULE-7477879136 [0,1,0,0,0,0|2,0,0]=3 1143 B9R1.163 O=C(O)[C@@]1(CCNC1)F MCULE-8296048165 [0,1,0,0,0,0|2,0,0]=3 1144 B7R0.4 C#CCCCC(=O)C MCULE-9860822800 [0,0,1,0,0,0|2,0,1]=4 1145 B7R0.4 C#CCCCC(=O)Cl MCULE-8504740573 [0,0,1,0,0,0|2,0,1]=4 1146 B7R0.4 C#CCCCC(=O)N MCULE-3927386617 [0,0,1,0,0,0|2,0,1]=4 1147 B7R0.4 C#CCCCC(=O)O MCULE-7464892335 [0,0,1,0,0,0|1,0,1]=3 1148 B7R0.4 C#CCNCC(=O)O MCULE-3308171795 [0,0,1,0,0,0|1,0,2]=4 1149 B7R0.4 C#CCNCC(=O)O MCULE-7200045848 [0,0,1,0,0,0|1,0,2]=4 1150 B7R0.4 C#CCOCC(=O)O MCULE-7164718181 [0,0,1,0,0,0|0,0,2]=3 1151 B7R0.4 C#CCSCC(=O)O MCULE-4337210412 [0,0,1,0,0,0|0,1,2]=4 1152 B7R0.4 C(=C/C(=O)O)\CCC MCULE-7580507705 [0,0,1,0,0,0|1,0,1]=3 1153 B7R0.4 C(=C/CC(=O)O)\CC MCULE-2731794411 [0,0,1,0,0,0|1,0,1]=3 1154 B7R0.4 C=C(Br)CCCCC MCULE-3049831354 [0,0,1,0,0,0|3,0,0]=4 1155 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [0,0,1,0,0,0|3,0,0]=4 1156 B7R0.4 C=C(Cl)CCCCC MCULE-5074452982 [0,0,1,0,0,0|3,0,0]=4 1157 B7R0.4 C=C=CCCC(=O)O MCULE-4179366971 [0,0,1,0,0,0|1,0,2]=4 1158 B7R0.4 C=CCCCC(=O)Cl MCULE-9125909850 [0,0,1,0,0,0|2,0,1]=4 1159 B7R0.4 C=CCCCC(=O)O MCULE-6043142578 [0,0,1,0,0,0|1,0,1]=3 1160 B7R0.4 C=CCNCC(=O)O MCULE-2925626447 [0,0,1,0,0,0|1,0,2]=4 1161 B7R0.4 C=CCNCC(=O)O MCULE-6980667867 [0,0,1,0,0,0|1,0,2]=4 1162 B7R0.4 C=CCOCC(=O)O MCULE-1419435306 [0,0,1,0,0,0|0,0,2]=3 1163 B7R0.4 C=CCSCC(=O)O MCULE-1950424629 [0,0,1,0,0,0|0,1,2]=4 1164 B7R0.4 CC#CCCC(=O)O MCULE-1415388780 [0,0,1,0,0,0|1,0,2]=4 1165 B7R0.4 CC(=CCCCO)C MCULE-5263952692 [0,0,1,0,0,0|2,0,1]=4 1166 B7R0.4 CC(=O)CCCC#N MCULE-5884370871 [0,0,1,0,0,0|2,0,1]=4 1167 B7R0.4 CC(=O)CCCCBr MCULE-8801446022 [0,0,1,0,0,0|2,0,0]=3 1168 B7R0.4 CC(=O)CCCCCl MCULE-2883443563 [0,0,1,0,0,0|2,0,0]=3 1169 B7R0.4 CC(=O)CCCCO MCULE-9846338144 [0,0,1,0,0,0|1,0,0]=2 1170 B7R0.4 CC(=O)CSCCF MCULE-8129308816 [0,0,1,0,0,0|2,1,0]=4 1171 B7R0.4 CC(=O)NCCCBr MCULE-5421597540 [0,0,1,0,0,0|3,0,0]=4 1172 B7R0.4 CC(=O)NCCCCl MCULE-4056331581 [0,0,1,0,0,0|3,0,0]=4 1173 B7R0.4 CC(=O)NCCCN MCULE-6321543480 [0,0,1,0,0,0|3,0,0]=4 1174 B7R0.4 CC(=O)NCCCN MCULE-8441492497 [0,0,1,0,0,0|3,0,0]=4 1175 B7R0.4 CC(=O)NCCCO MCULE-5627003249 [0,0,1,0,0,0|2,0,0]=3 1176 B7R0.4 CC(=O)OCCCBr MCULE-4735159476 [0,0,1,0,0,0|3,0,0]=4 1177 B7R0.4 CC(=O)OCCCCl MCULE-4801419214 [0,0,1,0,0,0|3,0,0]=4 1178 B7R0.4 CC(=O)OCCCI MCULE-5830086336 [0,0,1,0,0,0|3,0,0]=4 1179 B7R0.4 CC(=O)OCCCO MCULE-1423430948 [0,0,1,0,0,0|2,0,0]=3 1180 B7R0.4 CC(=O)OCCCS MCULE-2576827025 [0,0,1,0,0,0|2,1,0]=4 1181 B7R0.4 CC(=O)SCCCBr MCULE-2716633608 [0,0,1,0,0,0|3,0,0]=4 1182 B7R0.4 CC(=O)SCCCCl MCULE-3875604518 [0,0,1,0,0,0|3,0,0]=4 1183 B7R0.4 CC(=O)SCCCO MCULE-9014625190 [0,0,1,0,0,0|2,0,0]=3 1184 B7R0.4 CC(Br)CCCCO MCULE-2106751856 [0,0,1,0,0,0|2,0,1]=4 1185 B7R0.4 CC(C)CCCCO MCULE-9053698607 [0,0,1,0,0,0|2,0,1]=4 1186 B7R0.4 CC(N)CCCCO MCULE-7039935081 [0,0,1,0,0,0|2,0,1]=4 1187 B7R0.4 CC(N)CCCCO MCULE-8167834378 [0,0,1,0,0,0|2,0,1]=4 1188 B7R0.4 CC(O)CCCCO MCULE-3790969400 [0,0,1,0,0,0|1,0,1]=3 1189 B7R0.4 CC(O)CNCCO MCULE-4873845500 [0,0,1,0,0,0|2,0,1]=4 1190 B7R0.4 CC(O)CSCCO MCULE-8885458360 [0,0,1,0,0,0|2,0,1]=4 1191 B7R0.4 CC=CCCC(=O)O MCULE-4275247668 [0,0,1,0,0,0|1,0,2]=4 1192 B7R0.4 CCC/C=C/C(=O)C MCULE-2005171902 [0,0,1,0,0,0|2,0,1]=4 1193 B7R0.4 CCC=CCC(=O)O MCULE-5031939966 [0,0,1,0,0,0|1,0,1]=3 1194 B7R0.4 CCCC#CC(=O)O MCULE-1682387091 [0,0,1,0,0,0|1,0,1]=3 1195 B7R0.4 CCCC=CC(=O)C MCULE-5008490883 [0,0,1,0,0,0|2,0,1]=4 1196 B7R0.4 CCCC=CC(=O)Cl MCULE-6782906777 [0,0,1,0,0,0|2,0,1]=4 1197 B7R0.4 CCCC=CC(=O)O MCULE-6995077492 [0,0,1,0,0,0|1,0,1]=3 1198 B7R0.4 CCCCCB(O)O MCULE-3441747739 [0,0,1,0,0,0|2,0,1]=4 1199 B7R0.4 CCCCCC(=N)N MCULE-4874167268 [0,0,1,0,0,0|3,0,0]=4 1200 B7R0.4 CCCCCC(=N)N MCULE-6942690708 [0,0,1,0,0,0|3,0,0]=4 1201 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [0,0,1,0,0,0|2,0,0]=3 1202 B7R0.4 CCCCCC(=O)Cl MCULE-5446850478 [0,0,1,0,0,0|2,0,0]=3 1203 B7R0.4 CCCCCC(=O)N MCULE-3215992514 [0,0,1,0,0,0|2,0,0]=3 1204 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [0,0,1,0,0,0|1,0,0]=2 1205 B7R0.4 CCCCCC(=O)[O-] MCULE-5310584661 [0,0,1,0,0,0|1,0,1]=3 1206 B7R0.4 CCCCCC(=O)[O-] MCULE-9495078126 [0,0,1,0,0,0|1,0,1]=3 1207 B7R0.4 CCCCCC(=S)N MCULE-7633089850 [0,0,1,0,0,0|2,1,0]=4 1208 B7R0.4 CCCCCC(C)O MCULE-2463855771 [0,0,1,0,0,0|2,0,1]=4 1209 B7R0.4 CCCCCN(=O)=O MCULE-6853489453 [0,0,1,0,0,0|2,0,1]=4 1210 B7R0.4 CCCCC[C@@H](C)O MCULE-1984852239 [0,0,1,0,0,0|2,0,1]=4 1211 B7R0.4 CCCCC[C@@H](C)O MCULE-2769933740 [0,0,1,0,0,0|2,0,1]=4 1212 B7R0.4 CCCCC[C@H](C)O MCULE-2305379902 [0,0,1,0,0,0|2,0,1]=4 1213 B7R0.4 CCCCC[C@H](C)O MCULE-5898721044 [0,0,1,0,0,0|2,0,1]=4 1214 B7R0.4 CCCCNC(=O)C MCULE-7266335096 [0,0,1,0,0,0|3,0,0]=4 1215 B7R0.4 CCCCNC(=O)Cl MCULE-2148016012 [0,0,1,0,0,0|3,0,0]=4 1216 B7R0.4 CCCCNC(=O)N MCULE-3263036294 [0,0,1,0,0,0|3,0,0]=4 1217 B7R0.4 CCCCOC(=O)C MCULE-2107021121 [0,0,1,0,0,0|3,0,0]=4 1218 B7R0.4 CCCCOC(=O)Cl MCULE-5750652482 [0,0,1,0,0,0|3,0,0]=4 1219 B7R0.4 CCCCOC(=O)N MCULE-7719579696 [0,0,1,0,0,0|3,0,0]=4 1220 B7R0.4 CCCCSC(=O)C MCULE-2653182488 [0,0,1,0,0,0|3,0,0]=4 1221 B7R0.4 CCCCSC(=O)Cl MCULE-8008254909 [0,0,1,0,0,0|3,0,0]=4 1222 B7R0.4 CCCNCC(=O)N MCULE-2330202708 [0,0,1,0,0,0|2,0,0]=3 1223 B7R0.4 CCCNCC(=O)N MCULE-3731054780 [0,0,1,0,0,0|2,0,0]=3 1224 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [0,0,1,0,0,0|1,0,0]=2 1225 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [0,0,1,0,0,0|1,0,0]=2 1226 B7R0.4 CCCNCC(C)O MCULE-8110237473 [0,0,1,0,0,0|2,0,1]=4 1227 B7R0.4 CCCOCC(=O)O MCULE-6841640058 [0,0,1,0,0,0|0,0,0]=1 1228 B7R0.4 CCCOCC(=S)N MCULE-4681127635 [0,0,1,0,0,0|1,1,0]=3 1229 B7R0.4 CCCOCC(C)O MCULE-9214840563 [0,0,1,0,0,0|1,0,1]=3 1230 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [0,0,1,0,0,0|1,1,0]=3 1231 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [0,0,1,0,0,0|0,1,0]=2 1232 B7R0.4 CCNCCC(=O)N MCULE-4857735433 [0,0,1,0,0,0|3,0,0]=4 1233 B7R0.4 CCNCCC(=O)N MCULE-8238114591 [0,0,1,0,0,0|3,0,0]=4 1234 B7R0.4 CCNCCC(=O)O MCULE-4226597657 [0,0,1,0,0,0|2,0,0]=3 1235 B7R0.4 CCNCCC(=O)O MCULE-9183951914 [0,0,1,0,0,0|2,0,0]=3 1236 B7R0.4 CCO/C=C/C(=O)O MCULE-6712227034 [0,0,1,0,0,0|2,0,1]=4 1237 B7R0.4 CCOC=CC(=O)O MCULE-4776715351 [0,0,1,0,0,0|2,0,1]=4 1238 B7R0.4 CCOCCC(=O)C MCULE-8449201493 [0,0,1,0,0,0|3,0,0]=4 1239 B7R0.4 CCOCCC(=O)Cl MCULE-8299617790 [0,0,1,0,0,0|3,0,0]=4 1240 B7R0.4 CCOCCC(=O)O MCULE-3962084059 [0,0,1,0,0,0|2,0,0]=3 1241 B7R0.4 CCSCCC(=O)O MCULE-9385724904 [0,0,1,0,0,0|2,0,0]=3 1242 B7R0.4 CN(C)CCCCO MCULE-6973654872 [0,0,1,0,0,0|3,0,0]=4 1243 B7R0.4 CNCCCC(=O)N MCULE-8337447772 [0,0,1,0,0,0|3,0,0]=4 1244 B7R0.4 CNCCCC(=O)N MCULE-9037809827 [0,0,1,0,0,0|3,0,0]=4 1245 B7R0.4 CNCCCC(=O)O MCULE-7598762485 [0,0,1,0,0,0|2,0,0]=3 1246 B7R0.4 CNCCCC(=O)O MCULE-7877286915 [0,0,1,0,0,0|2,0,0]=3 1247 B7R0.4 COC/C=C/C(=O)O MCULE-7555080897 [0,0,1,0,0,0|2,0,1]=4 1248 B7R0.4 COCC#CC(=O)O MCULE-5896712747 [0,0,1,0,0,0|2,0,1]=4 1249 B7R0.4 COCC=CC(=O)O MCULE-5702384430 [0,0,1,0,0,0|2,0,1]=4 1250 B7R0.4 COCCCC(=O)C MCULE-3606369396 [0,0,1,0,0,0|3,0,0]=4 1251 B7R0.4 COCCCC(=O)O MCULE-3165881573 [0,0,1,0,0,0|2,0,0]=3 1252 B7R0.4 CSCC=CC(=O)O MCULE-8220760222 [0,0,1,0,0,0|2,0,1]=4 1253 B7R0.4 CSCCCC(=O)O MCULE-2126637794 [0,0,1,0,0,0|2,0,0]=3 1254 B7R0.4 CSSCCC(=O)O MCULE-6571821309 [0,0,1,0,0,0|3,0,0]=4 1255 B7R0.4 N#CCCCC(=O)O MCULE-9921837071 [0,0,1,0,0,0|1,0,1]=3 1256 B7R0.4 N#CCSCC(=O)O MCULE-4687961137 [0,0,1,0,0,0|1,1,1]=4 1257 B7R0.4 N#N=NCCC(=O)O MCULE-2098979516 [0,0,1,0,0,0|3,0,0]=4 1258 B7R0.4 N=C(N)CCCCCl MCULE-4352194585 [0,0,1,0,0,0|3,0,0]=4 1259 B7R0.4 N=C(N)CCCCCl MCULE-5262170460 [0,0,1,0,0,0|3,0,0]=4 1260 B7R0.4 NC(=O)CCCCBr MCULE-4949681497 [0,0,1,0,0,0|2,0,0]=3 1261 B7R0.4 NC(=O)CCCCCl MCULE-7937142112 [0,0,1,0,0,0|2,0,0]=3 1262 B7R0.4 NC(=O)CCCCO MCULE-4820227146 [0,0,1,0,0,0|1,0,0]=2 1263 B7R0.4 NC(=O)COCCCl MCULE-1141300697 [0,0,1,0,0,0|2,0,0]=3 1264 B7R0.4 NC(=O)COCCO MCULE-3158372920 [0,0,1,0,0,0|2,0,0]=3 1265 B7R0.4 NC(=O)CSCCO MCULE-8225407259 [0,0,1,0,0,0|2,0,0]=3 1266 B7R0.4 NC(=O)NCCCO MCULE-3167491311 [0,0,1,0,0,0|2,0,0]=3 1267 B7R0.4 NCCCCC(=O)N MCULE-3198962228 [0,0,1,0,0,0|2,0,0]=3 1268 B7R0.4 NCCCCC(=O)N MCULE-7986221705 [0,0,1,0,0,0|2,0,0]=3 1269 B7R0.4 NCCCCC(=O)O MCULE-1155829905 [0,0,1,0,0,0|1,0,0]=2 1270 B7R0.4 NCCCCC(=O)O MCULE-3920398524 [0,0,1,0,0,0|1,0,0]=2 1271 B7R0.4 NCCCCC(=O)O MCULE-4404796498 [0,0,1,0,0,0|1,0,0]=2 1272 B7R0.4 NCCCCC(=O)O MCULE-4971679857 [0,0,1,0,0,0|1,0,0]=2 1273 B7R0.4 NCCCNC(=O)N MCULE-1109440921 [0,0,1,0,0,0|3,0,0]=4 1274 B7R0.4 NCCCNC(=O)N MCULE-3933221897 [0,0,1,0,0,0|3,0,0]=4 1275 B7R0.4 NCCCOS(=O)O MCULE-8389295774 [0,0,1,0,0,0|3,0,0]=4 1276 B7R0.4 NCCNCC(=O)O MCULE-9689592343 [0,0,1,0,0,0|2,0,0]=3 1277 B7R0.4 NCCNCC(=O)O MCULE-9795251557 [0,0,1,0,0,0|2,0,0]=3 1278 B7R0.4 NCCOCC(=O)O MCULE-2375694645 [0,0,1,0,0,0|1,0,0]=2 1279 B7R0.4 NCCOCC(=O)O MCULE-5877065986 [0,0,1,0,0,0|1,0,0]=2 1280 B7R0.4 NCCSCC(=O)O MCULE-5565800206 [0,0,1,0,0,0|1,1,0]=3 1281 B7R0.4 NCCSCC(=O)O MCULE-8322098978 [0,0,1,0,0,0|1,1,0]=3 1282 B7R0.4 NOCCCC(=O)O MCULE-4102473285 [0,0,1,0,0,0|2,0,0]=3 1283 B7R0.4 NOCCCC(=O)O MCULE-7068985203 [0,0,1,0,0,0|2,0,0]=3 1284 B7R0.4 O=C(Cl)CCCCBr MCULE-5574450546 [0,0,1,0,0,0|2,0,0]=3 1285 B7R0.4 O=C(Cl)CCCCCl MCULE-9605707894 [0,0,1,0,0,0|2,0,0]=3 1286 B7R0.4 O=C(Cl)CCCCF MCULE-8110878511 [0,0,1,0,0,0|2,0,0]=3 1287 B7R0.4 O=C(Cl)COCCCl MCULE-9707252778 [0,0,1,0,0,0|2,0,0]=3 1288 B7R0.4 O=C(Cl)OCCCCl MCULE-2619287385 [0,0,1,0,0,0|3,0,0]=4 1289 B7R0.4 O=C(Cl)OCCCF MCULE-4930474319 [0,0,1,0,0,0|3,0,0]=4 1290 B7R0.4 O=C(O)C#CCCO MCULE-5211042941 [0,0,1,0,0,0|0,0,2]=3 1291 B7R0.4 O=C(O)CCC=CBr MCULE-1826887170 [0,0,1,0,0,0|1,0,2]=4 1292 B7R0.4 O=C(O)CCCCBr MCULE-2655919094 [0,0,1,0,0,0|1,0,0]=2 1293 B7R0.4 O=C(O)CCCCCl MCULE-4094641005 [0,0,1,0,0,0|1,0,0]=2 1294 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [0,0,1,0,0,0|0,0,0]=1 1295 B7R0.4 O=C(O)CCCCS MCULE-2427465795 [0,0,1,0,0,0|0,1,0]=2 1296 B7R0.4 O=C(O)CNCCO MCULE-7501311949 [0,0,1,0,0,0|1,0,0]=2 1297 B7R0.4 O=C(O)COCCBr MCULE-4593325557 [0,0,1,0,0,0|1,0,0]=2 1298 B7R0.4 O=C(O)COCCCl MCULE-2978816248 [0,0,1,0,0,0|1,0,0]=2 1299 B7R0.4 O=C(O)COCCF MCULE-9820799514 [0,0,1,0,0,0|1,0,0]=2 1300 B7R0.4 O=C(O)COCCO MCULE-8297137880 [0,0,1,0,0,0|1,0,0]=2 1301 B7R0.4 O=C(O)CSCCCl MCULE-5204967583 [0,0,1,0,0,0|1,1,0]=3 1302 B7R0.4 O=C(O)CSCCO MCULE-1062560307 [0,0,1,0,0,0|1,0,0]=2 1303 B7R0.4 O=C([O-])CCCCO MCULE-3836827182 [0,0,1,0,0,0|0,0,1]=2 1304 B7R0.4 O=C([O-])COCCO MCULE-7093344226 [0,0,1,0,0,0|1,0,1]=3 1305 B7R0.4 O=CCCCC(=O)O MCULE-8389457571 [0,0,1,0,0,0|0,0,2]=3 1306 B7R0.4 O=N(=O)CCCCBr MCULE-8310183286 [0,0,1,0,0,0|2,0,1]=4 1307 B7R0.4 O=N(=O)CCCCCl MCULE-9069384470 [0,0,1,0,0,0|2,0,1]=4 1308 B7R0.4 O=N(=O)CCCCO MCULE-4639070341 [0,0,1,0,0,0|1,0,1]=3 1309 B7R0.4 O=N(=O)OCCCO MCULE-3030828224 [0,0,1,0,0,0|2,0,1]=4 1310 B7R0.4 OB(O)CCCCBr MCULE-3231135677 [0,0,1,0,0,0|2,0,1]=4 1311 B7R0.5 C#CCC(C)C(=O)O MCULE-4819055703 [0,0,1,0,0,0|1,0,2]=4 1312 B7R0.5 C#CCC(F)C(=O)O MCULE-1070671235 [0,0,1,0,0,0|1,0,2]=4 1313 B7R0.5 C#CCC(N)C(=O)O MCULE-2022398365 [0,0,1,0,0,0|1,0,2]=4 1314 B7R0.5 C#CCC(N)C(=O)O MCULE-2451098139 [0,0,1,0,0,0|1,0,2]=4 1315 B7R0.5 C#CCC(N)C(=O)O MCULE-4330300997 [0,0,1,0,0,0|1,0,2]=4 1316 B7R0.5 C#CCC(N)C(=O)O MCULE-5100293043 [0,0,1,0,0,0|1,0,2]=4 1317 B7R0.5 C#CCC(O)C(=O)O MCULE-4988425198 [0,0,1,0,0,0|0,0,2]=3 1318 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-1266511504 [0,0,1,0,0,0|1,0,2]=4 1319 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-2589808316 [0,0,1,0,0,0|1,0,2]=4 1320 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-4703021434 [0,0,1,0,0,0|1,0,2]=4 1321 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-5616417783 [0,0,1,0,0,0|1,0,2]=4 1322 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-1593368546 [0,0,1,0,0,0|1,0,2]=4 1323 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-5683421535 [0,0,1,0,0,0|1,0,2]=4 1324 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-7302855511 [0,0,1,0,0,0|1,0,2]=4 1325 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-9256626051 [0,0,1,0,0,0|1,0,2]=4 1326 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [0,0,1,0,0,0|1,0,1]=3 1327 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [0,0,1,0,0,0|2,0,1]=4 1328 B7R0.5 C=C(COC)C(=O)O MCULE-8964616960 [0,0,1,0,0,0|2,0,1]=4 1329 B7R0.5 C=C=CC(C)C(=O)O MCULE-3438905862 [0,0,1,0,0,0|1,0,2]=4 1330 B7R0.5 C=CCC(C)C(=O)O MCULE-2912410432 [0,0,1,0,0,0|1,0,2]=4 1331 B7R0.5 C=CCC(N)C(=O)O MCULE-1550468430 [0,0,1,0,0,0|1,0,2]=4 1332 B7R0.5 C=CCC(N)C(=O)O MCULE-1783682768 [0,0,1,0,0,0|1,0,2]=4 1333 B7R0.5 C=CCC(N)C(=O)O MCULE-8721864064 [0,0,1,0,0,0|1,0,2]=4 1334 B7R0.5 C=CCC(N)C(=O)O MCULE-9091562338 [0,0,1,0,0,0|1,0,2]=4 1335 B7R0.5 C=CCC(O)C(=O)O MCULE-6418899544 [0,0,1,0,0,0|0,0,2]=3 1336 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-3817126030 [0,0,1,0,0,0|1,0,2]=4 1337 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-5479618260 [0,0,1,0,0,0|1,0,2]=4 1338 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-6719393730 [0,0,1,0,0,0|1,0,2]=4 1339 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-7577627870 [0,0,1,0,0,0|1,0,2]=4 1340 B7R0.5 C=CC[C@@H](O)C(=O)O MCULE-4103471826 [0,0,1,0,0,0|0,0,2]=3 1341 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-2073484196 [0,0,1,0,0,0|1,0,2]=4 1342 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-3267648941 [0,0,1,0,0,0|1,0,2]=4 1343 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-4183531139 [0,0,1,0,0,0|1,0,2]=4 1344 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-8225762047 [0,0,1,0,0,0|1,0,2]=4 1345 B7R0.5 C=CC[C@H](O)C(=O)O MCULE-8230827617 [0,0,1,0,0,0|0,0,2]=3 1346 B7R0.5 CC(=O)C(C)CCBr MCULE-4705039689 [0,0,1,0,0,0|3,0,0]=4 1347 B7R0.5 CC(=O)C(C)CCCl MCULE-2960091698 [0,0,1,0,0,0|3,0,0]=4 1348 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [0,0,1,0,0,0|3,0,0]=4 1349 B7R0.5 CC(=O)C(Cl)CCCl MCULE-4634341484 [0,0,1,0,0,0|3,0,0]=4 1350 B7R0.5 CC(=O)C(Cl)CCO MCULE-1606704903 [0,0,1,0,0,0|3,0,0]=4 1351 B7R0.5 CC(CCCl)C(=O)Cl MCULE-4844969943 [0,0,1,0,0,0|3,0,0]=4 1352 B7R0.5 CC(CCN)C(=O)O MCULE-8098419324 [0,0,1,0,0,0|2,0,0]=3 1353 B7R0.5 CC(CCN)C(=O)O MCULE-8509861009 [0,0,1,0,0,0|2,0,0]=3 1354 B7R0.5 CC(CCO)C(=O)N MCULE-3037868887 [0,0,1,0,0,0|3,0,0]=4 1355 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [0,0,1,0,0,0|2,0,0]=3 1356 B7R0.5 CC(CCO)C(=O)[O-] MCULE-2278638513 [0,0,1,0,0,0|2,0,1]=4 1357 B7R0.5 CC(N=N#N)C(=O)O MCULE-1449528032 [0,0,1,0,0,0|3,0,0]=4 1358 B7R0.5 CC(N=N#N)C(=O)O MCULE-6367123914 [0,0,1,0,0,0|3,0,0]=4 1359 B7R0.5 CC(NC=O)C(=O)O MCULE-7277951464 [0,0,1,0,0,0|2,0,1]=4 1360 B7R0.5 CC/C=C(\C)/C(=O)O MCULE-1290613859 [0,0,1,0,0,0|1,0,1]=3 1361 B7R0.5 CC=CC(C)C(=O)O MCULE-5584906296 [0,0,1,0,0,0|1,0,1]=3 1362 B7R0.5 CC=CC(O)C(=O)O MCULE-5249095255 [0,0,1,0,0,0|0,0,2]=3 1363 B7R0.5 CCC=C(C)C(=O)O MCULE-5045441145 [0,0,1,0,0,0|1,0,1]=3 1364 B7R0.5 CCC=C(F)C(=O)O MCULE-6630499680 [0,0,1,0,0,0|1,0,2]=4 1365 B7R0.5 CCCC(=O)C(=O)C MCULE-8267463586 [0,0,1,0,0,0|1,0,2]=4 1366 B7R0.5 CCCC(=O)C(=O)N MCULE-6625605588 [0,0,1,0,0,0|1,0,2]=4 1367 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [0,0,1,0,0,0|0,0,2]=3 1368 B7R0.5 CCCC(Br)C(=O)C MCULE-2062903416 [0,0,1,0,0,0|2,0,0]=3 1369 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [0,0,1,0,0,0|1,0,0]=2 1370 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [0,0,1,0,0,0|2,0,0]=3 1371 B7R0.5 CCCC(C)C(=O)Cl MCULE-4855016209 [0,0,1,0,0,0|2,0,0]=3 1372 B7R0.5 CCCC(C)C(=O)N MCULE-1948746391 [0,0,1,0,0,0|2,0,0]=3 1373 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [0,0,1,0,0,0|1,0,0]=2 1374 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [0,0,1,0,0,0|2,0,1]=4 1375 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [0,0,1,0,0,0|1,0,0]=2 1376 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [0,0,1,0,0,0|1,0,0]=2 1377 B7R0.5 CCCC(N)C(=O)N MCULE-5159221123 [0,0,1,0,0,0|2,0,0]=3 1378 B7R0.5 CCCC(N)C(=O)N MCULE-5742773956 [0,0,1,0,0,0|2,0,0]=3 1379 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [0,0,1,0,0,0|1,0,0]=2 1380 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [0,0,1,0,0,0|1,0,0]=2 1381 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [0,0,1,0,0,0|1,0,0]=2 1382 B7R0.5 CCCC(O)C(=O)N MCULE-3143432132 [0,0,1,0,0,0|1,0,0]=2 1383 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [0,0,1,0,0,0|0,0,0]=1 1384 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [0,0,1,0,0,0|0,0,0]=1 1385 B7R0.5 CCCC(O)C(C)C MCULE-8942406791 [0,0,1,0,0,0|2,0,1]=4 1386 B7R0.5 CCCN(C)C(=O)Cl MCULE-2930764127 [0,0,1,0,0,0|3,0,0]=4 1387 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [0,0,1,0,0,0|1,0,0]=2 1388 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [0,0,1,0,0,0|1,0,0]=2 1389 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [0,0,1,0,0,0|0,0,0]=1 1390 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [0,0,1,0,0,0|1,0,0]=2 1391 B7R0.5 CCC[C@H](N)C(=O)N MCULE-2163059771 [0,0,1,0,0,0|2,0,0]=3 1392 B7R0.5 CCC[C@H](N)C(=O)N MCULE-4687172013 [0,0,1,0,0,0|2,0,0]=3 1393 B7R0.5 CCC[C@H](N)C(=O)N MCULE-7482592029 [0,0,1,0,0,0|2,0,0]=3 1394 B7R0.5 CCC[C@H](N)C(=O)N MCULE-9639796243 [0,0,1,0,0,0|2,0,0]=3 1395 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [0,0,1,0,0,0|1,0,0]=2 1396 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [0,0,1,0,0,0|1,0,0]=2 1397 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [0,0,1,0,0,0|1,0,0]=2 1398 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [0,0,1,0,0,0|0,0,0]=1 1399 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [0,0,1,0,0,0|0,0,0]=1 1400 B7R0.5 CCNC(=O)C(=O)O MCULE-1213485294 [0,0,1,0,0,0|1,0,2]=4 1401 B7R0.5 CCNC(C)C(=O)N MCULE-2861818493 [0,0,1,0,0,0|2,0,0]=3 1402 B7R0.5 CCNC(C)C(=O)N MCULE-6110291237 [0,0,1,0,0,0|2,0,0]=3 1403 B7R0.5 CCNC(C)C(=O)O MCULE-5445574810 [0,0,1,0,0,0|1,0,0]=2 1404 B7R0.5 CCNC(C)C(=O)O MCULE-5666785247 [0,0,1,0,0,0|1,0,0]=2 1405 B7R0.5 CCN[C@H](C)C(=O)O MCULE-9676358201 [0,0,1,0,0,0|1,0,0]=2 1406 B7R0.5 CCOC(=O)C(=O)C MCULE-5817261721 [0,0,1,0,0,0|2,0,1]=4 1407 B7R0.5 CCOC(=O)C(=O)Cl MCULE-6454421959 [0,0,1,0,0,0|2,0,1]=4 1408 B7R0.5 CCOC(=O)C(=O)N MCULE-2968497645 [0,0,1,0,0,0|2,0,1]=4 1409 B7R0.5 CCOC(=O)C(=O)O MCULE-2368024441 [0,0,1,0,0,0|1,0,1]=3 1410 B7R0.5 CCOC(=O)C(=O)[O-] MCULE-1807862684 [0,0,1,0,0,0|1,0,2]=4 1411 B7R0.5 CCOC(=S)C(=O)N MCULE-4600711043 [0,0,1,0,0,0|2,0,1]=4 1412 B7R0.5 CCOC(C)C(=O)O MCULE-2185795311 [0,0,1,0,0,0|0,0,0]=1 1413 B7R0.5 CCOC(C)C(=S)N MCULE-2027801148 [0,0,1,0,0,0|1,1,0]=3 1414 B7R0.5 CCSC(C)C(=O)O MCULE-9817243573 [0,0,1,0,0,0|0,1,0]=2 1415 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [0,0,1,0,0,0|2,0,0]=3 1416 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [0,0,1,0,0,0|2,0,0]=3 1417 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [0,0,1,0,0,0|2,0,0]=3 1418 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [0,0,1,0,0,0|2,0,0]=3 1419 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [0,0,1,0,0,0|2,0,0]=3 1420 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [0,0,1,0,0,0|2,0,0]=3 1421 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [0,0,1,0,0,0|2,0,0]=3 1422 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [0,0,1,0,0,0|2,0,0]=3 1423 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [0,0,1,0,0,0|2,0,0]=3 1424 B7R0.5 COCC(C)C(=O)C MCULE-5328927786 [0,0,1,0,0,0|3,0,0]=4 1425 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [0,0,1,0,0,0|2,0,0]=3 1426 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [0,0,1,0,0,0|2,0,0]=3 1427 B7R0.5 COCC(N)C(=O)N MCULE-2465830538 [0,0,1,0,0,0|3,0,0]=4 1428 B7R0.5 COCC(N)C(=O)N MCULE-6194410780 [0,0,1,0,0,0|3,0,0]=4 1429 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [0,0,1,0,0,0|2,0,0]=3 1430 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [0,0,1,0,0,0|2,0,0]=3 1431 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [0,0,1,0,0,0|2,0,0]=3 1432 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [0,0,1,0,0,0|2,0,0]=3 1433 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [0,0,1,0,0,0|1,0,0]=2 1434 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [0,0,1,0,0,0|2,0,0]=3 1435 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [0,0,1,0,0,0|2,0,0]=3 1436 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [0,0,1,0,0,0|2,0,0]=3 1437 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [0,0,1,0,0,0|2,0,0]=3 1438 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [0,0,1,0,0,0|2,0,0]=3 1439 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [0,0,1,0,0,0|2,0,0]=3 1440 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [0,0,1,0,0,0|2,0,0]=3 1441 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [0,0,1,0,0,0|2,0,0]=3 1442 B7R0.5 CON=C(C)C(=O)O MCULE-8599774085 [0,0,1,0,0,0|2,0,1]=4 1443 B7R0.5 CSCC(C)C(=O)O MCULE-7112130175 [0,0,1,0,0,0|2,0,0]=3 1444 B7R0.5 CSCC(N)C(=O)O MCULE-7668628251 [0,0,1,0,0,0|2,0,0]=3 1445 B7R0.5 CSC[C@H](N)C(=O)O MCULE-1178337776 [0,0,1,0,0,0|2,0,0]=3 1446 B7R0.5 CSC[C@H](N)C(=O)O MCULE-2769761337 [0,0,1,0,0,0|2,0,0]=3 1447 B7R0.5 C[C@@H](CCS)C(=O)O MCULE-2918304262 [0,0,1,0,0,0|2,0,0]=3 1448 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O MCULE-2214426945 [0,0,1,0,0,0|3,0,0]=4 1449 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O MCULE-6124505236 [0,0,1,0,0,0|3,0,0]=4 1450 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O MCULE-3591368470 [0,0,1,0,0,0|3,0,0]=4 1451 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O MCULE-5109353470 [0,0,1,0,0,0|3,0,0]=4 1452 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O MCULE-6277841083 [0,0,1,0,0,0|3,0,0]=4 1453 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O MCULE-7843278634 [0,0,1,0,0,0|3,0,0]=4 1454 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-3824082361 [0,0,1,0,0,0|2,0,1]=4 1455 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-5248110352 [0,0,1,0,0,0|2,0,1]=4 1456 B7R0.5 C[Se]CC(N)C(=O)O MCULE-3357465269 [0,0,1,0,0,0|2,0,0]=3 1457 B7R0.5 C[Se]CC(N)C(=O)O MCULE-7671606756 [0,0,1,0,0,0|2,0,0]=3 1458 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-5208306365 [0,0,1,0,0,0|2,0,0]=3 1459 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6734478742 [0,0,1,0,0,0|2,0,0]=3 1460 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6760615750 [0,0,1,0,0,0|2,0,0]=3 1461 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-7512025617 [0,0,1,0,0,0|2,0,0]=3 1462 B7R0.5 N#CCC(N)C(=O)O MCULE-4929926467 [0,0,1,0,0,0|2,0,1]=4 1463 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6294926701 [0,0,1,0,0,0|2,0,1]=4 1464 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6432920316 [0,0,1,0,0,0|2,0,1]=4 1465 B7R0.5 NC(=O)C(Br)CCBr MCULE-5008510444 [0,0,1,0,0,0|3,0,0]=4 1466 B7R0.5 NC(CCBr)C(=O)O MCULE-1900559475 [0,0,1,0,0,0|2,0,0]=3 1467 B7R0.5 NC(CCBr)C(=O)O MCULE-7293320576 [0,0,1,0,0,0|2,0,0]=3 1468 B7R0.5 NC(CCF)C(=O)O MCULE-5519595590 [0,0,1,0,0,0|2,0,0]=3 1469 B7R0.5 NC(CCF)C(=O)O MCULE-7293194855 [0,0,1,0,0,0|2,0,0]=3 1470 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [0,0,1,0,0,0|2,0,0]=3 1471 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [0,0,1,0,0,0|2,0,0]=3 1472 B7R0.5 NC(CCS)C(=O)O MCULE-8057550187 [0,0,1,0,0,0|2,0,0]=3 1473 B7R0.5 NC(CCS)C(=O)O MCULE-8117596001 [0,0,1,0,0,0|2,0,0]=3 1474 B7R0.5 NC(CNO)C(=O)O MCULE-2332662988 [0,0,1,0,0,0|3,0,0]=4 1475 B7R0.5 NCCC(F)C(=O)O MCULE-5068755002 [0,0,1,0,0,0|2,0,0]=3 1476 B7R0.5 NCCC(F)C(=O)O MCULE-9196695600 [0,0,1,0,0,0|2,0,0]=3 1477 B7R0.5 NCCC(N)C(=O)O MCULE-1239764966 [0,0,1,0,0,0|2,0,0]=3 1478 B7R0.5 NCCC(N)C(=O)O MCULE-2441123923 [0,0,1,0,0,0|2,0,0]=3 1479 B7R0.5 NCCC(N)C(=O)O MCULE-3966593369 [0,0,1,0,0,0|2,0,0]=3 1480 B7R0.5 NCCC(N)C(=O)O MCULE-4212078130 [0,0,1,0,0,0|2,0,0]=3 1481 B7R0.5 NCCC(N)C(=O)O MCULE-7713366571 [0,0,1,0,0,0|2,0,0]=3 1482 B7R0.5 NCCC(N)C(=O)O MCULE-8402131049 [0,0,1,0,0,0|2,0,0]=3 1483 B7R0.5 NCCC(N)C(=O)O MCULE-9198187552 [0,0,1,0,0,0|2,0,0]=3 1484 B7R0.5 NCCC(O)C(=O)O MCULE-3670080484 [0,0,1,0,0,0|1,0,0]=2 1485 B7R0.5 NCCC(O)C(=O)O MCULE-6540935279 [0,0,1,0,0,0|1,0,0]=2 1486 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-4000770618 [0,0,1,0,0,0|2,0,0]=3 1487 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-5775312784 [0,0,1,0,0,0|2,0,0]=3 1488 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-6259961704 [0,0,1,0,0,0|2,0,0]=3 1489 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-9871958374 [0,0,1,0,0,0|2,0,0]=3 1490 B7R0.5 NCC[C@@H](O)C(=O)O MCULE-9726912888 [0,0,1,0,0,0|1,0,0]=2 1491 B7R0.5 NCC[C@H](N)C(=O)O MCULE-1745978456 [0,0,1,0,0,0|2,0,0]=3 1492 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3856066353 [0,0,1,0,0,0|2,0,0]=3 1493 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3919721317 [0,0,1,0,0,0|2,0,0]=3 1494 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5434373726 [0,0,1,0,0,0|2,0,0]=3 1495 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5992578597 [0,0,1,0,0,0|2,0,0]=3 1496 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6536533546 [0,0,1,0,0,0|2,0,0]=3 1497 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6978035806 [0,0,1,0,0,0|2,0,0]=3 1498 B7R0.5 NCC[C@H](N)C(=O)O MCULE-8762011291 [0,0,1,0,0,0|2,0,0]=3 1499 B7R0.5 NCC[C@H](N)C(=O)O MCULE-9645608127 [0,0,1,0,0,0|2,0,0]=3 1500 B7R0.5 NCC[C@H](O)C(=O)O MCULE-3296998083 [0,0,1,0,0,0|1,0,0]=2 1501 B7R0.5 NCC[C@H](O)C(=O)O MCULE-7901866019 [0,0,1,0,0,0|1,0,0]=2 1502 B7R0.5 NOC[C@H](N)C(=O)O MCULE-1050292176 [0,0,1,0,0,0|3,0,0]=4 1503 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2388269464 [0,0,1,0,0,0|2,0,0]=3 1504 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2456796412 [0,0,1,0,0,0|2,0,0]=3 1505 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-6229782603 [0,0,1,0,0,0|2,0,0]=3 1506 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-8123446168 [0,0,1,0,0,0|2,0,0]=3 1507 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [0,0,1,0,0,0|2,0,0]=3 1508 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [0,0,1,0,0,0|2,0,0]=3 1509 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-4021115723 [0,0,1,0,0,0|2,0,0]=3 1510 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-7661321953 [0,0,1,0,0,0|2,0,0]=3 1511 B7R0.5 N[C@@H](CSS)C(=O)O MCULE-3029500977 [0,0,1,0,0,0|3,0,0]=4 1512 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-1975650690 [0,0,1,0,0,0|2,0,0]=3 1513 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-7245104465 [0,0,1,0,0,0|2,0,0]=3 1514 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [0,0,1,0,0,0|2,0,0]=3 1515 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [0,0,1,0,0,0|2,0,0]=3 1516 B7R0.5 N[C@H](CCS)C(=O)O MCULE-1110046008 [0,0,1,0,0,0|2,0,0]=3 1517 B7R0.5 N[C@H](CCS)C(=O)O MCULE-7556963357 [0,0,1,0,0,0|2,0,0]=3 1518 B7R0.5 O=C(Br)C(Br)CCBr MCULE-1496301616 [0,0,1,0,0,0|3,0,0]=4 1519 B7R0.5 O=C(Cl)C(Br)CCBr MCULE-9787639147 [0,0,1,0,0,0|3,0,0]=4 1520 B7R0.5 O=C(Cl)C(Br)CCCl MCULE-6400872582 [0,0,1,0,0,0|3,0,0]=4 1521 B7R0.5 O=C(O)C(Br)CCBr MCULE-3091819269 [0,0,1,0,0,0|2,0,0]=3 1522 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [0,0,1,0,0,0|1,0,0]=2 1523 B7R0.5 [C@H](N)(CC#C)C(=O)O MCULE-7308061694 [0,0,1,0,0,0|1,0,2]=4 1524 B7R0.15 C#CC(OC)C(=O)O MCULE-9292798546 [0,0,1,0,0,0|0,0,2]=3 1525 B7R0.15 C=C(C)C(CC)CC MCULE-2424136176 [0,0,1,0,0,0|3,0,0]=4 1526 B7R0.15 CC=C(CC)C(=O)O MCULE-9303879981 [0,0,1,0,0,0|1,0,1]=3 1527 B7R0.15 CCC(C#N)C(=O)O MCULE-4808497444 [0,0,1,0,0,0|2,0,0]=3 1528 B7R0.15 CCC(CC)C(=O)C MCULE-5291760485 [0,0,1,0,0,0|2,0,0]=3 1529 B7R0.15 CCC(CC)C(=O)Cl MCULE-1027070009 [0,0,1,0,0,0|2,0,0]=3 1530 B7R0.15 CCC(CC)C(=O)N MCULE-7337294425 [0,0,1,0,0,0|2,0,0]=3 1531 B7R0.15 CCC(CC)C(=O)O MCULE-5236890306 [0,0,1,0,0,0|1,0,0]=2 1532 B7R0.15 CCC(CC)C(=S)N MCULE-8027076934 [0,0,1,0,0,0|2,1,0]=4 1533 B7R0.15 CCC(CC)C(C)O MCULE-9742014522 [0,0,1,0,0,0|2,0,1]=4 1534 B7R0.15 CCC(CN)C(=O)O MCULE-3795207054 [0,0,1,0,0,0|2,0,0]=3 1535 B7R0.15 CCC(CN)C(=O)O MCULE-3929048283 [0,0,1,0,0,0|2,0,0]=3 1536 B7R0.15 CCC(CO)C(=O)O MCULE-9435802738 [0,0,1,0,0,0|2,0,0]=3 1537 B7R0.15 CCC(CO)C(=O)[O-] MCULE-4277685135 [0,0,1,0,0,0|2,0,1]=4 1538 B7R0.15 CCC(NC)C(=O)N MCULE-1925914686 [0,0,1,0,0,0|2,0,0]=3 1539 B7R0.15 CCC(NC)C(=O)N MCULE-3283265693 [0,0,1,0,0,0|2,0,0]=3 1540 B7R0.15 CCC(NC)C(=O)O MCULE-4101988968 [0,0,1,0,0,0|1,0,0]=2 1541 B7R0.15 CCC(NC)C(=O)O MCULE-4491873969 [0,0,1,0,0,0|1,0,0]=2 1542 B7R0.15 CCC(NN)C(=O)O MCULE-8823684595 [0,0,1,0,0,0|2,0,0]=3 1543 B7R0.15 CCC(NO)C(=O)O MCULE-1962461048 [0,0,1,0,0,0|2,0,0]=3 1544 B7R0.15 CCC(OC)C(=O)N MCULE-4022181907 [0,0,1,0,0,0|1,0,0]=2 1545 B7R0.15 CCC(OC)C(=O)O MCULE-2475290794 [0,0,1,0,0,0|0,0,0]=1 1546 B7R0.15 CCC(SC)C(=O)O MCULE-3373016779 [0,0,1,0,0,0|0,1,0]=2 1547 B7R0.15 CCN(CC)C(=O)C MCULE-6584128098 [0,0,1,0,0,0|3,0,0]=4 1548 B7R0.15 CCN(CC)C(=O)Cl MCULE-2162985195 [0,0,1,0,0,0|3,0,0]=4 1549 B7R0.15 CCN(CC)C(=O)N MCULE-7011051295 [0,0,1,0,0,0|3,0,0]=4 1550 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-3190659348 [0,0,1,0,0,0|2,0,0]=3 1551 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-5613487575 [0,0,1,0,0,0|2,0,0]=3 1552 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-6726398435 [0,0,1,0,0,0|2,0,0]=3 1553 B7R0.15 CC[C@H](CN)C(=O)O MCULE-2222410753 [0,0,1,0,0,0|2,0,0]=3 1554 B7R0.15 CC[C@H](CN)C(=O)O MCULE-3153536523 [0,0,1,0,0,0|2,0,0]=3 1555 B7R0.15 CC[C@H](CO)C(=O)O MCULE-3017159819 [0,0,1,0,0,0|2,0,0]=3 1556 B7R0.15 CC[C@H](NC)C(=O)N MCULE-6927041915 [0,0,1,0,0,0|2,0,0]=3 1557 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8566282898 [0,0,1,0,0,0|2,0,0]=3 1558 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8659413445 [0,0,1,0,0,0|2,0,0]=3 1559 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8863599251 [0,0,1,0,0,0|2,0,0]=3 1560 B7R0.15 CNC(CN)C(=O)N MCULE-4431940195 [0,0,1,0,0,0|3,0,0]=4 1561 B7R0.15 CNC(CO)C(=O)O MCULE-1439435474 [0,0,1,0,0,0|2,0,0]=3 1562 B7R0.15 CNC(CO)C(=O)O MCULE-7611211207 [0,0,1,0,0,0|2,0,0]=3 1563 B7R0.15 CNC(CS)C(=O)O MCULE-4817727684 [0,0,1,0,0,0|2,0,0]=3 1564 B7R0.15 CNC(CS)C(=O)O MCULE-5741984055 [0,0,1,0,0,0|2,0,0]=3 1565 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3196852022 [0,0,1,0,0,0|2,0,0]=3 1566 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3690177999 [0,0,1,0,0,0|2,0,0]=3 1567 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-3320307572 [0,0,1,0,0,0|2,0,0]=3 1568 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-5844994620 [0,0,1,0,0,0|2,0,0]=3 1569 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6293854138 [0,0,1,0,0,0|2,0,0]=3 1570 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6463850730 [0,0,1,0,0,0|2,0,0]=3 1571 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-3043115433 [0,0,1,0,0,0|2,0,0]=3 1572 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-8814760080 [0,0,1,0,0,0|2,0,0]=3 1573 B7R0.15 CN[C@H](CO)C(=O)O MCULE-1791141182 [0,0,1,0,0,0|2,0,0]=3 1574 B7R0.15 CN[C@H](CO)C(=O)O MCULE-9346314213 [0,0,1,0,0,0|2,0,0]=3 1575 B7R0.15 COC(CBr)C(=O)O MCULE-5528365617 [0,0,1,0,0,0|1,0,0]=2 1576 B7R0.15 COC(CN)C(=O)N MCULE-3215392526 [0,0,1,0,0,0|2,0,0]=3 1577 B7R0.15 COC(CN)C(=O)O MCULE-1561937449 [0,0,1,0,0,0|1,0,0]=2 1578 B7R0.15 COC(CN)C(=O)O MCULE-7501291426 [0,0,1,0,0,0|1,0,0]=2 1579 B7R0.15 COC(OC)C(=N)N MCULE-1897423045 [0,0,1,0,0,0|3,0,0]=4 1580 B7R0.15 COC(OC)C(=N)N MCULE-9805136082 [0,0,1,0,0,0|3,0,0]=4 1581 B7R0.15 COC(OC)C(=O)C MCULE-9746788369 [0,0,1,0,0,0|2,0,0]=3 1582 B7R0.15 COC(OC)C(=O)N MCULE-2624682764 [0,0,1,0,0,0|2,0,0]=3 1583 B7R0.15 COC(OC)C(=O)O MCULE-3341727181 [0,0,1,0,0,0|1,0,0]=2 1584 B7R0.15 COC(OC)C(=O)[O-] MCULE-5345464135 [0,0,1,0,0,0|1,0,1]=3 1585 B7R0.15 COC(OC)C(C)O MCULE-9058387582 [0,0,1,0,0,0|2,0,1]=4 1586 B7R0.15 COC(OC)[C@@H](C)O MCULE-2524252240 [0,0,1,0,0,0|2,0,1]=4 1587 B7R0.15 COC(OC)[C@H](C)O MCULE-2577056762 [0,0,1,0,0,0|2,0,1]=4 1588 B7R0.15 CO[C@@H](CN)C(=O)O MCULE-5536624827 [0,0,1,0,0,0|1,0,0]=2 1589 B7R0.15 CO[C@@H](CN)C(=O)O MCULE-6198841067 [0,0,1,0,0,0|1,0,0]=2 1590 B7R0.15 N#CC(CN)C(=O)O MCULE-3513807694 [0,0,1,0,0,0|3,0,0]=4 1591 B7R0.15 NCC(CO)C(=O)O MCULE-5510878508 [0,0,1,0,0,0|3,0,0]=4 1592 B7R0.15 NCC(CO)C(=O)O MCULE-9991285445 [0,0,1,0,0,0|3,0,0]=4 1593 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-4607648703 [0,0,1,0,0,0|3,0,0]=4 1594 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-8943978569 [0,0,1,0,0,0|3,0,0]=4 1595 B7R0.15 NC[C@H](CO)C(=O)O MCULE-8459713640 [0,0,1,0,0,0|3,0,0]=4 1596 B7R0.15 O=C(O)C(CBr)CBr MCULE-5180730979 [0,0,1,0,0,0|3,0,0]=4 1597 B7R0.15 O=C(O)C(CS)CS MCULE-3175815620 [0,0,1,0,0,0|3,0,0]=4 1598 B7R0.15 O=C(O)[C@H](CO)NP MCULE-8418001133 [0,0,1,0,0,0|3,0,0]=4 1599 B9R2.7 NC1CC2C1OCC2 MCULE-9987634072 [0,0,0,1,0,0|2,0,1]=4 1600 B9R2.7 O=C1CC2C1C=CC2 MCULE-3852880142 [0,0,0,1,0,0|2,0,1]=4 1601 B9R2.7 O=C1CC2C1CNC2 MCULE-7088124346 [0,0,0,1,0,0|3,0,0]=4 1602 B9R2.7 O=C1CC2C1CNC2 MCULE-9132894100 [0,0,0,1,0,0|3,0,0]=4 1603 B9R2.7 O=C1CC2C1NCC2 MCULE-5565431334 [0,0,0,1,0,0|2,0,0]=3 1604 B9R2.7 O=C1CC2C1NCC2 MCULE-8877801710 [0,0,0,1,0,0|2,0,0]=3 1605 B9R2.7 O=C1CC2C1OCC2 MCULE-9845403948 [0,0,0,1,0,0|1,0,0]=2 1606 B9R2.7 O=C1C[C@H]2[C@@H]1OCC2 MCULE-7616272357 [0,0,0,1,0,0|1,0,0]=2 1607 B9R2.7 O=C1NC2C1CCC2 MCULE-4665683392 [0,0,0,1,0,0|2,0,0]=3 1608 B9R2.7 O=C1N[C@@H]2[C@H]1CCC2 MCULE-6354748107 [0,0,0,1,0,0|2,0,0]=3 1609 B9R2.7 OC1CC2C1NCC2 MCULE-1724056091 [0,0,0,1,0,0|2,0,1]=4 1610 B9R2.7 OC1CC2C1NCC2 MCULE-4088023944 [0,0,0,1,0,0|2,0,1]=4 1611 B9R2.7 [C@@H]12CCO[C@@H]1C(=O)C2 MCULE-8869936364 [0,0,0,1,0,0|1,0,0]=2 1612 B9R2.7 [C@H]12CCC[C@H]1NC2=O MCULE-8553168635 [0,0,0,1,0,0|2,0,0]=3 1613 B9R2.39 BrC1=CC2CCC1C2 MCULE-1542178097 [0,0,0,1,0,0|3,0,0]=4 1614 B9R2.39 C12CNC(C1)C(=O)O2 MCULE-4651135224 [0,0,0,1,0,0|1,0,0]=2 1615 B9R2.39 NC1CC2CCC1O2 MCULE-7005194127 [0,0,0,1,0,0|2,0,1]=4 1616 B9R2.39 NC1CC2CCC1O2 MCULE-9938013447 [0,0,0,1,0,0|2,0,1]=4 1617 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1O2 MCULE-1567634529 [0,0,0,1,0,0|2,0,1]=4 1618 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1O2 MCULE-3673875552 [0,0,0,1,0,0|2,0,1]=4 1619 B9R2.39 O=C1CC2C=CC1C2 MCULE-9956317855 [0,0,0,1,0,0|2,0,1]=4 1620 B9R2.39 O=C1CC2CC1CN2 MCULE-1513637451 [0,0,0,1,0,0|3,0,0]=4 1621 B9R2.39 O=C1CC2CC1CN2 MCULE-8245110165 [0,0,0,1,0,0|3,0,0]=4 1622 B9R2.39 O=C1CC2CCC1C2 MCULE-2467634489 [0,0,0,1,0,0|2,0,0]=3 1623 B9R2.39 O=C1CC2CCC1N2 MCULE-2060564396 [0,0,0,1,0,0|2,0,0]=3 1624 B9R2.39 O=C1CC2CCC1N2 MCULE-3298355504 [0,0,0,1,0,0|2,0,0]=3 1625 B9R2.39 O=C1CC2CCC1O2 MCULE-3122768457 [0,0,0,1,0,0|1,0,0]=2 1626 B9R2.39 O=C1CC2CNC1C2 MCULE-1302527504 [0,0,0,1,0,0|2,0,0]=3 1627 B9R2.39 O=C1CC2CNC1C2 MCULE-3367580397 [0,0,0,1,0,0|2,0,0]=3 1628 B9R2.39 O=C1CN2CCC1C2 MCULE-2930167084 [0,0,0,1,0,0|3,0,0]=4 1629 B9R2.39 O=C1CN2CCC1C2 MCULE-6962814008 [0,0,0,1,0,0|3,0,0]=4 1630 B9R2.39 O=C1C[C@@H]2CC[C@H]1C2 MCULE-9992741520 [0,0,0,1,0,0|2,0,0]=3 1631 B9R2.39 O=C1C[C@H]2CC[C@@H]1C2 MCULE-2228698965 [0,0,0,1,0,0|2,0,0]=3 1632 B9R2.39 O=C1NC2C=CC1C2 MCULE-6558104055 [0,0,0,1,0,0|2,0,1]=4 1633 B9R2.39 O=C1NC2CCC1C2 MCULE-2050587567 [0,0,0,1,0,0|2,0,0]=3 1634 B9R2.39 O=C1N[C@@H]2C=C[C@H]1C2 MCULE-9490915904 [0,0,0,1,0,0|2,0,1]=4 1635 B9R2.39 O=C1N[C@@H]2CC[C@H]1C2 MCULE-2601085316 [0,0,0,1,0,0|2,0,0]=3 1636 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 MCULE-6049411288 [0,0,0,1,0,0|2,0,0]=3 1637 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 MCULE-7775612507 [0,0,0,1,0,0|2,0,0]=3 1638 B9R2.39 O=C1N[C@H]2CC[C@@H]1C2 MCULE-6863863448 [0,0,0,1,0,0|2,0,0]=3 1639 B9R2.39 O=C1OC2CNC1C2 MCULE-1081203973 [0,0,0,1,0,0|1,0,0]=2 1640 B9R2.39 O=C1OC2CNC1C2 MCULE-4715019258 [0,0,0,1,0,0|1,0,0]=2 1641 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-1020161730 [0,0,0,1,0,0|1,0,0]=2 1642 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-3837738406 [0,0,0,1,0,0|1,0,0]=2 1643 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-6980885310 [0,0,0,1,0,0|1,0,0]=2 1644 B9R2.39 OC1CC2CCC1C2 MCULE-6414891759 [0,0,0,1,0,0|2,0,1]=4 1645 B9R2.39 OC1CC2CCC1N2 MCULE-1605436075 [0,0,0,1,0,0|2,0,1]=4 1646 B9R2.39 OC1CC2CCC1N2 MCULE-1761281414 [0,0,0,1,0,0|2,0,1]=4 1647 B9R2.39 OC1CC2CCC1O2 MCULE-3124193235 [0,0,0,1,0,0|1,0,1]=3 1648 B9R2.39 OC1CC2CNC1C2 MCULE-2749316886 [0,0,0,1,0,0|2,0,1]=4 1649 B9R2.39 OC1CC2CNC1C2 MCULE-4966948452 [0,0,0,1,0,0|2,0,1]=4 1650 B9R2.39 OC1C[C@@H]2CC[C@H]1C2 MCULE-9639323400 [0,0,0,1,0,0|2,0,1]=4 1651 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-4979276205 [0,0,0,1,0,0|2,0,1]=4 1652 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 MCULE-3144398733 [0,0,0,1,0,0|2,0,1]=4 1653 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 MCULE-7894832313 [0,0,0,1,0,0|2,0,1]=4 1654 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1C2 MCULE-6071426979 [0,0,0,1,0,0|2,0,1]=4 1655 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 MCULE-1633391346 [0,0,0,1,0,0|2,0,1]=4 1656 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 MCULE-9461548760 [0,0,0,1,0,0|2,0,1]=4 1657 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 MCULE-1159886921 [0,0,0,1,0,0|2,0,1]=4 1658 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 MCULE-6982071164 [0,0,0,1,0,0|2,0,1]=4 1659 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 MCULE-4495352435 [0,0,0,1,0,0|2,0,1]=4 1660 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 MCULE-6073992216 [0,0,0,1,0,0|2,0,1]=4 1661 B9R2.39 [C@@H]1(C[C@@H]2CC[C@H]1C2)O MCULE-6218681459 [0,0,0,1,0,0|2,0,1]=4 1662 B9R2.39 [C@@H]12C=C([C@@H](C1)CC2)Br MCULE-1979441209 [0,0,0,1,0,0|3,0,0]=4 1663 B9R2.39 [C@@H]12C=C([C@@H](C1)CC2)C MCULE-9983936985 [0,0,0,1,0,0|3,0,0]=4 1664 B9R2.39 [C@@H]12C=C[C@@H](C1)C(=O)N2 MCULE-7927184168 [0,0,0,1,0,0|2,0,1]=4 1665 B9R2.39 [C@@H]12C=C[C@@H](C1)C(=O)N2 MCULE-9869305172 [0,0,0,1,0,0|2,0,1]=4 1666 B9R2.39 [C@@H]12C=C[C@@H](C1)NC2=O MCULE-3299747937 [0,0,0,1,0,0|2,0,1]=4 1667 B9R2.39 [C@@H]12C=C[C@@H](C1)NC2=O MCULE-6202052539 [0,0,0,1,0,0|2,0,1]=4 1668 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-3428651950 [0,0,0,1,0,0|2,0,1]=4 1669 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-5974580174 [0,0,0,1,0,0|2,0,1]=4 1670 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-6305413134 [0,0,0,1,0,0|2,0,1]=4 1671 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-7062654568 [0,0,0,1,0,0|2,0,1]=4 1672 B9R2.39 [C@@H]12CC[C@@H](N1)[C@H](C2)O MCULE-4291985781 [0,0,0,1,0,0|2,0,1]=4 1673 B9R2.39 [C@@H]12CC[C@@H](N1)[C@H](C2)O MCULE-8663774893 [0,0,0,1,0,0|2,0,1]=4 1674 B9R2.39 [C@@H]12CC[C@@H](O1)[C@@H](C2)N MCULE-3840560284 [0,0,0,1,0,0|2,0,1]=4 1675 B9R2.39 [C@@H]12CC[C@@H](O1)[C@@H](C2)N MCULE-6488455225 [0,0,0,1,0,0|2,0,1]=4 1676 B9R2.39 [C@@H]12CC[C@@H](O1)[C@H](C2)O MCULE-2630669259 [0,0,0,1,0,0|1,0,1]=3 1677 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-4857421267 [0,0,0,1,0,0|1,0,0]=2 1678 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-5314520254 [0,0,0,1,0,0|1,0,0]=2 1679 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-8592680797 [0,0,0,1,0,0|1,0,0]=2 1680 B9R2.39 [C@H]12C=CC(C1)C(=O)N2 MCULE-5474445534 [0,0,0,1,0,0|2,0,1]=4 1681 B9R2.39 [C@H]12CCN(C1)CC2=O MCULE-4642920839 [0,0,0,1,0,0|3,0,0]=4 1682 B9R2.39 [C@H]12CC[C@H](C1)C(=O)N2 MCULE-3838940137 [0,0,0,1,0,0|2,0,0]=3 1683 B9R2.39 [C@H]12CC[C@H](C1)CC2=O MCULE-1488894938 [0,0,0,1,0,0|2,0,0]=3 1684 B9R2.39 [C@H]12CC[C@H](C1)CC2O MCULE-7175651186 [0,0,0,1,0,0|2,0,1]=4 1685 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-4118507960 [0,0,0,1,0,0|2,0,1]=4 1686 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-9141970579 [0,0,0,1,0,0|2,0,1]=4 1687 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-4746309717 [0,0,0,1,0,0|2,0,1]=4 1688 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-5454625797 [0,0,0,1,0,0|2,0,1]=4 1689 B9R2.148 O=C(O)C1C2C1CC2 MCULE-2273094599 [0,0,0,1,0,0|1,0,0]=2 1690 B9R2.148 O=C(O)C1C2C1NC2 MCULE-5026622210 [0,0,0,1,0,0|2,0,0]=3 1691 B7R1.18 C1(CCN1)C(=O)O MCULE-9324355017 [0,0,0,0,1,0|1,0,0]=2 1692 B7R1.18 CC(=O)C1CCC1 MCULE-5770046789 [0,0,0,0,1,0|1,0,0]=2 1693 B7R1.18 CC(=O)C1CNC1 MCULE-2354733934 [0,0,0,0,1,0|2,0,0]=3 1694 B7R1.18 CC(=O)C1CNC1 MCULE-3110609785 [0,0,0,0,1,0|2,0,0]=3 1695 B7R1.18 CC(=O)C1CNC1 MCULE-4112322251 [0,0,0,0,1,0|2,0,0]=3 1696 B7R1.18 CC(=O)C1COC1 MCULE-3416774210 [0,0,0,0,1,0|2,0,0]=3 1697 B7R1.18 CC(=O)N1CCC1 MCULE-6467100562 [0,0,0,0,1,0|2,0,0]=3 1698 B7R1.18 CC(N)C1CCC1 MCULE-1055775237 [0,0,0,0,1,0|2,0,1]=4 1699 B7R1.18 CC(N)C1CCC1 MCULE-4303681430 [0,0,0,0,1,0|2,0,1]=4 1700 B7R1.18 CC(O)C1CCC1 MCULE-7846963519 [0,0,0,0,1,0|1,0,1]=3 1701 B7R1.18 CC(O)C1CNC1 MCULE-1265886795 [0,0,0,0,1,0|2,0,1]=4 1702 B7R1.18 CC(O)C1CNC1 MCULE-5108259269 [0,0,0,0,1,0|2,0,1]=4 1703 B7R1.18 CC(O)C1CNC1 MCULE-8265279011 [0,0,0,0,1,0|2,0,1]=4 1704 B7R1.18 CC(O)C1COC1 MCULE-4981198639 [0,0,0,0,1,0|2,0,1]=4 1705 B7R1.18 CS(=O)C1CNC1 MCULE-1896314246 [0,0,0,0,1,0|3,0,0]=4 1706 B7R1.18 CS(=O)C1CNC1 MCULE-3655021594 [0,0,0,0,1,0|3,0,0]=4 1707 B7R1.18 C[C@@H](N)C1CCC1 MCULE-4670161237 [0,0,0,0,1,0|2,0,1]=4 1708 B7R1.18 C[C@@H](N)C1CCC1 MCULE-6520272933 [0,0,0,0,1,0|2,0,1]=4 1709 B7R1.18 C[C@@H](N)C1CCC1 MCULE-8342688572 [0,0,0,0,1,0|2,0,1]=4 1710 B7R1.18 C[C@@H](N)C1CCC1 MCULE-9076983662 [0,0,0,0,1,0|2,0,1]=4 1711 B7R1.18 C[C@@H](O)C1CCC1 MCULE-6990873960 [0,0,0,0,1,0|1,0,1]=3 1712 B7R1.18 C[C@@H](O)C1COC1 MCULE-5223611242 [0,0,0,0,1,0|2,0,1]=4 1713 B7R1.18 C[C@@H](O)C1COC1 MCULE-5819578881 [0,0,0,0,1,0|2,0,1]=4 1714 B7R1.18 C[C@H](N)C1CCC1 MCULE-2555280675 [0,0,0,0,1,0|2,0,1]=4 1715 B7R1.18 C[C@H](N)C1CCC1 MCULE-3888125434 [0,0,0,0,1,0|2,0,1]=4 1716 B7R1.18 C[C@H](N)C1CCC1 MCULE-6963105805 [0,0,0,0,1,0|2,0,1]=4 1717 B7R1.18 C[C@H](N)C1CCC1 MCULE-7483270694 [0,0,0,0,1,0|2,0,1]=4 1718 B7R1.18 C[C@H](O)C1CCC1 MCULE-5072123772 [0,0,0,0,1,0|1,0,1]=3 1719 B7R1.18 C[C@H](O)C1CCC1 MCULE-6701623925 [0,0,0,0,1,0|1,0,1]=3 1720 B7R1.18 C[C@H](O)C1CNC1 MCULE-4694154501 [0,0,0,0,1,0|2,0,1]=4 1721 B7R1.18 C[C@H](O)C1CNC1 MCULE-5870270724 [0,0,0,0,1,0|2,0,1]=4 1722 B7R1.18 C[C@H](O)C1COC1 MCULE-1396791034 [0,0,0,0,1,0|2,0,1]=4 1723 B7R1.18 C[C@H](O)C1COC1 MCULE-8805369596 [0,0,0,0,1,0|2,0,1]=4 1724 B7R1.18 N=C(N)C1CCC1 MCULE-3470535674 [0,0,0,0,1,0|2,0,0]=3 1725 B7R1.18 N=C(N)C1CCC1 MCULE-4802517706 [0,0,0,0,1,0|2,0,0]=3 1726 B7R1.18 N=C(N)C1CCC1 MCULE-5858986439 [0,0,0,0,1,0|2,0,0]=3 1727 B7R1.18 N=C(N)C1CSC1 MCULE-6979629096 [0,0,0,0,1,0|3,0,0]=4 1728 B7R1.18 N=C(N)C1CSC1 MCULE-8561937098 [0,0,0,0,1,0|3,0,0]=4 1729 B7R1.18 NC(=O)C1CCC1 MCULE-5151176129 [0,0,0,0,1,0|1,0,0]=2 1730 B7R1.18 NC(=O)C1CCN1 MCULE-1856696035 [0,0,0,0,1,0|2,0,0]=3 1731 B7R1.18 NC(=O)C1CCN1 MCULE-5757704016 [0,0,0,0,1,0|2,0,0]=3 1732 B7R1.18 NC(=O)C1CNC1 MCULE-2319282799 [0,0,0,0,1,0|2,0,0]=3 1733 B7R1.18 NC(=O)C1CNC1 MCULE-4985073048 [0,0,0,0,1,0|2,0,0]=3 1734 B7R1.18 NC(=O)C1CNC1 MCULE-8796959516 [0,0,0,0,1,0|2,0,0]=3 1735 B7R1.18 NC(=O)C1COC1 MCULE-1077689713 [0,0,0,0,1,0|2,0,0]=3 1736 B7R1.18 NC(=O)N1CCC1 MCULE-1594728830 [0,0,0,0,1,0|2,0,0]=3 1737 B7R1.18 NC(=O)[C@H]1CCN1 MCULE-7187425143 [0,0,0,0,1,0|2,0,0]=3 1738 B7R1.18 NC(=S)C1CCC1 MCULE-9753547991 [0,0,0,0,1,0|1,1,0]=3 1739 B7R1.18 NC(=S)N1CCC1 MCULE-5688954257 [0,0,0,0,1,0|2,1,0]=4 1740 B7R1.18 O=C(Cl)C1CCC1 MCULE-2155859428 [0,0,0,0,1,0|1,0,0]=2 1741 B7R1.18 O=C(Cl)N1CCC1 MCULE-8313088104 [0,0,0,0,1,0|2,0,0]=3 1742 B7R1.18 O=C(O)C1=CCC1 MCULE-4244912351 [0,0,0,0,1,0|0,0,2]=3 1743 B7R1.18 O=C(O)C1CCC1 MCULE-2498509888 [0,0,0,0,1,0|0,0,0]=1 1744 B7R1.18 O=C(O)C1CCN1 MCULE-1336085891 [0,0,0,0,1,0|1,0,0]=2 1745 B7R1.18 O=C(O)C1CCN1 MCULE-6501890131 [0,0,0,0,1,0|1,0,0]=2 1746 B7R1.18 O=C(O)C1CCN1 MCULE-7647115314 [0,0,0,0,1,0|1,0,0]=2 1747 B7R1.18 O=C(O)C1CCO1 MCULE-6065911736 [0,0,0,0,1,0|0,0,0]=1 1748 B7R1.18 O=C(O)C1CCO1 MCULE-9296370119 [0,0,0,0,1,0|0,0,0]=1 1749 B7R1.18 O=C(O)C1CNC1 MCULE-2350328355 [0,0,0,0,1,0|1,0,0]=2 1750 B7R1.18 O=C(O)C1CNC1 MCULE-7890374869 [0,0,0,0,1,0|1,0,0]=2 1751 B7R1.18 O=C(O)C1COC1 MCULE-2530431165 [0,0,0,0,1,0|1,0,0]=2 1752 B7R1.18 O=C(O)C1CSC1 MCULE-4019152056 [0,0,0,0,1,0|1,0,0]=2 1753 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2126306157 [0,0,0,0,1,0|1,0,0]=2 1754 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2597576629 [0,0,0,0,1,0|1,0,0]=2 1755 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-6006656004 [0,0,0,0,1,0|1,0,0]=2 1756 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-7241612713 [0,0,0,0,1,0|1,0,0]=2 1757 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-5117442811 [0,0,0,0,1,0|0,0,0]=1 1758 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-8116248615 [0,0,0,0,1,0|0,0,0]=1 1759 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-3254184046 [0,0,0,0,1,0|1,0,0]=2 1760 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5162570273 [0,0,0,0,1,0|1,0,0]=2 1761 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5488052558 [0,0,0,0,1,0|1,0,0]=2 1762 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-8240936495 [0,0,0,0,1,0|1,0,0]=2 1763 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-5499247834 [0,0,0,0,1,0|0,0,0]=1 1764 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-7468207073 [0,0,0,0,1,0|0,0,0]=1 1765 B7R1.18 O=N(=O)C1CCC1 MCULE-1263563910 [0,0,0,0,1,0|1,0,1]=3 1766 B7R1.18 O=N(=O)C1COC1 MCULE-1243582303 [0,0,0,0,1,0|2,0,1]=4 1767 B7R1.18 O=S([O-])C1CCC1 MCULE-2181260614 [0,0,0,0,1,0|1,0,1]=3 1768 B7R1.18 O=S([O-])C1CCC1 MCULE-5691798035 [0,0,0,0,1,0|1,0,1]=3 1769 B7R1.18 OB(O)C1CCC1 MCULE-3574521261 [0,0,0,0,1,0|1,0,1]=3 1770 B9R1.6 C1(CC=CCC1)C(=O)O MCULE-7139174666 [0,0,0,0,0,1|1,0,1]=3 1771 B9R1.6 C1(CCCNC1)C(=O)N MCULE-1974021716 [0,0,0,0,0,1|2,0,0]=3 1772 B9R1.6 C1(CCCNC1)C(=O)N MCULE-3484822743 [0,0,0,0,0,1|2,0,0]=3 1773 B9R1.6 C1(CCCNC1)C(=O)O MCULE-5804171064 [0,0,0,0,0,1|1,0,0]=2 1774 B9R1.6 C1(CNCCN1)C(=O)O MCULE-2145678876 [0,0,0,0,0,1|1,0,0]=2 1775 B9R1.6 C1(CNCCN1)C(=O)O MCULE-9477513225 [0,0,0,0,0,1|1,0,0]=2 1776 B9R1.6 C1(COCCN1)C(=O)O MCULE-7653061162 [0,0,0,0,0,1|1,0,0]=2 1777 B9R1.6 C1(COCCN1)C(=O)O MCULE-8375563970 [0,0,0,0,0,1|1,0,0]=2 1778 B9R1.6 C=C(O)C1CNCCN1 MCULE-4032832858 [0,0,0,0,0,1|2,0,0]=3 1779 B9R1.6 C=C(O)C1CNCCN1 MCULE-7014741917 [0,0,0,0,0,1|2,0,0]=3 1780 B9R1.6 CC(=O)C1=CCCCC1 MCULE-9958324589 [0,0,0,0,0,1|2,0,1]=4 1781 B9R1.6 CC(=O)C1=NCCCC1 MCULE-8103583007 [0,0,0,0,0,1|2,0,1]=4 1782 B9R1.6 CC(=O)C1=NCCCC1 MCULE-8275418154 [0,0,0,0,0,1|2,0,1]=4 1783 B9R1.6 CC(=O)C1CCCCC1 MCULE-3582349091 [0,0,0,0,0,1|2,0,0]=3 1784 B9R1.6 CC(=O)C1CCCCN1 MCULE-2854776557 [0,0,0,0,0,1|2,0,0]=3 1785 B9R1.6 CC(=O)C1CCCCN1 MCULE-7483298696 [0,0,0,0,0,1|2,0,0]=3 1786 B9R1.6 CC(=O)C1CCCCO1 MCULE-6292051941 [0,0,0,0,0,1|1,0,0]=2 1787 B9R1.6 CC(=O)C1CCCNC1 MCULE-5048287619 [0,0,0,0,0,1|2,0,0]=3 1788 B9R1.6 CC(=O)C1CCCNC1 MCULE-7308448482 [0,0,0,0,0,1|2,0,0]=3 1789 B9R1.6 CC(=O)C1CCCOC1 MCULE-8355092375 [0,0,0,0,0,1|1,0,0]=2 1790 B9R1.6 CC(=O)C1CCNCC1 MCULE-5629644359 [0,0,0,0,0,1|2,0,0]=3 1791 B9R1.6 CC(=O)C1CCNCC1 MCULE-7994490746 [0,0,0,0,0,1|2,0,0]=3 1792 B9R1.6 CC(=O)C1CCOCC1 MCULE-4829713073 [0,0,0,0,0,1|2,0,0]=3 1793 B9R1.6 CC(=O)C1CCSCC1 MCULE-1825777359 [0,0,0,0,0,1|2,0,0]=3 1794 B9R1.6 CC(=O)C1CNCCO1 MCULE-1332213026 [0,0,0,0,0,1|1,0,0]=2 1795 B9R1.6 CC(=O)C1CNCCO1 MCULE-8599628301 [0,0,0,0,0,1|1,0,0]=2 1796 B9R1.6 CC(=O)C1COCCO1 MCULE-5168266299 [0,0,0,0,0,1|1,0,0]=2 1797 B9R1.6 CC(=O)N1CCCCC1 MCULE-2376049669 [0,0,0,0,0,1|3,0,0]=4 1798 B9R1.6 CC(=O)N1CCCNC1 MCULE-1504945403 [0,0,0,0,0,1|3,0,0]=4 1799 B9R1.6 CC(=O)N1CCNCC1 MCULE-6090938298 [0,0,0,0,0,1|3,0,0]=4 1800 B9R1.6 CC(=O)N1CCNCC1 MCULE-6273641444 [0,0,0,0,0,1|3,0,0]=4 1801 B9R1.6 CC(=O)N1CCOCC1 MCULE-8135519320 [0,0,0,0,0,1|3,0,0]=4 1802 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-6225629414 [0,0,0,0,0,1|2,0,0]=3 1803 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-9308955565 [0,0,0,0,0,1|2,0,0]=3 1804 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6405789728 [0,0,0,0,0,1|2,0,0]=3 1805 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6966774576 [0,0,0,0,0,1|2,0,0]=3 1806 B9R1.6 CC(C)C1CNCCO1 MCULE-1548709816 [0,0,0,0,0,1|2,0,1]=4 1807 B9R1.6 CC(C)C1CNCCO1 MCULE-3698866028 [0,0,0,0,0,1|2,0,1]=4 1808 B9R1.6 CC(C)C1OCCCO1 MCULE-5024002070 [0,0,0,0,0,1|2,0,1]=4 1809 B9R1.6 CC(C)[C@@H]1CNCCO1 MCULE-4730564774 [0,0,0,0,0,1|2,0,1]=4 1810 B9R1.6 CC(C)[C@@H]1CNCCO1 MCULE-6895424671 [0,0,0,0,0,1|2,0,1]=4 1811 B9R1.6 CC(C)[C@H]1CNCCO1 MCULE-6888809992 [0,0,0,0,0,1|2,0,1]=4 1812 B9R1.6 CC(C)[C@H]1CNCCO1 MCULE-8313613560 [0,0,0,0,0,1|2,0,1]=4 1813 B9R1.6 CC(N)C1CCCCO1 MCULE-8387374309 [0,0,0,0,0,1|2,0,1]=4 1814 B9R1.6 CC(N)C1CCCCO1 MCULE-9971513933 [0,0,0,0,0,1|2,0,1]=4 1815 B9R1.6 CC(O)C1CCCCC1 MCULE-5078012753 [0,0,0,0,0,1|2,0,1]=4 1816 B9R1.6 CC(O)C1CCCCN1 MCULE-2559324365 [0,0,0,0,0,1|2,0,1]=4 1817 B9R1.6 CC(O)C1CCCNC1 MCULE-2671166499 [0,0,0,0,0,1|2,0,1]=4 1818 B9R1.6 CC(O)C1CCCNC1 MCULE-3528761801 [0,0,0,0,0,1|2,0,1]=4 1819 B9R1.6 CC(O)C1CCNCC1 MCULE-4584203332 [0,0,0,0,0,1|2,0,1]=4 1820 B9R1.6 CC(O)C1CCNCC1 MCULE-5499145407 [0,0,0,0,0,1|2,0,1]=4 1821 B9R1.6 CC(O)C1CCNCC1 MCULE-6172957789 [0,0,0,0,0,1|2,0,1]=4 1822 B9R1.6 CC(O)C1CCNCC1 MCULE-9287143291 [0,0,0,0,0,1|2,0,1]=4 1823 B9R1.6 CC(O)C1CCOCC1 MCULE-9618372743 [0,0,0,0,0,1|2,0,1]=4 1824 B9R1.6 CC(O)C1CNCCN1 MCULE-7562437820 [0,0,0,0,0,1|2,0,1]=4 1825 B9R1.6 CC(O)C1CNCCO1 MCULE-5611108274 [0,0,0,0,0,1|1,0,1]=3 1826 B9R1.6 CN(C)C1CCCCO1 MCULE-4888978458 [0,0,0,0,0,1|3,0,0]=4 1827 B9R1.6 CN(C)C1COCCO1 MCULE-3622801400 [0,0,0,0,0,1|3,0,0]=4 1828 B9R1.6 CN(C)C1COCCO1 MCULE-5184407422 [0,0,0,0,0,1|3,0,0]=4 1829 B9R1.6 CS(=O)C1CCCCC1 MCULE-4263908685 [0,0,0,0,0,1|3,0,0]=4 1830 B9R1.6 C[C@@H](N)C1CCCCO1 MCULE-3320469003 [0,0,0,0,0,1|2,0,1]=4 1831 B9R1.6 C[C@@H](N)C1CCCCO1 MCULE-9895193081 [0,0,0,0,0,1|2,0,1]=4 1832 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-4304404236 [0,0,0,0,0,1|2,0,1]=4 1833 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-7854211857 [0,0,0,0,0,1|2,0,1]=4 1834 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-1752623068 [0,0,0,0,0,1|2,0,1]=4 1835 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-2316047131 [0,0,0,0,0,1|2,0,1]=4 1836 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-9451593770 [0,0,0,0,0,1|2,0,1]=4 1837 B9R1.6 C[C@@H](O)C1CCOCC1 MCULE-1246138653 [0,0,0,0,0,1|2,0,1]=4 1838 B9R1.6 C[C@@H](O)C1CCOCC1 MCULE-5178620559 [0,0,0,0,0,1|2,0,1]=4 1839 B9R1.6 C[C@@H](O)[C@H]1CNCCN1 MCULE-2168214783 [0,0,0,0,0,1|2,0,1]=4 1840 B9R1.6 C[C@@H](O)[C@H]1CNCCN1 MCULE-8290718551 [0,0,0,0,0,1|2,0,1]=4 1841 B9R1.6 C[C@H](O)C1CCCCC1 MCULE-9702860419 [0,0,0,0,0,1|2,0,1]=4 1842 B9R1.6 C[C@H](O)C1CCNCC1 MCULE-2198012011 [0,0,0,0,0,1|2,0,1]=4 1843 B9R1.6 C[C@H](O)C1CCNCC1 MCULE-7131345979 [0,0,0,0,0,1|2,0,1]=4 1844 B9R1.6 C[C@H](O)C1CCOCC1 MCULE-4135856134 [0,0,0,0,0,1|2,0,1]=4 1845 B9R1.6 FC(F)C1CNCCO1 MCULE-3085847203 [0,0,0,0,0,1|2,0,1]=4 1846 B9R1.6 FC(F)C1CNCCO1 MCULE-7955903734 [0,0,0,0,0,1|2,0,1]=4 1847 B9R1.6 N=C(N)C1CCCCC1 MCULE-3107787417 [0,0,0,0,0,1|3,0,0]=4 1848 B9R1.6 N=C(N)C1CCCCC1 MCULE-9030561972 [0,0,0,0,0,1|3,0,0]=4 1849 B9R1.6 N=C(N)C1CCCCN1 MCULE-3219883116 [0,0,0,0,0,1|3,0,0]=4 1850 B9R1.6 N=C(N)C1CCCCN1 MCULE-8067475683 [0,0,0,0,0,1|3,0,0]=4 1851 B9R1.6 N=C(N)C1CCCNC1 MCULE-1952956995 [0,0,0,0,0,1|3,0,0]=4 1852 B9R1.6 N=C(N)C1CCCNC1 MCULE-5965162460 [0,0,0,0,0,1|3,0,0]=4 1853 B9R1.6 N=C(N)C1CCNCC1 MCULE-5469691156 [0,0,0,0,0,1|3,0,0]=4 1854 B9R1.6 N=C(N)C1CCNCC1 MCULE-5841148719 [0,0,0,0,0,1|3,0,0]=4 1855 B9R1.6 N=C(N)C1CCOCC1 MCULE-5311101584 [0,0,0,0,0,1|3,0,0]=4 1856 B9R1.6 N=C(N)C1CCOCC1 MCULE-9918917702 [0,0,0,0,0,1|3,0,0]=4 1857 B9R1.6 NC(=O)C1=CNCCC1 MCULE-5396085408 [0,0,0,0,0,1|2,0,1]=4 1858 B9R1.6 NC(=O)C1=COCCC1 MCULE-1179770781 [0,0,0,0,0,1|1,0,1]=3 1859 B9R1.6 NC(=O)C1CC=CCC1 MCULE-5613786218 [0,0,0,0,0,1|2,0,1]=4 1860 B9R1.6 NC(=O)C1CCCCC1 MCULE-8611311863 [0,0,0,0,0,1|2,0,0]=3 1861 B9R1.6 NC(=O)C1CCCCN1 MCULE-2544126054 [0,0,0,0,0,1|2,0,0]=3 1862 B9R1.6 NC(=O)C1CCCCN1 MCULE-6661716686 [0,0,0,0,0,1|2,0,0]=3 1863 B9R1.6 NC(=O)C1CCCNC1 MCULE-1833696438 [0,0,0,0,0,1|2,0,0]=3 1864 B9R1.6 NC(=O)C1CCCNC1 MCULE-5902080067 [0,0,0,0,0,1|2,0,0]=3 1865 B9R1.6 NC(=O)C1CCCOC1 MCULE-3754898627 [0,0,0,0,0,1|1,0,0]=2 1866 B9R1.6 NC(=O)C1CCNCC1 MCULE-8206211805 [0,0,0,0,0,1|2,0,0]=3 1867 B9R1.6 NC(=O)C1CCNCC1 MCULE-8840746533 [0,0,0,0,0,1|2,0,0]=3 1868 B9R1.6 NC(=O)C1CCOCC1 MCULE-1626473774 [0,0,0,0,0,1|2,0,0]=3 1869 B9R1.6 NC(=O)C1CNCCN1 MCULE-6032361805 [0,0,0,0,0,1|2,0,0]=3 1870 B9R1.6 NC(=O)C1CNCCN1 MCULE-7459621704 [0,0,0,0,0,1|2,0,0]=3 1871 B9R1.6 NC(=O)C1CNCCO1 MCULE-7045289444 [0,0,0,0,0,1|1,0,0]=2 1872 B9R1.6 NC(=O)C1CNCCO1 MCULE-8403360257 [0,0,0,0,0,1|1,0,0]=2 1873 B9R1.6 NC(=O)C1CNCCO1 MCULE-8477654103 [0,0,0,0,0,1|1,0,0]=2 1874 B9R1.6 NC(=O)C1COCCN1 MCULE-3997305592 [0,0,0,0,0,1|2,0,0]=3 1875 B9R1.6 NC(=O)C1COCCN1 MCULE-8679226087 [0,0,0,0,0,1|2,0,0]=3 1876 B9R1.6 NC(=O)C1CSCCN1 MCULE-5519659168 [0,0,0,0,0,1|2,0,0]=3 1877 B9R1.6 NC(=O)N1CCCCC1 MCULE-9935688246 [0,0,0,0,0,1|3,0,0]=4 1878 B9R1.6 NC(=O)N1CCNCC1 MCULE-2703076090 [0,0,0,0,0,1|3,0,0]=4 1879 B9R1.6 NC(=O)N1CCNCC1 MCULE-9778565861 [0,0,0,0,0,1|3,0,0]=4 1880 B9R1.6 NC(=O)N1CCOCC1 MCULE-2181195591 [0,0,0,0,0,1|3,0,0]=4 1881 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-1302948446 [0,0,0,0,0,1|2,0,0]=3 1882 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-3790099707 [0,0,0,0,0,1|2,0,0]=3 1883 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-4105759578 [0,0,0,0,0,1|2,0,0]=3 1884 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-6022899132 [0,0,0,0,0,1|2,0,0]=3 1885 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-3203472135 [0,0,0,0,0,1|2,0,0]=3 1886 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-3866777440 [0,0,0,0,0,1|2,0,0]=3 1887 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-6105431602 [0,0,0,0,0,1|2,0,0]=3 1888 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-7727900968 [0,0,0,0,0,1|2,0,0]=3 1889 B9R1.6 NC(=O)[C@H]1CCCCN1 MCULE-5554529404 [0,0,0,0,0,1|2,0,0]=3 1890 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-3568267883 [0,0,0,0,0,1|2,0,0]=3 1891 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-6403292667 [0,0,0,0,0,1|2,0,0]=3 1892 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-7433087477 [0,0,0,0,0,1|2,0,0]=3 1893 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-9069766695 [0,0,0,0,0,1|2,0,0]=3 1894 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-1527418805 [0,0,0,0,0,1|2,0,0]=3 1895 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-6529490056 [0,0,0,0,0,1|2,0,0]=3 1896 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-9894216692 [0,0,0,0,0,1|2,0,0]=3 1897 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-1904729907 [0,0,0,0,0,1|2,0,0]=3 1898 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-7069433109 [0,0,0,0,0,1|2,0,0]=3 1899 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-7970834070 [0,0,0,0,0,1|2,0,0]=3 1900 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-9117686776 [0,0,0,0,0,1|2,0,0]=3 1901 B9R1.6 NC(=S)C1CCCCC1 MCULE-8109334870 [0,0,0,0,0,1|2,1,0]=4 1902 B9R1.6 NC(=S)C1CCCOC1 MCULE-7147213341 [0,0,0,0,0,1|1,1,0]=3 1903 B9R1.6 NC(=S)C1CCNCC1 MCULE-6109847413 [0,0,0,0,0,1|2,1,0]=4 1904 B9R1.6 NC(=S)C1CCOCC1 MCULE-6355388595 [0,0,0,0,0,1|2,1,0]=4 1905 B9R1.6 NC(=S)C1CSCCS1 MCULE-2847991371 [0,0,0,0,0,1|1,2,0]=4 1906 B9R1.6 O=C(Cl)C1=CCCCC1 MCULE-8228686007 [0,0,0,0,0,1|2,0,1]=4 1907 B9R1.6 O=C(Cl)C1=CCOCC1 MCULE-9144118947 [0,0,0,0,0,1|2,0,1]=4 1908 B9R1.6 O=C(Cl)C1=COCCO1 MCULE-9393230121 [0,0,0,0,0,1|1,0,2]=4 1909 B9R1.6 O=C(Cl)C1CC=CCC1 MCULE-2173469232 [0,0,0,0,0,1|2,0,1]=4 1910 B9R1.6 O=C(Cl)C1CCCCC1 MCULE-5867897390 [0,0,0,0,0,1|2,0,0]=3 1911 B9R1.6 O=C(Cl)C1CCCCO1 MCULE-2871405989 [0,0,0,0,0,1|1,0,0]=2 1912 B9R1.6 O=C(Cl)C1CCNCC1 MCULE-6549888109 [0,0,0,0,0,1|2,0,0]=3 1913 B9R1.6 O=C(Cl)C1CCNCC1 MCULE-7154842850 [0,0,0,0,0,1|2,0,0]=3 1914 B9R1.6 O=C(Cl)C1CCOCC1 MCULE-5435965006 [0,0,0,0,0,1|2,0,0]=3 1915 B9R1.6 O=C(Cl)C1CCSCC1 MCULE-2089111376 [0,0,0,0,0,1|2,0,0]=3 1916 B9R1.6 O=C(Cl)N1CCCCC1 MCULE-8197895576 [0,0,0,0,0,1|3,0,0]=4 1917 B9R1.6 O=C(Cl)N1CCOCC1 MCULE-6303586319 [0,0,0,0,0,1|3,0,0]=4 1918 B9R1.6 O=C(Cl)N1CCSCC1 MCULE-7153763312 [0,0,0,0,0,1|3,0,0]=4 1919 B9R1.6 O=C(F)N1CCNCC1 MCULE-3929907191 [0,0,0,0,0,1|3,0,0]=4 1920 B9R1.6 O=C(F)N1CCNCC1 MCULE-8030550291 [0,0,0,0,0,1|3,0,0]=4 1921 B9R1.6 O=C(O)C1=CCCCC1 MCULE-1482472372 [0,0,0,0,0,1|1,0,1]=3 1922 B9R1.6 O=C(O)C1=CCCCO1 MCULE-8158964792 [0,0,0,0,0,1|0,0,1]=2 1923 B9R1.6 O=C(O)C1=CCCNC1 MCULE-7878143035 [0,0,0,0,0,1|1,0,1]=3 1924 B9R1.6 O=C(O)C1=CCCNC1 MCULE-9382105537 [0,0,0,0,0,1|1,0,1]=3 1925 B9R1.6 O=C(O)C1=CCCOC1 MCULE-4597846034 [0,0,0,0,0,1|0,0,2]=3 1926 B9R1.6 O=C(O)C1=CCCSC1 MCULE-6991730217 [0,0,0,0,0,1|1,0,1]=3 1927 B9R1.6 O=C(O)C1=CCNCC1 MCULE-7813592729 [0,0,0,0,0,1|1,0,1]=3 1928 B9R1.6 O=C(O)C1=CCNCC1 MCULE-9446043448 [0,0,0,0,0,1|1,0,1]=3 1929 B9R1.6 O=C(O)C1=CCOCC1 MCULE-8602474600 [0,0,0,0,0,1|1,0,1]=3 1930 B9R1.6 O=C(O)C1=COCCC1 MCULE-4203786677 [0,0,0,0,0,1|0,0,1]=2 1931 B9R1.6 O=C(O)C1=COCCO1 MCULE-9406944236 [0,0,0,0,0,1|0,0,2]=3 1932 B9R1.6 O=C(O)C1=NNCCC1 MCULE-7500831474 [0,0,0,0,0,1|1,0,1]=3 1933 B9R1.6 O=C(O)C1C=CCC=C1 MCULE-1209088345 [0,0,0,0,0,1|1,0,2]=4 1934 B9R1.6 O=C(O)C1C=CCCC1 MCULE-7827178223 [0,0,0,0,0,1|1,0,0]=2 1935 B9R1.6 O=C(O)C1CC=CCC1 MCULE-6262725586 [0,0,0,0,0,1|1,0,1]=3 1936 B9R1.6 O=C(O)C1CC=CCO1 MCULE-5751437850 [0,0,0,0,0,1|0,0,1]=2 1937 B9R1.6 O=C(O)C1CCC=CO1 MCULE-6447977583 [0,0,0,0,0,1|0,0,1]=2 1938 B9R1.6 O=C(O)C1CCCCC1 MCULE-2193918964 [0,0,0,0,0,1|1,0,0]=2 1939 B9R1.6 O=C(O)C1CCCCN1 MCULE-3485439173 [0,0,0,0,0,1|1,0,0]=2 1940 B9R1.6 O=C(O)C1CCCCN1 MCULE-4576094783 [0,0,0,0,0,1|1,0,0]=2 1941 B9R1.6 O=C(O)C1CCCCN1 MCULE-4851525706 [0,0,0,0,0,1|1,0,0]=2 1942 B9R1.6 O=C(O)C1CCCCN1 MCULE-6801625058 [0,0,0,0,0,1|1,0,0]=2 1943 B9R1.6 O=C(O)C1CCCCO1 MCULE-8947688342 [0,0,0,0,0,1|0,0,0]=1 1944 B9R1.6 O=C(O)C1CCCCS1 MCULE-6466357833 [0,0,0,0,0,1|0,1,0]=2 1945 B9R1.6 O=C(O)C1CCCNC1 MCULE-3189529983 [0,0,0,0,0,1|1,0,0]=2 1946 B9R1.6 O=C(O)C1CCCNC1 MCULE-5698100100 [0,0,0,0,0,1|1,0,0]=2 1947 B9R1.6 O=C(O)C1CCCNC1 MCULE-9486003126 [0,0,0,0,0,1|1,0,0]=2 1948 B9R1.6 O=C(O)C1CCCNN1 MCULE-1480488255 [0,0,0,0,0,1|1,0,0]=2 1949 B9R1.6 O=C(O)C1CCCNN1 MCULE-3054116225 [0,0,0,0,0,1|1,0,0]=2 1950 B9R1.6 O=C(O)C1CCCOC1 MCULE-3431951803 [0,0,0,0,0,1|0,0,0]=1 1951 B9R1.6 O=C(O)C1CCCSC1 MCULE-1777528306 [0,0,0,0,0,1|0,1,0]=2 1952 B9R1.6 O=C(O)C1CCNCC1 MCULE-5699874022 [0,0,0,0,0,1|1,0,0]=2 1953 B9R1.6 O=C(O)C1CCNCC1 MCULE-7477545245 [0,0,0,0,0,1|1,0,0]=2 1954 B9R1.6 O=C(O)C1CCOCC1 MCULE-4725122837 [0,0,0,0,0,1|1,0,0]=2 1955 B9R1.6 O=C(O)C1CCOCN1 MCULE-2724570105 [0,0,0,0,0,1|1,0,0]=2 1956 B9R1.6 O=C(O)C1CCOCN1 MCULE-7891527992 [0,0,0,0,0,1|1,0,0]=2 1957 B9R1.6 O=C(O)C1CCSCC1 MCULE-5031108601 [0,0,0,0,0,1|1,0,0]=2 1958 B9R1.6 O=C(O)C1CCSCN1 MCULE-7351632016 [0,0,0,0,0,1|1,0,0]=2 1959 B9R1.6 O=C(O)C1CCSCN1 MCULE-7786919982 [0,0,0,0,0,1|1,0,0]=2 1960 B9R1.6 O=C(O)C1CNCCN1 MCULE-2689074129 [0,0,0,0,0,1|1,0,0]=2 1961 B9R1.6 O=C(O)C1CNCCN1 MCULE-4697614875 [0,0,0,0,0,1|1,0,0]=2 1962 B9R1.6 O=C(O)C1CNCCN1 MCULE-7015381558 [0,0,0,0,0,1|1,0,0]=2 1963 B9R1.6 O=C(O)C1CNCCO1 MCULE-1106448255 [0,0,0,0,0,1|0,0,0]=1 1964 B9R1.6 O=C(O)C1CNCCO1 MCULE-5402647836 [0,0,0,0,0,1|0,0,0]=1 1965 B9R1.6 O=C(O)C1CNCCO1 MCULE-5647993069 [0,0,0,0,0,1|0,0,0]=1 1966 B9R1.6 O=C(O)C1CNCCO1 MCULE-6949638629 [0,0,0,0,0,1|0,0,0]=1 1967 B9R1.6 O=C(O)C1CNCCS1 MCULE-3981762124 [0,0,0,0,0,1|0,1,0]=2 1968 B9R1.6 O=C(O)C1CNCCS1 MCULE-4631923202 [0,0,0,0,0,1|0,1,0]=2 1969 B9R1.6 O=C(O)C1COCCN1 MCULE-2235592409 [0,0,0,0,0,1|1,0,0]=2 1970 B9R1.6 O=C(O)C1COCCN1 MCULE-6865044459 [0,0,0,0,0,1|1,0,0]=2 1971 B9R1.6 O=C(O)C1COCCO1 MCULE-3887767361 [0,0,0,0,0,1|0,0,0]=1 1972 B9R1.6 O=C(O)C1COCCO1 MCULE-6027603960 [0,0,0,0,0,1|0,0,0]=1 1973 B9R1.6 O=C(O)C1COCOC1 MCULE-4867087023 [0,0,0,0,0,1|1,0,0]=2 1974 B9R1.6 O=C(O)C1CSCCN1 MCULE-4003309722 [0,0,0,0,0,1|1,0,0]=2 1975 B9R1.6 O=C(O)C1CSCCN1 MCULE-5519716572 [0,0,0,0,0,1|1,0,0]=2 1976 B9R1.6 O=C(O)C1CSCCS1 MCULE-6267524662 [0,0,0,0,0,1|0,1,0]=2 1977 B9R1.6 O=C(O)C1NCCCS1 MCULE-7316372918 [0,0,0,0,0,1|0,1,0]=2 1978 B9R1.6 O=C(O)C1OCCCO1 MCULE-6505925267 [0,0,0,0,0,1|0,0,0]=1 1979 B9R1.6 O=C(O)C1SCCCS1 MCULE-6447130734 [0,0,0,0,0,1|0,1,0]=2 1980 B9R1.6 O=C(O)C1SCSCS1 MCULE-6847986458 [0,0,0,0,0,1|1,1,0]=3 1981 B9R1.6 O=C(O)N1CCCCC1 MCULE-2727154893 [0,0,0,0,0,1|2,0,0]=3 1982 B9R1.6 O=C(O)N1CCCCC1 MCULE-4559010344 [0,0,0,0,0,1|2,0,0]=3 1983 B9R1.6 O=C(O)N1CCNCC1 MCULE-3508385346 [0,0,0,0,0,1|2,0,0]=3 1984 B9R1.6 O=C(O)N1CCOCC1 MCULE-7938310937 [0,0,0,0,0,1|2,0,0]=3 1985 B9R1.6 O=C(O)N1CCSCC1 MCULE-4867596495 [0,0,0,0,0,1|2,0,0]=3 1986 B9R1.6 O=C(O)[C@@H]1CC=CCC1 MCULE-1597942572 [0,0,0,0,0,1|1,0,1]=3 1987 B9R1.6 O=C(O)[C@@H]1CC=CCC1 MCULE-6215840629 [0,0,0,0,0,1|1,0,1]=3 1988 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-3257537289 [0,0,0,0,0,1|1,0,0]=2 1989 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-7236775885 [0,0,0,0,0,1|1,0,0]=2 1990 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-8859089797 [0,0,0,0,0,1|1,0,0]=2 1991 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-9674307172 [0,0,0,0,0,1|1,0,0]=2 1992 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-4995364653 [0,0,0,0,0,1|0,0,0]=1 1993 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-8767901302 [0,0,0,0,0,1|0,0,0]=1 1994 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-3206278693 [0,0,0,0,0,1|1,0,0]=2 1995 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-5509362549 [0,0,0,0,0,1|1,0,0]=2 1996 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-8357747886 [0,0,0,0,0,1|1,0,0]=2 1997 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-9156802088 [0,0,0,0,0,1|1,0,0]=2 1998 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-1404699605 [0,0,0,0,0,1|1,0,0]=2 1999 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-4463982289 [0,0,0,0,0,1|1,0,0]=2 2000 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-6113826647 [0,0,0,0,0,1|1,0,0]=2 2001 B9R1.6 O=C(O)[C@@H]1CCCOC1 MCULE-8270310960 [0,0,0,0,0,1|0,0,0]=1 2002 B9R1.6 O=C(O)[C@@H]1CCCOC1 MCULE-9211958407 [0,0,0,0,0,1|0,0,0]=1 2003 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-2545046706 [0,0,0,0,0,1|1,0,0]=2 2004 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-5694807182 [0,0,0,0,0,1|1,0,0]=2 2005 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-7177432982 [0,0,0,0,0,1|1,0,0]=2 2006 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-7413709257 [0,0,0,0,0,1|1,0,0]=2 2007 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-3078161658 [0,0,0,0,0,1|0,0,0]=1 2008 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-4550123668 [0,0,0,0,0,1|0,0,0]=1 2009 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7218215777 [0,0,0,0,0,1|0,0,0]=1 2010 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7983160968 [0,0,0,0,0,1|0,0,0]=1 2011 B9R1.6 O=C(O)[C@@H]1CNCCS1 MCULE-6650545170 [0,0,0,0,0,1|0,1,0]=2 2012 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-1789021231 [0,0,0,0,0,1|1,0,0]=2 2013 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-4026574279 [0,0,0,0,0,1|1,0,0]=2 2014 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-7736477261 [0,0,0,0,0,1|1,0,0]=2 2015 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-8166049277 [0,0,0,0,0,1|1,0,0]=2 2016 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-3560012987 [0,0,0,0,0,1|0,0,0]=1 2017 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-8883141087 [0,0,0,0,0,1|0,0,0]=1 2018 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-3905601111 [0,0,0,0,0,1|1,0,0]=2 2019 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-9668825603 [0,0,0,0,0,1|1,0,0]=2 2020 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-9675980130 [0,0,0,0,0,1|1,0,0]=2 2021 B9R1.6 O=C(O)[C@H]1CC=CCC1 MCULE-5009469360 [0,0,0,0,0,1|1,0,1]=3 2022 B9R1.6 O=C(O)[C@H]1CC=CCC1 MCULE-9797420475 [0,0,0,0,0,1|1,0,1]=3 2023 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8281618311 [0,0,0,0,0,1|1,0,0]=2 2024 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8486513131 [0,0,0,0,0,1|1,0,0]=2 2025 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9333123477 [0,0,0,0,0,1|1,0,0]=2 2026 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9786740249 [0,0,0,0,0,1|1,0,0]=2 2027 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-2856988466 [0,0,0,0,0,1|0,0,0]=1 2028 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-8960602925 [0,0,0,0,0,1|0,0,0]=1 2029 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-5644771403 [0,0,0,0,0,1|1,0,0]=2 2030 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-6473613352 [0,0,0,0,0,1|1,0,0]=2 2031 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-7395918259 [0,0,0,0,0,1|1,0,0]=2 2032 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-8202628107 [0,0,0,0,0,1|1,0,0]=2 2033 B9R1.6 O=C(O)[C@H]1CCCNN1 MCULE-5460978548 [0,0,0,0,0,1|1,0,0]=2 2034 B9R1.6 O=C(O)[C@H]1CCCNN1 MCULE-6296084302 [0,0,0,0,0,1|1,0,0]=2 2035 B9R1.6 O=C(O)[C@H]1CCCOC1 MCULE-3913162278 [0,0,0,0,0,1|0,0,0]=1 2036 B9R1.6 O=C(O)[C@H]1CCCOC1 MCULE-4021468329 [0,0,0,0,0,1|0,0,0]=1 2037 B9R1.6 O=C(O)[C@H]1CCCSC1 MCULE-1373166628 [0,0,0,0,0,1|0,1,0]=2 2038 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-2073761586 [0,0,0,0,0,1|1,0,0]=2 2039 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-3099021896 [0,0,0,0,0,1|1,0,0]=2 2040 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-5862899979 [0,0,0,0,0,1|1,0,0]=2 2041 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-8591926633 [0,0,0,0,0,1|1,0,0]=2 2042 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-9781518658 [0,0,0,0,0,1|1,0,0]=2 2043 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-1051281674 [0,0,0,0,0,1|0,0,0]=1 2044 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-2477891803 [0,0,0,0,0,1|0,0,0]=1 2045 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-5182952887 [0,0,0,0,0,1|0,0,0]=1 2046 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-6051376580 [0,0,0,0,0,1|0,0,0]=1 2047 B9R1.6 O=C(O)[C@H]1CNCCS1 MCULE-7818958113 [0,0,0,0,0,1|0,1,0]=2 2048 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-2388461804 [0,0,0,0,0,1|1,0,0]=2 2049 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-3810653827 [0,0,0,0,0,1|1,0,0]=2 2050 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-6589310258 [0,0,0,0,0,1|1,0,0]=2 2051 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-9158991594 [0,0,0,0,0,1|1,0,0]=2 2052 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-6591475838 [0,0,0,0,0,1|0,0,0]=1 2053 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-9849453248 [0,0,0,0,0,1|0,0,0]=1 2054 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-2174373928 [0,0,0,0,0,1|1,0,0]=2 2055 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-5936347595 [0,0,0,0,0,1|1,0,0]=2 2056 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-8464504119 [0,0,0,0,0,1|1,0,0]=2 2057 B9R1.6 O=C([O-])C1CCC=CO1 MCULE-8478897142 [0,0,0,0,0,1|0,0,2]=3 2058 B9R1.6 O=C([O-])C1CCCCC1 MCULE-2430887278 [0,0,0,0,0,1|1,0,1]=3 2059 B9R1.6 O=C([O-])C1CCCCN1 MCULE-2358540296 [0,0,0,0,0,1|1,0,1]=3 2060 B9R1.6 O=N(=O)C1CCCCC1 MCULE-6198799449 [0,0,0,0,0,1|2,0,1]=4 2061 B9R1.6 O=N(=O)C1CCNCC1 MCULE-1396847158 [0,0,0,0,0,1|2,0,1]=4 2062 B9R1.6 O=N(=O)C1CCNCC1 MCULE-2863786986 [0,0,0,0,0,1|2,0,1]=4 2063 B9R1.6 O=N(=O)C1CCOCC1 MCULE-8523674594 [0,0,0,0,0,1|2,0,1]=4 2064 B9R1.6 O=S(O)C1CCCCC1 MCULE-2447383910 [0,0,0,0,0,1|2,0,0]=3 2065 B9R1.6 O=S([O-])C1CCCCC1 MCULE-4340070525 [0,0,0,0,0,1|2,0,1]=4 2066 B9R1.6 O=S([O-])C1CCOCC1 MCULE-4319852593 [0,0,0,0,0,1|2,0,1]=4 2067 B9R1.6 O=S([O-])C1CCOCC1 MCULE-7056046306 [0,0,0,0,0,1|2,0,1]=4 2068 B9R1.6 OB(O)C1CCCCC1 MCULE-7463281328 [0,0,0,0,0,1|2,0,1]=4 2069 B9R1.6 OB(O)C1CCCNC1 MCULE-9145993336 [0,0,0,0,0,1|2,0,1]=4 2070 B9R1.6 OB(O)C1CCCOC1 MCULE-5502913518 [0,0,0,0,0,1|1,0,1]=3 2071 B9R1.6 OB(O)C1CCNCC1 MCULE-6477872801 [0,0,0,0,0,1|2,0,1]=4 2072 B9R1.6 OB(O)C1CCNCC1 MCULE-6629356175 [0,0,0,0,0,1|2,0,1]=4 2073 B9R1.6 OB(O)C1CCOCC1 MCULE-5917553399 [0,0,0,0,0,1|2,0,1]=4 2074 B9R1.6 [C@H]1(CSCCN1)C(=O)O MCULE-2592294388 [0,0,0,0,0,1|1,0,0]=2 2075 B9R1.13 C1(CCCN1)CC(=O)O MCULE-3743402418 [0,0,0,0,0,1|1,0,0]=2 2076 B9R1.13 C1(CCCN1)CC(=O)O MCULE-9966702869 [0,0,0,0,0,1|1,0,0]=2 2077 B9R1.13 C1(CCNC1)CC(=O)O MCULE-7279534621 [0,0,0,0,0,1|2,0,0]=3 2078 B9R1.13 C1(CCNC1)NC(=O)C MCULE-3187971747 [0,0,0,0,0,1|3,0,0]=4 2079 B9R1.13 C1(CCNC1)NC(=O)C MCULE-5477008391 [0,0,0,0,0,1|3,0,0]=4 2080 B9R1.13 CC(=O)C=C1CCCC1 MCULE-1647139252 [0,0,0,0,0,1|2,0,1]=4 2081 B9R1.13 CC(=O)CC1C=CCC1 MCULE-6918580278 [0,0,0,0,0,1|2,0,1]=4 2082 B9R1.13 CC(=O)CC1CCCC1 MCULE-5830536761 [0,0,0,0,0,1|2,0,0]=3 2083 B9R1.13 CC(=O)CC1CCCO1 MCULE-7012539509 [0,0,0,0,0,1|1,0,0]=2 2084 B9R1.13 CC(=O)CC1CCOC1 MCULE-2391008206 [0,0,0,0,0,1|3,0,0]=4 2085 B9R1.13 CC(=O)CC1OCCO1 MCULE-2632722648 [0,0,0,0,0,1|2,0,0]=3 2086 B9R1.13 CC(=O)CN1CCCC1 MCULE-7257105125 [0,0,0,0,0,1|3,0,0]=4 2087 B9R1.13 CC(=O)NC1CCCC1 MCULE-5984597819 [0,0,0,0,0,1|2,0,0]=3 2088 B9R1.13 CC(=O)NC1CCNC1 MCULE-7740912446 [0,0,0,0,0,1|3,0,0]=4 2089 B9R1.13 CC(=O)NC1CCNC1 MCULE-9319017541 [0,0,0,0,0,1|3,0,0]=4 2090 B9R1.13 CC(=O)N[C@@H]1CCNC1 MCULE-1207025314 [0,0,0,0,0,1|3,0,0]=4 2091 B9R1.13 CC(=O)N[C@@H]1CCNC1 MCULE-7984936811 [0,0,0,0,0,1|3,0,0]=4 2092 B9R1.13 CC(=O)N[C@@H]1CCNC1 MCULE-8722694369 [0,0,0,0,0,1|3,0,0]=4 2093 B9R1.13 CC(=O)N[C@H]1CCNC1 MCULE-3447488838 [0,0,0,0,0,1|3,0,0]=4 2094 B9R1.13 CC(=O)N[C@H]1CCNC1 MCULE-4093097100 [0,0,0,0,0,1|3,0,0]=4 2095 B9R1.13 CC(=O)N[C@H]1CCNC1 MCULE-4416464509 [0,0,0,0,0,1|3,0,0]=4 2096 B9R1.13 CC(=O)N[C@H]1CCNC1 MCULE-5561268178 [0,0,0,0,0,1|3,0,0]=4 2097 B9R1.13 CC(=O)OC1C=CCC1 MCULE-5058666304 [0,0,0,0,0,1|2,0,1]=4 2098 B9R1.13 CC(=O)OC1CCCC1 MCULE-7737656947 [0,0,0,0,0,1|2,0,0]=3 2099 B9R1.13 CC(=O)OC1CCCO1 MCULE-9160883410 [0,0,0,0,0,1|1,0,0]=2 2100 B9R1.13 CC(=O)OC1CCNC1 MCULE-3149020197 [0,0,0,0,0,1|3,0,0]=4 2101 B9R1.13 CC(=O)OC1CCNC1 MCULE-9159124706 [0,0,0,0,0,1|3,0,0]=4 2102 B9R1.13 CC(=O)SC1CCOC1 MCULE-8318391351 [0,0,0,0,0,1|3,0,0]=4 2103 B9R1.13 CC(N)CC1CCCO1 MCULE-7603248274 [0,0,0,0,0,1|2,0,1]=4 2104 B9R1.13 CC(O)CC1CCCN1 MCULE-7800705257 [0,0,0,0,0,1|2,0,1]=4 2105 B9R1.13 CN(C)CC1CCCO1 MCULE-7407716357 [0,0,0,0,0,1|3,0,0]=4 2106 B9R1.13 N=C(N)NC1CCCC1 MCULE-2712949871 [0,0,0,0,0,1|3,0,0]=4 2107 B9R1.13 N=C(N)NC1CCCC1 MCULE-8069558442 [0,0,0,0,0,1|3,0,0]=4 2108 B9R1.13 NC(=NC1CCCC1)N MCULE-1167874672 [0,0,0,0,0,1|3,0,0]=4 2109 B9R1.13 NC(=NC1CCCC1)N MCULE-9434603443 [0,0,0,0,0,1|3,0,0]=4 2110 B9R1.13 NC(=O)/N=C\1/CCCN1 MCULE-4992899283 [0,0,0,0,0,1|2,0,1]=4 2111 B9R1.13 NC(=O)CC1CCCC1 MCULE-2082339108 [0,0,0,0,0,1|2,0,0]=3 2112 B9R1.13 NC(=O)CC1CCCN1 MCULE-2142594957 [0,0,0,0,0,1|2,0,0]=3 2113 B9R1.13 NC(=O)CC1CCCN1 MCULE-8011902334 [0,0,0,0,0,1|2,0,0]=3 2114 B9R1.13 NC(=O)CC1CCNC1 MCULE-7856346382 [0,0,0,0,0,1|3,0,0]=4 2115 B9R1.13 NC(=O)CC1CCNC1 MCULE-9708437402 [0,0,0,0,0,1|3,0,0]=4 2116 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-2790931086 [0,0,0,0,0,1|2,0,0]=3 2117 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3723741843 [0,0,0,0,0,1|2,0,0]=3 2118 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3877903747 [0,0,0,0,0,1|2,0,0]=3 2119 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-5587287647 [0,0,0,0,0,1|2,0,0]=3 2120 B9R1.13 NC(=O)NC1CCCC1 MCULE-9715014489 [0,0,0,0,0,1|2,0,0]=3 2121 B9R1.13 NC(=O)NC1NCCN1 MCULE-5746168335 [0,0,0,0,0,1|3,0,0]=4 2122 B9R1.13 NC(=O)OC1CCCC1 MCULE-7706681395 [0,0,0,0,0,1|2,0,0]=3 2123 B9R1.13 NC(=S)CC1CCCC1 MCULE-6979331241 [0,0,0,0,0,1|2,1,0]=4 2124 B9R1.13 NC(=S)CC1CCCO1 MCULE-7256451681 [0,0,0,0,0,1|1,1,0]=3 2125 B9R1.13 NC(=S)NC1CCCC1 MCULE-6223276405 [0,0,0,0,0,1|2,1,0]=4 2126 B9R1.13 O=C(Cl)CC1CCCC1 MCULE-1532102571 [0,0,0,0,0,1|2,0,0]=3 2127 B9R1.13 O=C(Cl)CC1CCCO1 MCULE-6649417514 [0,0,0,0,0,1|1,0,0]=2 2128 B9R1.13 O=C(Cl)CN1CCCC1 MCULE-5855966340 [0,0,0,0,0,1|3,0,0]=4 2129 B9R1.13 O=C(Cl)CN1CCCC1 MCULE-7423158222 [0,0,0,0,0,1|3,0,0]=4 2130 B9R1.13 O=C(Cl)OC1CCCC1 MCULE-2692212922 [0,0,0,0,0,1|2,0,0]=3 2131 B9R1.13 O=C(Cl)OC1CCOC1 MCULE-2201264760 [0,0,0,0,0,1|3,0,0]=4 2132 B9R1.13 O=C(O)/C=C\1/CCNC1 MCULE-3459034443 [0,0,0,0,0,1|2,0,1]=4 2133 B9R1.13 O=C(O)C=C1CCCC1 MCULE-1637420148 [0,0,0,0,0,1|1,0,1]=3 2134 B9R1.13 O=C(O)CC1=CCCC1 MCULE-5115478269 [0,0,0,0,0,1|1,0,1]=3 2135 B9R1.13 O=C(O)CC1C=CCC1 MCULE-6825390000 [0,0,0,0,0,1|1,0,1]=3 2136 B9R1.13 O=C(O)CC1CC=CC1 MCULE-8417475923 [0,0,0,0,0,1|1,0,2]=4 2137 B9R1.13 O=C(O)CC1CCCC1 MCULE-1115751804 [0,0,0,0,0,1|1,0,0]=2 2138 B9R1.13 O=C(O)CC1CCCN1 MCULE-6784535537 [0,0,0,0,0,1|1,0,0]=2 2139 B9R1.13 O=C(O)CC1CCCN1 MCULE-8302150253 [0,0,0,0,0,1|1,0,0]=2 2140 B9R1.13 O=C(O)CC1CCCO1 MCULE-8027346350 [0,0,0,0,0,1|0,0,0]=1 2141 B9R1.13 O=C(O)CC1CCNC1 MCULE-3199492917 [0,0,0,0,0,1|2,0,0]=3 2142 B9R1.13 O=C(O)CC1CCNC1 MCULE-3887627276 [0,0,0,0,0,1|2,0,0]=3 2143 B9R1.13 O=C(O)CC1CCOC1 MCULE-5167901709 [0,0,0,0,0,1|2,0,0]=3 2144 B9R1.13 O=C(O)CC1CCOC1 MCULE-9171332464 [0,0,0,0,0,1|2,0,0]=3 2145 B9R1.13 O=C(O)CC1CCSS1 MCULE-4893716992 [0,0,0,0,0,1|1,1,0]=3 2146 B9R1.13 O=C(O)CC1OCCO1 MCULE-2253063465 [0,0,0,0,0,1|1,0,0]=2 2147 B9R1.13 O=C(O)CN1CCCC1 MCULE-3979513963 [0,0,0,0,0,1|2,0,0]=3 2148 B9R1.13 O=C(O)CN1CCCC1 MCULE-4046939568 [0,0,0,0,0,1|2,0,0]=3 2149 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-3034711788 [0,0,0,0,0,1|1,0,0]=2 2150 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-8632270998 [0,0,0,0,0,1|1,0,0]=2 2151 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-9053746158 [0,0,0,0,0,1|1,0,0]=2 2152 B9R1.13 O=C(O)C[C@@H]1CCCO1 MCULE-6652130024 [0,0,0,0,0,1|0,0,0]=1 2153 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-1313399028 [0,0,0,0,0,1|2,0,0]=3 2154 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-3013411353 [0,0,0,0,0,1|2,0,0]=3 2155 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-4082052328 [0,0,0,0,0,1|2,0,0]=3 2156 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-4709831049 [0,0,0,0,0,1|2,0,0]=3 2157 B9R1.13 O=C(O)C[C@@H]1CCOC1 MCULE-2630690308 [0,0,0,0,0,1|2,0,0]=3 2158 B9R1.13 O=C(O)C[C@@H]1CCOC1 MCULE-6148582776 [0,0,0,0,0,1|2,0,0]=3 2159 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-1934097379 [0,0,0,0,0,1|1,0,0]=2 2160 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-3129569449 [0,0,0,0,0,1|1,0,0]=2 2161 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-8499782890 [0,0,0,0,0,1|1,0,0]=2 2162 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-9712071738 [0,0,0,0,0,1|1,0,0]=2 2163 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-3712345326 [0,0,0,0,0,1|2,0,0]=3 2164 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-4882389427 [0,0,0,0,0,1|2,0,0]=3 2165 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-5390328422 [0,0,0,0,0,1|2,0,0]=3 2166 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-8402835022 [0,0,0,0,0,1|2,0,0]=3 2167 B9R1.13 O=C(O)C[C@H]1CCOC1 MCULE-3521696581 [0,0,0,0,0,1|2,0,0]=3 2168 B9R1.13 O=C(O)C[C@H]1CCOC1 MCULE-6096956796 [0,0,0,0,0,1|2,0,0]=3 2169 B9R1.13 OB(O)CC1CCCC1 MCULE-5721807920 [0,0,0,0,0,1|2,0,1]=4 2170 B9R1.13 [C@H]1(CCCN1)CC(=O)O MCULE-6368276149 [0,0,0,0,0,1|1,0,0]=2 2171 B6R0.4 C#CCCC(=O)O MCULE-6669146060 [1,0,1,0,0,0|0,0,2]=4 2172 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [1,0,1,0,0,0|0,0,2]=4 2173 B6R0.4 C=C(C)CCCC MCULE-1010177756 [1,0,1,0,0,0|2,0,0]=4 2174 B6R0.4 C=C(C)CCCO MCULE-4629274490 [1,0,1,0,0,0|2,0,0]=4 2175 B6R0.4 C=C(F)CCCO MCULE-1688645687 [1,0,1,0,0,0|2,0,0]=4 2176 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [1,0,1,0,0,0|0,0,2]=4 2177 B6R0.4 CC#CCC(=O)O MCULE-8576178825 [1,0,1,0,0,0|0,0,2]=4 2178 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [1,0,1,0,0,0|2,0,0]=4 2179 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [1,0,1,0,0,0|2,0,0]=4 2180 B6R0.4 CC(=O)CCCO MCULE-1335342150 [1,0,1,0,0,0|1,0,0]=3 2181 B6R0.4 CC(=O)NCCO MCULE-5968518415 [1,0,1,0,0,0|2,0,0]=4 2182 B6R0.4 CC(=O)OCCBr MCULE-3760449773 [1,0,1,0,0,0|2,0,0]=4 2183 B6R0.4 CC(=O)OCCCl MCULE-4570139017 [1,0,1,0,0,0|2,0,0]=4 2184 B6R0.4 CC(=O)OCCN MCULE-4530529900 [1,0,1,0,0,0|2,0,0]=4 2185 B6R0.4 CC(=O)OCCN MCULE-6854340494 [1,0,1,0,0,0|2,0,0]=4 2186 B6R0.4 CC(=O)OCCO MCULE-1251660436 [1,0,1,0,0,0|2,0,0]=4 2187 B6R0.4 CC(O)CCCO MCULE-6580326052 [1,0,1,0,0,0|1,0,1]=4 2188 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [1,0,1,0,0,0|0,0,2]=4 2189 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [1,0,1,0,0,0|0,0,2]=4 2190 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [1,0,1,0,0,0|0,0,2]=4 2191 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [1,0,1,0,0,0|0,0,2]=4 2192 B6R0.4 CCCCB(O)O MCULE-9002672645 [1,0,1,0,0,0|1,0,1]=4 2193 B6R0.4 CCCCC(=N)N MCULE-3271993509 [1,0,1,0,0,0|2,0,0]=4 2194 B6R0.4 CCCCC(=N)N MCULE-3935017760 [1,0,1,0,0,0|2,0,0]=4 2195 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [1,0,1,0,0,0|1,0,0]=3 2196 B6R0.4 CCCCC(=O)C MCULE-3554390184 [1,0,1,0,0,0|1,0,0]=3 2197 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [1,0,1,0,0,0|1,0,0]=3 2198 B6R0.4 CCCCC(=O)N MCULE-6419483436 [1,0,1,0,0,0|1,0,0]=3 2199 B6R0.4 CCCCC(=O)O MCULE-2333640078 [1,0,1,0,0,0|0,0,0]=2 2200 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [1,0,1,0,0,0|0,0,1]=3 2201 B6R0.4 CCCCC(=S)N MCULE-8236760762 [1,0,1,0,0,0|1,1,0]=4 2202 B6R0.4 CCCCC(C)O MCULE-6558228722 [1,0,1,0,0,0|1,0,1]=4 2203 B6R0.4 CCCCN(=O)=O MCULE-7679767771 [1,0,1,0,0,0|1,0,1]=4 2204 B6R0.4 CCCCS(=O)[O-] MCULE-4347348762 [1,0,1,0,0,0|1,0,1]=4 2205 B6R0.4 CCCCS(=O)[O-] MCULE-8153578421 [1,0,1,0,0,0|1,0,1]=4 2206 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [1,0,1,0,0,0|1,0,1]=4 2207 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [1,0,1,0,0,0|1,0,1]=4 2208 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [1,0,1,0,0,0|1,0,1]=4 2209 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [1,0,1,0,0,0|1,0,1]=4 2210 B6R0.4 CCCNC(=O)C MCULE-5899703886 [1,0,1,0,0,0|2,0,0]=4 2211 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [1,0,1,0,0,0|2,0,0]=4 2212 B6R0.4 CCCNC(=O)N MCULE-8528844765 [1,0,1,0,0,0|2,0,0]=4 2213 B6R0.4 CCCOC(=O)C MCULE-7327042566 [1,0,1,0,0,0|1,0,0]=3 2214 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [1,0,1,0,0,0|1,0,0]=3 2215 B6R0.4 CCCOC(=O)N MCULE-2760622567 [1,0,1,0,0,0|1,0,0]=3 2216 B6R0.4 CCCOC(=S)[S-] MCULE-9126934993 [1,0,1,0,0,0|0,2,0]=4 2217 B6R0.4 CCCOC(=S)[S-] MCULE-9566804941 [1,0,1,0,0,0|0,2,0]=4 2218 B6R0.4 CCCON(=O)=O MCULE-3372904250 [1,0,1,0,0,0|1,0,1]=4 2219 B6R0.4 CCCSC(=O)C MCULE-4329646671 [1,0,1,0,0,0|1,1,0]=4 2220 B6R0.4 CCCSC(=O)Cl MCULE-5971141999 [1,0,1,0,0,0|1,1,0]=4 2221 B6R0.4 CCNCC(=O)C MCULE-5799315547 [1,0,1,0,0,0|2,0,0]=4 2222 B6R0.4 CCNCC(=O)C MCULE-9258294157 [1,0,1,0,0,0|2,0,0]=4 2223 B6R0.4 CCNCC(=O)N MCULE-1787248899 [1,0,1,0,0,0|2,0,0]=4 2224 B6R0.4 CCNCC(=O)N MCULE-3821700273 [1,0,1,0,0,0|2,0,0]=4 2225 B6R0.4 CCNCC(=O)O MCULE-5989480216 [1,0,1,0,0,0|1,0,0]=3 2226 B6R0.4 CCNCC(=O)O MCULE-8087863397 [1,0,1,0,0,0|1,0,0]=3 2227 B6R0.4 CCOCC(=N)N MCULE-3232806707 [1,0,1,0,0,0|2,0,0]=4 2228 B6R0.4 CCOCC(=N)N MCULE-4996987536 [1,0,1,0,0,0|2,0,0]=4 2229 B6R0.4 CCOCC(=O)C MCULE-2825677443 [1,0,1,0,0,0|1,0,0]=3 2230 B6R0.4 CCOCC(=O)Cl MCULE-2172268229 [1,0,1,0,0,0|1,0,0]=3 2231 B6R0.4 CCOCC(=O)O MCULE-1726530898 [1,0,1,0,0,0|0,0,0]=2 2232 B6R0.4 CCOCC(=S)N MCULE-7064672670 [1,0,1,0,0,0|1,1,0]=4 2233 B6R0.4 CCOCC(C)O MCULE-6224339526 [1,0,1,0,0,0|1,0,1]=4 2234 B6R0.4 CCOC[C@@H](C)O MCULE-9075407512 [1,0,1,0,0,0|1,0,1]=4 2235 B6R0.4 CCSCC(=O)C MCULE-9872082780 [1,0,1,0,0,0|1,1,0]=4 2236 B6R0.4 CCSCC(=O)O MCULE-7471335718 [1,0,1,0,0,0|0,1,0]=3 2237 B6R0.4 CNCCC(=O)N MCULE-1118876220 [1,0,1,0,0,0|2,0,0]=4 2238 B6R0.4 CNCCC(=O)N MCULE-6679713144 [1,0,1,0,0,0|2,0,0]=4 2239 B6R0.4 CNCCC(=O)O MCULE-3627988097 [1,0,1,0,0,0|1,0,0]=3 2240 B6R0.4 CNCCC(=O)O MCULE-9858204248 [1,0,1,0,0,0|1,0,0]=3 2241 B6R0.4 COCCC(=O)C MCULE-5939812376 [1,0,1,0,0,0|2,0,0]=4 2242 B6R0.4 COCCC(=O)Cl MCULE-9454266286 [1,0,1,0,0,0|2,0,0]=4 2243 B6R0.4 COCCC(=O)N MCULE-7556483675 [1,0,1,0,0,0|2,0,0]=4 2244 B6R0.4 COCCC(=O)O MCULE-3436347115 [1,0,1,0,0,0|1,0,0]=3 2245 B6R0.4 COCOC(=O)C MCULE-8876091916 [1,0,1,0,0,0|2,0,0]=4 2246 B6R0.4 CSCCC(=O)C MCULE-6178663156 [1,0,1,0,0,0|2,0,0]=4 2247 B6R0.4 CSCCC(=O)Cl MCULE-9732512141 [1,0,1,0,0,0|2,0,0]=4 2248 B6R0.4 CSCCC(=O)N MCULE-7105035733 [1,0,1,0,0,0|2,0,0]=4 2249 B6R0.4 CSCCC(=O)O MCULE-9550032941 [1,0,1,0,0,0|1,0,0]=3 2250 B6R0.4 CSCOC(=O)C MCULE-1498769347 [1,0,1,0,0,0|2,0,0]=4 2251 B6R0.4 CSSCC(=O)O MCULE-5829510166 [1,0,1,0,0,0|1,1,0]=4 2252 B6R0.4 C[C@@H](O)CCCO MCULE-1658231016 [1,0,1,0,0,0|1,0,1]=4 2253 B6R0.4 N#CCCC(=O)O MCULE-3165189228 [1,0,1,0,0,0|1,0,1]=4 2254 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [1,0,1,0,0,0|2,0,0]=4 2255 B6R0.4 NC(=O)CCCO MCULE-3779341561 [1,0,1,0,0,0|1,0,0]=3 2256 B6R0.4 NC(=O)NCCO MCULE-2353513655 [1,0,1,0,0,0|2,0,0]=4 2257 B6R0.4 NC(=O)OCCCl MCULE-4259077420 [1,0,1,0,0,0|2,0,0]=4 2258 B6R0.4 NC(=O)OCCO MCULE-7565460845 [1,0,1,0,0,0|2,0,0]=4 2259 B6R0.4 NC(=S)CCCO MCULE-8951145487 [1,0,1,0,0,0|1,1,0]=4 2260 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [1,0,1,0,0,0|2,0,0]=4 2261 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [1,0,1,0,0,0|2,0,0]=4 2262 B6R0.4 NCCCC(=O)N MCULE-8039142092 [1,0,1,0,0,0|2,0,0]=4 2263 B6R0.4 NCCCC(=O)N MCULE-8262250872 [1,0,1,0,0,0|2,0,0]=4 2264 B6R0.4 NCCCC(=O)O MCULE-3615304273 [1,0,1,0,0,0|1,0,0]=3 2265 B6R0.4 NCCCC(=O)O MCULE-7613134021 [1,0,1,0,0,0|1,0,0]=3 2266 B6R0.4 NCCOC(=O)N MCULE-4144808257 [1,0,1,0,0,0|2,0,0]=4 2267 B6R0.4 NCCOC(=O)N MCULE-5815053840 [1,0,1,0,0,0|2,0,0]=4 2268 B6R0.4 NOCCC(=O)O MCULE-1529492904 [1,0,1,0,0,0|2,0,0]=4 2269 B6R0.4 NOCCC(=O)O MCULE-6297331357 [1,0,1,0,0,0|2,0,0]=4 2270 B6R0.4 O=C(Cl)CCCBr MCULE-1389049838 [1,0,1,0,0,0|2,0,0]=4 2271 B6R0.4 O=C(Cl)CCCCl MCULE-5885932072 [1,0,1,0,0,0|2,0,0]=4 2272 B6R0.4 O=C(Cl)OCCBr MCULE-6758010852 [1,0,1,0,0,0|2,0,0]=4 2273 B6R0.4 O=C(Cl)OCCCl MCULE-1505786385 [1,0,1,0,0,0|2,0,0]=4 2274 B6R0.4 O=C(Cl)OCCF MCULE-5233366139 [1,0,1,0,0,0|2,0,0]=4 2275 B6R0.4 O=C(O)/C=C/CO MCULE-1612823053 [1,0,1,0,0,0|0,0,2]=4 2276 B6R0.4 O=C(O)C#CCO MCULE-1849362182 [1,0,1,0,0,0|0,0,2]=4 2277 B6R0.4 O=C(O)C=CCO MCULE-3375515425 [1,0,1,0,0,0|0,0,2]=4 2278 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [1,0,1,0,0,0|1,0,0]=3 2279 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [1,0,1,0,0,0|1,0,0]=3 2280 B6R0.4 O=C(O)CCCF MCULE-2415675768 [1,0,1,0,0,0|1,0,0]=3 2281 B6R0.4 O=C(O)CCCI MCULE-7794841553 [1,0,1,0,0,0|1,0,0]=3 2282 B6R0.4 O=C(O)CCCS MCULE-3352840152 [1,0,1,0,0,0|0,1,0]=3 2283 B6R0.4 O=C(O)CNCO MCULE-4092998319 [1,0,1,0,0,0|1,0,0]=3 2284 B6R0.4 O=C([O-])CCCCl MCULE-4131322715 [1,0,1,0,0,0|1,0,1]=4 2285 B6R0.4 O=C([O-])CNCO MCULE-2804068565 [1,0,1,0,0,0|1,0,1]=4 2286 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [1,0,1,0,0,0|0,0,2]=4 2287 B6R0.4 O=N(=O)CCCO MCULE-5021681032 [1,0,1,0,0,0|1,0,1]=4 2288 B6R0.4 P(=O)([O-])OCCC MCULE-3877591764 [1,0,1,0,0,0|1,0,1]=4 2289 B6R0.6 C#CCCCC=O MCULE-4075029417 [1,0,1,0,0,0|1,0,1]=4 2290 B6R0.6 C#CCCCCO MCULE-2977997146 [1,0,1,0,0,0|1,0,1]=4 2291 B6R0.6 C/C=C/CCCO MCULE-9865436125 [1,0,1,0,0,0|1,0,1]=4 2292 B6R0.6 C/C=C\CCCO MCULE-3169839661 [1,0,1,0,0,0|1,0,1]=4 2293 B6R0.6 C=CCCCC=O MCULE-8676840281 [1,0,1,0,0,0|1,0,1]=4 2294 B6R0.6 C=CCCCCBr MCULE-4313298656 [1,0,1,0,0,0|2,0,0]=4 2295 B6R0.6 C=CCCCCC MCULE-5868303078 [1,0,1,0,0,0|2,0,0]=4 2296 B6R0.6 C=CCCCCCl MCULE-7600727876 [1,0,1,0,0,0|2,0,0]=4 2297 B6R0.6 C=CCCCCI MCULE-5694143061 [1,0,1,0,0,0|2,0,0]=4 2298 B6R0.6 C=CCCCCN MCULE-1489231988 [1,0,1,0,0,0|2,0,0]=4 2299 B6R0.6 C=CCCCCN MCULE-4288584778 [1,0,1,0,0,0|2,0,0]=4 2300 B6R0.6 C=CCCCCO MCULE-3631432277 [1,0,1,0,0,0|1,0,0]=3 2301 B6R0.6 C=CCNCCC MCULE-4239068147 [1,0,1,0,0,0|2,0,0]=4 2302 B6R0.6 C=CCNCCC MCULE-9778489216 [1,0,1,0,0,0|2,0,0]=4 2303 B6R0.6 C=CCNCCO MCULE-5860509324 [1,0,1,0,0,0|2,0,0]=4 2304 B6R0.6 C=CCOCC=O MCULE-8507800253 [1,0,1,0,0,0|0,0,2]=4 2305 B6R0.6 C=CCOCCBr MCULE-7565992230 [1,0,1,0,0,0|2,0,0]=4 2306 B6R0.6 C=CCOCCCl MCULE-1353236332 [1,0,1,0,0,0|2,0,0]=4 2307 B6R0.6 C=CCOCCI MCULE-8468439129 [1,0,1,0,0,0|2,0,0]=4 2308 B6R0.6 C=CCOCCN MCULE-5411259412 [1,0,1,0,0,0|2,0,0]=4 2309 B6R0.6 C=CCOCCN MCULE-9798285838 [1,0,1,0,0,0|2,0,0]=4 2310 B6R0.6 C=CCOCCO MCULE-5718868633 [1,0,1,0,0,0|2,0,0]=4 2311 B6R0.6 C=CCOCOC MCULE-6553342654 [1,0,1,0,0,0|2,0,0]=4 2312 B6R0.6 C=CCSCCC MCULE-3855352363 [1,0,1,0,0,0|1,1,0]=4 2313 B6R0.6 C=COCCCO MCULE-8325617945 [1,0,1,0,0,0|2,0,0]=4 2314 B6R0.6 CC/C=C\CC=O MCULE-1715953159 [1,0,1,0,0,0|1,0,1]=4 2315 B6R0.6 CC=CCCCO MCULE-1401303632 [1,0,1,0,0,0|1,0,1]=4 2316 B6R0.6 CCC#CCC=O MCULE-4049790039 [1,0,1,0,0,0|1,0,1]=4 2317 B6R0.6 CCC/C=C/C=O MCULE-3059768922 [1,0,1,0,0,0|1,0,1]=4 2318 B6R0.6 CCC=CCC=O MCULE-5764198290 [1,0,1,0,0,0|1,0,1]=4 2319 B6R0.6 CCCC=CC=O MCULE-5273169296 [1,0,1,0,0,0|1,0,1]=4 2320 B6R0.6 CCCCCC=O MCULE-6770578514 [1,0,1,0,0,0|1,0,0]=3 2321 B6R0.6 CCCCCCO MCULE-4299150163 [1,0,1,0,0,0|1,0,1]=4 2322 B6R0.6 CCCCNC=O MCULE-8821792924 [1,0,1,0,0,0|2,0,0]=4 2323 B6R0.6 CCCCOC=O MCULE-4633421026 [1,0,1,0,0,0|2,0,0]=4 2324 B6R0.6 CCCNCCO MCULE-4813687741 [1,0,1,0,0,0|1,0,1]=4 2325 B6R0.6 CCCOCC#N MCULE-7011471802 [1,0,1,0,0,0|1,0,1]=4 2326 B6R0.6 CCCOCCC MCULE-1390130917 [1,0,1,0,0,0|1,0,1]=4 2327 B6R0.6 CCCOCCCl MCULE-6561613708 [1,0,1,0,0,0|1,0,1]=4 2328 B6R0.6 CCCOCCI MCULE-5330098176 [1,0,1,0,0,0|1,0,1]=4 2329 B6R0.6 CCCOCCN MCULE-1987261931 [1,0,1,0,0,0|1,0,1]=4 2330 B6R0.6 CCCOCCN MCULE-9033871038 [1,0,1,0,0,0|1,0,1]=4 2331 B6R0.6 CCCOCCO MCULE-3263526264 [1,0,1,0,0,0|0,0,1]=3 2332 B6R0.6 CCCSCCO MCULE-8371796663 [1,0,1,0,0,0|0,1,1]=4 2333 B6R0.6 CCOCCC=O MCULE-1664130148 [1,0,1,0,0,0|2,0,0]=4 2334 B6R0.6 CCSCCC=O MCULE-2493452950 [1,0,1,0,0,0|2,0,0]=4 2335 B6R0.6 CNCCCCO MCULE-9264393637 [1,0,1,0,0,0|2,0,0]=4 2336 B6R0.6 COCCCC=O MCULE-2055914202 [1,0,1,0,0,0|2,0,0]=4 2337 B6R0.6 COCCCCO MCULE-2543196930 [1,0,1,0,0,0|2,0,0]=4 2338 B6R0.6 COCCCCO MCULE-8659106280 [1,0,1,0,0,0|2,0,0]=4 2339 B6R0.6 COCOCCO MCULE-8093241209 [1,0,1,0,0,0|1,0,1]=4 2340 B6R0.6 CSCCCC=O MCULE-6353729217 [1,0,1,0,0,0|2,0,0]=4 2341 B6R0.6 CSCCCCO MCULE-1045422424 [1,0,1,0,0,0|2,0,0]=4 2342 B6R0.6 N#CCCCCO MCULE-4289736283 [1,0,1,0,0,0|1,0,1]=4 2343 B6R0.6 NCCCCCO MCULE-8877250712 [1,0,1,0,0,0|1,0,1]=4 2344 B6R0.6 NCCCCNO MCULE-6478748569 [1,0,1,0,0,0|2,0,0]=4 2345 B6R0.6 NCCCNC=O MCULE-9651299205 [1,0,1,0,0,0|2,0,0]=4 2346 B6R0.6 NCCOCCO MCULE-1073574088 [1,0,1,0,0,0|1,0,1]=4 2347 B6R0.6 NNCCCCO MCULE-3928748589 [1,0,1,0,0,0|2,0,0]=4 2348 B6R0.6 O=CCCCC=O MCULE-6802048757 [1,0,1,0,0,0|0,0,2]=4 2349 B6R0.6 O=CCCCCCl MCULE-1257670284 [1,0,1,0,0,0|1,0,0]=3 2350 B6R0.6 O=CCCCCO MCULE-7959082228 [1,0,1,0,0,0|0,0,0]=2 2351 B6R0.6 O=CNCCCO MCULE-7926485528 [1,0,1,0,0,0|1,0,0]=3 2352 B6R0.6 O=NCNCCO MCULE-4478167391 [1,0,1,0,0,0|2,0,0]=4 2353 B6R0.6 OCCCCCBr MCULE-1444733196 [1,0,1,0,0,0|1,0,1]=4 2354 B6R0.6 OCCCCCCl MCULE-5666058059 [1,0,1,0,0,0|1,0,1]=4 2355 B6R0.6 OCCCCCF MCULE-9253204275 [1,0,1,0,0,0|1,0,1]=4 2356 B6R0.6 OCCCCCI MCULE-8707758496 [1,0,1,0,0,0|1,0,1]=4 2357 B6R0.6 OCCCCCO MCULE-1044076048 [1,0,1,0,0,0|0,0,1]=3 2358 B6R0.6 OCCNCCO MCULE-9183096746 [1,0,1,0,0,0|1,0,1]=4 2359 B6R0.6 OCCNCCO MCULE-9803420258 [1,0,1,0,0,0|1,0,1]=4 2360 B6R0.6 OCCOCCBr MCULE-2641000270 [1,0,1,0,0,0|1,0,1]=4 2361 B6R0.6 OCCOCCCl MCULE-7320539957 [1,0,1,0,0,0|1,0,1]=4 2362 B6R0.6 OCCOCCF MCULE-1780385479 [1,0,1,0,0,0|1,0,1]=4 2363 B6R0.6 OCCOCCI MCULE-1083607130 [1,0,1,0,0,0|1,0,1]=4 2364 B6R0.6 OCCOCCO MCULE-1531783732 [1,0,1,0,0,0|1,0,1]=4 2365 B6R0.6 OCCSCCO MCULE-5502656030 [1,0,1,0,0,0|1,0,1]=4 2366 B6R0.1 C#CC(O)CCC MCULE-6152066005 [1,0,1,0,0,0|1,0,1]=4 2367 B6R0.1 C=CC(C)CCC MCULE-2692803387 [1,0,1,0,0,0|2,0,0]=4 2368 B6R0.1 C=CC(O)CCC MCULE-3664453040 [1,0,1,0,0,0|1,0,0]=3 2369 B6R0.1 C=CC(O)CCN MCULE-9346205308 [1,0,1,0,0,0|2,0,0]=4 2370 B6R0.1 CC/C=C(\C)/C=O MCULE-6692882718 [1,0,1,0,0,0|1,0,1]=4 2371 B6R0.1 CCC=C(C)C=O MCULE-1636090264 [1,0,1,0,0,0|1,0,1]=4 2372 B6R0.1 CCCC(C)C=O MCULE-9756444218 [1,0,1,0,0,0|1,0,0]=3 2373 B6R0.1 CCCC(C)CO MCULE-9777250826 [1,0,1,0,0,0|1,0,1]=4 2374 B6R0.1 CCCC(N)CO MCULE-3404967504 [1,0,1,0,0,0|1,0,1]=4 2375 B6R0.1 CCCC(N)CO MCULE-3802448518 [1,0,1,0,0,0|1,0,1]=4 2376 B6R0.1 CCCC(N)CO MCULE-4259078445 [1,0,1,0,0,0|1,0,1]=4 2377 B6R0.1 CCCC(N)CO MCULE-6425025734 [1,0,1,0,0,0|1,0,1]=4 2378 B6R0.1 CCCC(O)C#N MCULE-7017059503 [1,0,1,0,0,0|1,0,1]=4 2379 B6R0.1 CCCC(O)CBr MCULE-5186252424 [1,0,1,0,0,0|1,0,1]=4 2380 B6R0.1 CCCC(O)CC MCULE-9504041935 [1,0,1,0,0,0|1,0,1]=4 2381 B6R0.1 CCCC(O)CCl MCULE-4737360217 [1,0,1,0,0,0|1,0,1]=4 2382 B6R0.1 CCCC(O)CN MCULE-9402934997 [1,0,1,0,0,0|1,0,1]=4 2383 B6R0.1 CCCC(O)CO MCULE-5124107719 [1,0,1,0,0,0|0,0,1]=3 2384 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [1,0,1,0,0,0|1,0,1]=4 2385 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [1,0,1,0,0,0|1,0,1]=4 2386 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [1,0,1,0,0,0|1,0,1]=4 2387 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [1,0,1,0,0,0|1,0,1]=4 2388 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [1,0,1,0,0,0|1,0,1]=4 2389 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [1,0,1,0,0,0|1,0,1]=4 2390 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [1,0,1,0,0,0|1,0,1]=4 2391 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [1,0,1,0,0,0|1,0,1]=4 2392 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [1,0,1,0,0,0|1,0,1]=4 2393 B6R0.1 CCNC(C)CO MCULE-4344397973 [1,0,1,0,0,0|1,0,1]=4 2394 B6R0.1 CCN[C@@H](C)CO MCULE-5648721449 [1,0,1,0,0,0|1,0,1]=4 2395 B6R0.1 CCN[C@H](C)CO MCULE-8047465405 [1,0,1,0,0,0|1,0,1]=4 2396 B6R0.1 CCO/C(=N/O)/C MCULE-2336241507 [1,0,1,0,0,0|1,0,1]=4 2397 B6R0.1 CCO/C(=N\O)/C MCULE-7101376522 [1,0,1,0,0,0|1,0,1]=4 2398 B6R0.1 CCOC(=NO)C MCULE-6964305821 [1,0,1,0,0,0|1,0,1]=4 2399 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [1,0,1,0,0,0|1,0,1]=4 2400 B6R0.1 CCOC(C)CC MCULE-5049998907 [1,0,1,0,0,0|1,0,1]=4 2401 B6R0.1 CCOC(C)CN MCULE-2322112215 [1,0,1,0,0,0|1,0,1]=4 2402 B6R0.1 CCOC(C)CN MCULE-7307949125 [1,0,1,0,0,0|1,0,1]=4 2403 B6R0.1 CCOC(C)CO MCULE-1592146913 [1,0,1,0,0,0|0,0,1]=3 2404 B6R0.1 CNCC(O)CO MCULE-4566952448 [1,0,1,0,0,0|1,0,1]=4 2405 B6R0.1 CNC[C@H](O)CO MCULE-3410453252 [1,0,1,0,0,0|1,0,1]=4 2406 B6R0.1 COCC(C)C=O MCULE-7679332713 [1,0,1,0,0,0|2,0,0]=4 2407 B6R0.1 COCC(O)CO MCULE-1154104224 [1,0,1,0,0,0|1,0,1]=4 2408 B6R0.1 CSCC(O)CO MCULE-6573013078 [1,0,1,0,0,0|1,0,1]=4 2409 B6R0.1 NCCC(O)CO MCULE-2556586168 [1,0,1,0,0,0|1,0,1]=4 2410 B6R0.1 OCCC(O)CO MCULE-6470178852 [1,0,1,0,0,0|1,0,1]=4 2411 B6R0.1 OCC[C@@H](O)CO MCULE-2312093276 [1,0,1,0,0,0|1,0,1]=4 2412 B6R0.1 OCC[C@@H](O)CO MCULE-4636748782 [1,0,1,0,0,0|1,0,1]=4 2413 B6R0.1 OCC[C@H](O)CO MCULE-2265914374 [1,0,1,0,0,0|1,0,1]=4 2414 B6R0.1 OCC[C@H](O)CO MCULE-5459838421 [1,0,1,0,0,0|1,0,1]=4 2415 B6R0.3 C#CC(O)C(=O)O MCULE-4214673632 [1,0,1,0,0,0|0,0,2]=4 2416 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [1,0,1,0,0,0|0,0,0]=2 2417 B6R0.3 C/C=C(/C)\C(=O)O MCULE-2116066534 [1,0,1,0,0,0|0,0,2]=4 2418 B6R0.3 C/C=C(\C)/C(=O)O MCULE-4890719796 [1,0,1,0,0,0|0,0,2]=4 2419 B6R0.3 C/C=C(\O)/C(=O)O MCULE-9596699660 [1,0,1,0,0,0|0,0,2]=4 2420 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [1,0,1,0,0,0|2,0,0]=4 2421 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [1,0,1,0,0,0|0,0,2]=4 2422 B6R0.3 C=C(OC)C(=O)O MCULE-9965334560 [1,0,1,0,0,0|0,0,2]=4 2423 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [1,0,1,0,0,0|0,0,2]=4 2424 B6R0.3 C=CC(O)C(=O)O MCULE-3847595710 [1,0,1,0,0,0|0,0,2]=4 2425 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [1,0,1,0,0,0|0,0,2]=4 2426 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [1,0,1,0,0,0|0,0,2]=4 2427 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [1,0,1,0,0,0|0,0,2]=4 2428 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [1,0,1,0,0,0|0,0,2]=4 2429 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [1,0,1,0,0,0|2,0,0]=4 2430 B6R0.3 CC(C#N)C(=O)O MCULE-3302580561 [1,0,1,0,0,0|1,0,1]=4 2431 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [1,0,1,0,0,0|1,0,0]=3 2432 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [1,0,1,0,0,0|1,0,0]=3 2433 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [1,0,1,0,0,0|1,0,0]=3 2434 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [1,0,1,0,0,0|1,0,0]=3 2435 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [1,0,1,0,0,0|1,0,0]=3 2436 B6R0.3 CC(CO)C(=O)[O-] MCULE-6956620176 [1,0,1,0,0,0|1,0,1]=4 2437 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [1,0,1,0,0,0|1,0,0]=3 2438 B6R0.3 CC(ON)C(=O)O MCULE-1969235976 [1,0,1,0,0,0|1,0,0]=3 2439 B6R0.3 CC(ON)C(=O)O MCULE-4318537884 [1,0,1,0,0,0|1,0,0]=3 2440 B6R0.3 CC(ON)C(=O)O MCULE-4455753863 [1,0,1,0,0,0|1,0,0]=3 2441 B6R0.3 CC(ON)C(=O)O MCULE-8893009712 [1,0,1,0,0,0|1,0,0]=3 2442 B6R0.3 CC=C(C)C(=O)O MCULE-2390677360 [1,0,1,0,0,0|0,0,2]=4 2443 B6R0.3 CC=C(O)C(=O)O MCULE-7886990963 [1,0,1,0,0,0|0,0,2]=4 2444 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [1,0,1,0,0,0|0,0,2]=4 2445 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [1,0,1,0,0,0|2,0,0]=4 2446 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [1,0,1,0,0,0|2,0,0]=4 2447 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [1,0,1,0,0,0|2,0,0]=4 2448 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [1,0,1,0,0,0|2,0,0]=4 2449 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [1,0,1,0,0,0|1,0,0]=3 2450 B6R0.3 CCC(C)B(O)O MCULE-7544159454 [1,0,1,0,0,0|1,0,1]=4 2451 B6R0.3 CCC(C)C(=N)N MCULE-4070060089 [1,0,1,0,0,0|2,0,0]=4 2452 B6R0.3 CCC(C)C(=N)N MCULE-7020524406 [1,0,1,0,0,0|2,0,0]=4 2453 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [1,0,1,0,0,0|1,0,0]=3 2454 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [1,0,1,0,0,0|1,0,0]=3 2455 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [1,0,1,0,0,0|1,0,0]=3 2456 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [1,0,1,0,0,0|0,0,0]=2 2457 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [1,0,1,0,0,0|0,0,0]=2 2458 B6R0.3 CCC(C)C(=S)N MCULE-9682279721 [1,0,1,0,0,0|1,1,0]=4 2459 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [1,0,1,0,0,0|1,0,1]=4 2460 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [1,0,1,0,0,0|2,0,0]=4 2461 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [1,0,1,0,0,0|2,0,0]=4 2462 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [1,0,1,0,0,0|1,0,0]=3 2463 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [1,0,1,0,0,0|1,0,0]=3 2464 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [1,0,1,0,0,0|2,0,0]=4 2465 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [1,0,1,0,0,0|2,0,0]=4 2466 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [1,0,1,0,0,0|2,0,0]=4 2467 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [1,0,1,0,0,0|2,0,0]=4 2468 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [1,0,1,0,0,0|1,0,0]=3 2469 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [1,0,1,0,0,0|1,0,0]=3 2470 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [1,0,1,0,0,0|1,0,0]=3 2471 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [1,0,1,0,0,0|1,0,0]=3 2472 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [1,0,1,0,0,0|1,0,0]=3 2473 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [1,0,1,0,0,0|0,0,0]=2 2474 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [1,0,1,0,0,0|0,0,0]=2 2475 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [1,0,1,0,0,0|0,0,1]=3 2476 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [1,0,1,0,0,0|0,0,1]=3 2477 B6R0.3 CCC(O)C(C)O MCULE-1468922095 [1,0,1,0,0,0|1,0,1]=4 2478 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [1,0,1,0,0,0|1,1,0]=4 2479 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [1,0,1,0,0,0|0,1,0]=3 2480 B6R0.3 CCN(C)C(=O)C MCULE-6881823095 [1,0,1,0,0,0|2,0,0]=4 2481 B6R0.3 CCN(C)C(=O)Cl MCULE-3697487267 [1,0,1,0,0,0|2,0,0]=4 2482 B6R0.3 CCN(O)C(=O)C MCULE-8547381969 [1,0,1,0,0,0|2,0,0]=4 2483 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [1,0,1,0,0,0|1,0,0]=3 2484 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [1,0,1,0,0,0|1,0,0]=3 2485 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [1,0,1,0,0,0|1,0,0]=3 2486 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [1,0,1,0,0,0|1,0,0]=3 2487 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [1,0,1,0,0,0|0,0,0]=2 2488 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [1,0,1,0,0,0|0,0,0]=2 2489 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [1,0,1,0,0,0|1,0,0]=3 2490 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [1,0,1,0,0,0|1,0,0]=3 2491 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [1,0,1,0,0,0|2,0,0]=4 2492 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [1,0,1,0,0,0|2,0,0]=4 2493 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [1,0,1,0,0,0|2,0,0]=4 2494 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [1,0,1,0,0,0|2,0,0]=4 2495 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [1,0,1,0,0,0|1,0,0]=3 2496 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [1,0,1,0,0,0|1,0,0]=3 2497 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [1,0,1,0,0,0|1,0,0]=3 2498 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [1,0,1,0,0,0|1,0,0]=3 2499 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [1,0,1,0,0,0|0,0,0]=2 2500 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [1,0,1,0,0,0|0,0,0]=2 2501 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [1,0,1,0,0,0|1,0,0]=3 2502 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [1,0,1,0,0,0|1,0,0]=3 2503 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [1,0,1,0,0,0|0,0,0]=2 2504 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [1,0,1,0,0,0|0,0,0]=2 2505 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [1,0,1,0,0,0|1,0,0]=3 2506 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [1,0,1,0,0,0|2,0,0]=4 2507 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [1,0,1,0,0,0|2,0,0]=4 2508 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [1,0,1,0,0,0|2,0,0]=4 2509 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [1,0,1,0,0,0|2,0,0]=4 2510 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [1,0,1,0,0,0|1,0,0]=3 2511 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [1,0,1,0,0,0|1,0,0]=3 2512 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [1,0,1,0,0,0|1,0,0]=3 2513 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [1,0,1,0,0,0|1,0,0]=3 2514 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [1,0,1,0,0,0|1,1,0]=4 2515 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [1,0,1,0,0,0|1,1,0]=4 2516 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [1,0,1,0,0,0|0,0,0]=2 2517 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [1,0,1,0,0,0|0,0,0]=2 2518 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [1,0,1,0,0,0|0,0,1]=3 2519 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [1,0,1,0,0,0|2,0,0]=4 2520 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [1,0,1,0,0,0|2,0,0]=4 2521 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [1,0,1,0,0,0|1,0,0]=3 2522 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [1,0,1,0,0,0|1,0,0]=3 2523 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [1,0,1,0,0,0|1,0,0]=3 2524 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [1,0,1,0,0,0|2,0,0]=4 2525 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [1,0,1,0,0,0|1,0,0]=3 2526 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [1,0,1,0,0,0|1,0,0]=3 2527 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [1,0,1,0,0,0|1,0,0]=3 2528 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [1,0,1,0,0,0|1,0,0]=3 2529 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [1,0,1,0,0,0|1,0,0]=3 2530 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [1,0,1,0,0,0|1,0,0]=3 2531 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [1,0,1,0,0,0|1,0,0]=3 2532 B6R0.3 COC(=O)C(=O)O MCULE-8527842270 [1,0,1,0,0,0|1,0,1]=4 2533 B6R0.3 COC(Br)C(=O)C MCULE-1220922171 [1,0,1,0,0,0|2,0,0]=4 2534 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [1,0,1,0,0,0|1,0,0]=3 2535 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [1,0,1,0,0,0|1,0,0]=3 2536 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [1,0,1,0,0,0|1,0,0]=3 2537 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [1,0,1,0,0,0|0,0,0]=2 2538 B6R0.3 COC(C)C(=S)N MCULE-6827196665 [1,0,1,0,0,0|1,1,0]=4 2539 B6R0.3 COC(C)C(C)O MCULE-9844405908 [1,0,1,0,0,0|1,0,1]=4 2540 B6R0.3 CON(C)C(=O)C MCULE-8559238750 [1,0,1,0,0,0|2,0,0]=4 2541 B6R0.3 CON(C)C(=O)Cl MCULE-7217619495 [1,0,1,0,0,0|2,0,0]=4 2542 B6R0.3 CO[C@@H](C)C(=O)Cl MCULE-9335923061 [1,0,1,0,0,0|1,0,0]=3 2543 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [1,0,1,0,0,0|0,0,0]=2 2544 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [1,0,1,0,0,0|0,0,0]=2 2545 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [1,0,1,0,0,0|0,0,0]=2 2546 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [1,0,1,0,0,0|0,0,0]=2 2547 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [1,0,1,0,0,0|1,1,0]=4 2548 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [1,0,1,0,0,0|0,1,0]=3 2549 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [1,0,1,0,0,0|1,0,0]=3 2550 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [1,0,1,0,0,0|1,0,0]=3 2551 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [1,0,1,0,0,0|1,0,0]=3 2552 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [1,0,1,0,0,0|1,0,0]=3 2553 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [1,0,1,0,0,0|1,0,0]=3 2554 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [1,0,1,0,0,0|1,0,0]=3 2555 B6R0.3 C[C@@H](ON)C(=O)O MCULE-1538722507 [1,0,1,0,0,0|1,0,0]=3 2556 B6R0.3 C[C@@H](ON)C(=O)O MCULE-3835402446 [1,0,1,0,0,0|1,0,0]=3 2557 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [1,0,1,0,0,0|1,0,0]=3 2558 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [1,0,1,0,0,0|1,0,0]=3 2559 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [1,0,1,0,0,0|1,0,0]=3 2560 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [1,0,1,0,0,0|1,0,0]=3 2561 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [1,0,1,0,0,0|1,0,0]=3 2562 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [1,0,1,0,0,0|1,0,0]=3 2563 B6R0.3 C[C@H](CO)C(=O)[O-] MCULE-5733737039 [1,0,1,0,0,0|1,0,1]=4 2564 B6R0.3 C[C@H](ON)C(=O)O MCULE-3327889540 [1,0,1,0,0,0|1,0,0]=3 2565 B6R0.3 C[C@H](ON)C(=O)O MCULE-4523264650 [1,0,1,0,0,0|1,0,0]=3 2566 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [1,0,1,0,0,0|2,0,0]=4 2567 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [1,0,1,0,0,0|2,0,0]=4 2568 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [1,0,1,0,0,0|2,0,0]=4 2569 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [1,0,1,0,0,0|2,0,0]=4 2570 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [1,0,1,0,0,0|2,0,0]=4 2571 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [1,0,1,0,0,0|2,0,0]=4 2572 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [1,0,1,0,0,0|2,0,0]=4 2573 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [1,0,1,0,0,0|2,0,0]=4 2574 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [1,0,1,0,0,0|2,0,0]=4 2575 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [1,0,1,0,0,0|2,0,0]=4 2576 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [1,0,1,0,0,0|2,0,0]=4 2577 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [1,0,1,0,0,0|2,0,0]=4 2578 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [1,0,1,0,0,0|2,0,0]=4 2579 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [1,0,1,0,0,0|2,0,0]=4 2580 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [1,0,1,0,0,0|2,0,0]=4 2581 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [1,0,1,0,0,0|2,0,0]=4 2582 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [1,0,1,0,0,0|2,0,0]=4 2583 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [1,0,1,0,0,0|2,0,0]=4 2584 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [1,0,1,0,0,0|2,0,0]=4 2585 B6R0.3 NCC(O)C(=O)N MCULE-1543465850 [1,0,1,0,0,0|2,0,0]=4 2586 B6R0.3 NCC(O)C(=O)N MCULE-9574499203 [1,0,1,0,0,0|2,0,0]=4 2587 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [1,0,1,0,0,0|1,0,0]=3 2588 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [1,0,1,0,0,0|1,0,0]=3 2589 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [1,0,1,0,0,0|2,0,0]=4 2590 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [1,0,1,0,0,0|2,0,0]=4 2591 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [1,0,1,0,0,0|2,0,0]=4 2592 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [1,0,1,0,0,0|2,0,0]=4 2593 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [1,0,1,0,0,0|2,0,0]=4 2594 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [1,0,1,0,0,0|2,0,0]=4 2595 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [1,0,1,0,0,0|2,0,0]=4 2596 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [1,0,1,0,0,0|1,0,0]=3 2597 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [1,0,1,0,0,0|1,0,0]=3 2598 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [1,0,1,0,0,0|2,0,0]=4 2599 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [1,0,1,0,0,0|2,0,0]=4 2600 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [1,0,1,0,0,0|2,0,0]=4 2601 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [1,0,1,0,0,0|2,0,0]=4 2602 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [1,0,1,0,0,0|2,0,0]=4 2603 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [1,0,1,0,0,0|2,0,0]=4 2604 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [1,0,1,0,0,0|2,0,0]=4 2605 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [1,0,1,0,0,0|2,0,0]=4 2606 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [1,0,1,0,0,0|2,0,0]=4 2607 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [1,0,1,0,0,0|2,0,0]=4 2608 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [1,0,1,0,0,0|1,0,0]=3 2609 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [1,0,1,0,0,0|1,0,0]=3 2610 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [1,0,1,0,0,0|2,0,0]=4 2611 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [1,0,1,0,0,0|2,0,0]=4 2612 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [1,0,1,0,0,0|2,0,0]=4 2613 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [1,0,1,0,0,0|2,0,0]=4 2614 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [1,0,1,0,0,0|2,0,0]=4 2615 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [1,0,1,0,0,0|2,0,0]=4 2616 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [1,0,1,0,0,0|2,0,0]=4 2617 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [1,0,1,0,0,0|2,0,0]=4 2618 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [1,0,1,0,0,0|2,0,0]=4 2619 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [1,0,1,0,0,0|2,0,0]=4 2620 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [1,0,1,0,0,0|2,0,0]=4 2621 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [1,0,1,0,0,0|2,0,0]=4 2622 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [1,0,1,0,0,0|2,0,0]=4 2623 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [1,0,1,0,0,0|2,0,0]=4 2624 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [1,0,1,0,0,0|2,0,0]=4 2625 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [1,0,1,0,0,0|2,0,0]=4 2626 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [1,0,1,0,0,0|2,0,0]=4 2627 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [1,0,1,0,0,0|2,0,0]=4 2628 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [1,0,1,0,0,0|2,0,0]=4 2629 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [1,0,1,0,0,0|2,0,0]=4 2630 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [1,0,1,0,0,0|2,0,0]=4 2631 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [1,0,1,0,0,0|2,0,0]=4 2632 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [1,0,1,0,0,0|2,0,0]=4 2633 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [1,0,1,0,0,0|2,0,0]=4 2634 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [1,0,1,0,0,0|2,0,0]=4 2635 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [1,0,1,0,0,0|2,0,0]=4 2636 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [1,0,1,0,0,0|2,0,0]=4 2637 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [1,0,1,0,0,0|2,0,0]=4 2638 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [1,0,1,0,0,0|2,0,0]=4 2639 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [1,0,1,0,0,0|2,0,0]=4 2640 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [1,0,1,0,0,0|1,0,0]=3 2641 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [1,0,1,0,0,0|1,0,0]=3 2642 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [1,0,1,0,0,0|1,0,0]=3 2643 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [1,0,1,0,0,0|2,0,0]=4 2644 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [1,0,1,0,0,0|2,0,0]=4 2645 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [1,0,1,0,0,0|1,0,0]=3 2646 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [1,0,1,0,0,0|1,0,0]=3 2647 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [1,0,1,0,0,0|1,0,0]=3 2648 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [1,0,1,0,0,0|2,0,0]=4 2649 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [1,0,1,0,0,0|2,0,0]=4 2650 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [1,0,1,0,0,0|1,0,0]=3 2651 B6R0.3 O=C([O-])[C@@H](O)CO MCULE-4498291090 [1,0,1,0,0,0|1,0,1]=4 2652 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [1,0,1,0,0,0|2,0,0]=4 2653 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [1,0,1,0,0,0|1,0,0]=3 2654 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [1,0,1,0,0,0|0,1,0]=3 2655 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [1,0,1,0,0,0|2,0,0]=4 2656 B6R0.9 C/C=C(/C=O)\CC MCULE-4811305564 [1,0,1,0,0,0|1,0,1]=4 2657 B6R0.9 C=CC(CCl)OC MCULE-7435605398 [1,0,1,0,0,0|2,0,0]=4 2658 B6R0.9 C=CC(OC)OC MCULE-7212819947 [1,0,1,0,0,0|2,0,0]=4 2659 B6R0.9 CC=C(C=O)CC MCULE-3354209980 [1,0,1,0,0,0|1,0,1]=4 2660 B6R0.9 CCC(=CO)CC MCULE-4973169590 [1,0,1,0,0,0|1,0,1]=4 2661 B6R0.9 CCC(=CO)CC MCULE-8459100577 [1,0,1,0,0,0|1,0,1]=4 2662 B6R0.9 CCC(C=O)CC MCULE-3529464122 [1,0,1,0,0,0|1,0,0]=3 2663 B6R0.9 CCC(CBr)OC MCULE-1656817461 [1,0,1,0,0,0|1,0,1]=4 2664 B6R0.9 CCC(CC)CO MCULE-8799293985 [1,0,1,0,0,0|1,0,1]=4 2665 B6R0.9 CCC(CN)OC MCULE-2981477258 [1,0,1,0,0,0|1,0,1]=4 2666 B6R0.9 CCC(CN)OC MCULE-5102774189 [1,0,1,0,0,0|1,0,1]=4 2667 B6R0.9 CCC(CO)NC MCULE-4151180539 [1,0,1,0,0,0|1,0,1]=4 2668 B6R0.9 CCC(CO)OC MCULE-3822452142 [1,0,1,0,0,0|0,0,1]=3 2669 B6R0.9 CCC(OC)OC MCULE-8987892974 [1,0,1,0,0,0|2,0,0]=4 2670 B6R0.9 CCN(C=O)CC MCULE-9053231156 [1,0,1,0,0,0|2,0,0]=4 2671 B6R0.9 CC[C@@H](CO)NC MCULE-6281808613 [1,0,1,0,0,0|1,0,1]=4 2672 B6R0.9 COC(C=O)OC MCULE-7354932286 [1,0,1,0,0,0|1,0,0]=3 2673 B6R0.9 COC(CN)CO MCULE-2486586573 [1,0,1,0,0,0|1,0,1]=4 2674 B6R0.9 COC(CN)CO MCULE-3908535917 [1,0,1,0,0,0|1,0,1]=4 2675 B6R0.9 COC(CO)CBr MCULE-4957036064 [1,0,1,0,0,0|1,0,1]=4 2676 B6R0.9 COC(CO)CO MCULE-4778743592 [1,0,1,0,0,0|1,0,1]=4 2677 B6R0.9 COC(CO)OC MCULE-1980066235 [1,0,1,0,0,0|1,0,1]=4 2678 B6R0.9 CO[C@H](CN)CO MCULE-6065862053 [1,0,1,0,0,0|1,0,1]=4 2679 B6R1.2 BrC1CCCC1 MCULE-9383923023 [2,0,0,0,0,0|2,0,0]=4 2680 B6R1.2 C1(CCNC1)O MCULE-2676539647 [2,0,0,0,0,0|2,0,0]=4 2681 B6R1.2 C1(CCNC1)O MCULE-4228466615 [2,0,0,0,0,0|2,0,0]=4 2682 B6R1.2 C1(CCOC1)O MCULE-3631749536 [2,0,0,0,0,0|2,0,0]=4 2683 B6R1.2 C=C1CCCC1 MCULE-4115373196 [2,0,0,0,0,0|1,0,1]=4 2684 B6R1.2 CC1CCCC1 MCULE-4702116068 [2,0,0,0,0,0|1,0,1]=4 2685 B6R1.2 CC1CCCN1 MCULE-4853624560 [2,0,0,0,0,0|1,0,1]=4 2686 B6R1.2 CC1CCCN1 MCULE-5939948024 [2,0,0,0,0,0|1,0,1]=4 2687 B6R1.2 CC1CCCN1 MCULE-6020011445 [2,0,0,0,0,0|1,0,1]=4 2688 B6R1.2 CC1CCCN1 MCULE-7855346849 [2,0,0,0,0,0|1,0,1]=4 2689 B6R1.2 CC1CCCO1 MCULE-2526138687 [2,0,0,0,0,0|0,0,1]=3 2690 B6R1.2 CC1CCCS1 MCULE-8372499972 [2,0,0,0,0,0|0,1,1]=4 2691 B6R1.2 CC1COCO1 MCULE-9332316279 [2,0,0,0,0,0|1,0,1]=4 2692 B6R1.2 CC1OCCO1 MCULE-2943809591 [2,0,0,0,0,0|1,0,1]=4 2693 B6R1.2 C[C@@H]1CCCN1 MCULE-1038329474 [2,0,0,0,0,0|1,0,1]=4 2694 B6R1.2 C[C@@H]1CCCN1 MCULE-1829999308 [2,0,0,0,0,0|1,0,1]=4 2695 B6R1.2 C[C@@H]1CCCN1 MCULE-8644278041 [2,0,0,0,0,0|1,0,1]=4 2696 B6R1.2 C[C@@H]1CCCN1 MCULE-9243990647 [2,0,0,0,0,0|1,0,1]=4 2697 B6R1.2 C[C@H]1CCCN1 MCULE-2078024663 [2,0,0,0,0,0|1,0,1]=4 2698 B6R1.2 C[C@H]1CCCN1 MCULE-3113877345 [2,0,0,0,0,0|1,0,1]=4 2699 B6R1.2 C[C@H]1CCCN1 MCULE-3426869473 [2,0,0,0,0,0|1,0,1]=4 2700 B6R1.2 C[C@H]1CCCN1 MCULE-5093266679 [2,0,0,0,0,0|1,0,1]=4 2701 B6R1.2 ClC1CCCC1 MCULE-3285928655 [2,0,0,0,0,0|2,0,0]=4 2702 B6R1.2 FC1CCCC1 MCULE-1416016970 [2,0,0,0,0,0|2,0,0]=4 2703 B6R1.2 F[C@H]1CCCN1 MCULE-8612757365 [2,0,0,0,0,0|2,0,0]=4 2704 B6R1.2 IC1CCCC1 MCULE-2705379744 [2,0,0,0,0,0|2,0,0]=4 2705 B6R1.2 NC1CCCC1 MCULE-2292038009 [2,0,0,0,0,0|2,0,0]=4 2706 B6R1.2 O=C1CCCC1 MCULE-9455227735 [2,0,0,0,0,0|1,0,1]=4 2707 B6R1.2 O=C1CCCN1 MCULE-3061780794 [2,0,0,0,0,0|1,0,1]=4 2708 B6R1.2 O=C1CCCO1 MCULE-6795890265 [2,0,0,0,0,0|0,0,1]=3 2709 B6R1.2 O=C1CCCS1 MCULE-5361654550 [2,0,0,0,0,0|0,1,1]=4 2710 B6R1.2 O=C1NCCO1 MCULE-3934923008 [2,0,0,0,0,0|1,0,1]=4 2711 B6R1.2 O=C1OCCO1 MCULE-9493253045 [2,0,0,0,0,0|1,0,1]=4 2712 B6R1.2 O=S1CCCC1 MCULE-2442126780 [2,0,0,0,0,0|2,0,0]=4 2713 B6R1.2 O=S1OCCO1 MCULE-5773173321 [2,0,0,0,0,0|2,0,0]=4 2714 B6R1.2 OC1C=CCC1 MCULE-3857764876 [2,0,0,0,0,0|1,0,1]=4 2715 B6R1.2 OC1C=CCO1 MCULE-4636930669 [2,0,0,0,0,0|0,0,2]=4 2716 B6R1.2 OC1CCCC1 MCULE-1758440264 [2,0,0,0,0,0|1,0,0]=3 2717 B6R1.2 OC1CCCN1 MCULE-4787168972 [2,0,0,0,0,0|1,0,0]=3 2718 B6R1.2 OC1CCCO1 MCULE-9632627344 [2,0,0,0,0,0|0,0,0]=2 2719 B6R1.2 OC1CCNC1 MCULE-4307402606 [2,0,0,0,0,0|2,0,0]=4 2720 B6R1.2 OC1CCNC1 MCULE-6745480350 [2,0,0,0,0,0|2,0,0]=4 2721 B6R1.2 OC1CCOC1 MCULE-4469581028 [2,0,0,0,0,0|2,0,0]=4 2722 B6R1.2 OC1CCSC1 MCULE-9796808599 [2,0,0,0,0,0|2,0,0]=4 2723 B6R1.2 O[C@@H]1CCNC1 MCULE-8116497337 [2,0,0,0,0,0|2,0,0]=4 2724 B6R1.2 O[C@@H]1CCNC1 MCULE-8578068948 [2,0,0,0,0,0|2,0,0]=4 2725 B6R1.2 O[C@@H]1CCNC1 MCULE-9094582248 [2,0,0,0,0,0|2,0,0]=4 2726 B6R1.2 O[C@@H]1CCNC1 MCULE-9933593352 [2,0,0,0,0,0|2,0,0]=4 2727 B6R1.2 O[C@@H]1CCOC1 MCULE-7739141732 [2,0,0,0,0,0|2,0,0]=4 2728 B6R1.2 O[C@@H]1CCOC1 MCULE-8344812226 [2,0,0,0,0,0|2,0,0]=4 2729 B6R1.2 O[C@@H]1CCOC1 MCULE-9098074990 [2,0,0,0,0,0|2,0,0]=4 2730 B6R1.2 O[C@@H]1CCSC1 MCULE-3532754705 [2,0,0,0,0,0|2,0,0]=4 2731 B6R1.2 O[C@@H]1CCSC1 MCULE-5800407146 [2,0,0,0,0,0|2,0,0]=4 2732 B6R1.2 O[C@H]1CCNC1 MCULE-1100098088 [2,0,0,0,0,0|2,0,0]=4 2733 B6R1.2 O[C@H]1CCNC1 MCULE-3493644065 [2,0,0,0,0,0|2,0,0]=4 2734 B6R1.2 O[C@H]1CCNC1 MCULE-3778918259 [2,0,0,0,0,0|2,0,0]=4 2735 B6R1.2 O[C@H]1CCNC1 MCULE-4680162054 [2,0,0,0,0,0|2,0,0]=4 2736 B6R1.2 O[C@H]1CCOC1 MCULE-8518846297 [2,0,0,0,0,0|2,0,0]=4 2737 B6R1.2 O[C@H]1CCOC1 MCULE-9544747995 [2,0,0,0,0,0|2,0,0]=4 2738 B6R1.2 P1(=O)OCCO1 MCULE-3753821837 [2,0,0,0,0,0|2,0,0]=4 2739 B6R1.2 SC1CCCC1 MCULE-5932400506 [2,0,0,0,0,0|1,1,0]=4 2740 B8R0.5 C#CCC(N)CC(=O)O MCULE-2010410671 [0,1,1,0,0,0|1,0,1]=4 2741 B8R0.5 C#CCC(N)CC(=O)O MCULE-9655976746 [0,1,1,0,0,0|1,0,1]=4 2742 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-1849013560 [0,1,1,0,0,0|1,0,1]=4 2743 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-5050240935 [0,1,1,0,0,0|1,0,1]=4 2744 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-7394019004 [0,1,1,0,0,0|1,0,1]=4 2745 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-8376747540 [0,1,1,0,0,0|1,0,1]=4 2746 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-1446527937 [0,1,1,0,0,0|1,0,1]=4 2747 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-4559086818 [0,1,1,0,0,0|1,0,1]=4 2748 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-5154381271 [0,1,1,0,0,0|1,0,1]=4 2749 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-9666448400 [0,1,1,0,0,0|1,0,1]=4 2750 B8R0.5 C=C(CCC)CC(=O)O MCULE-5240115049 [0,1,1,0,0,0|1,0,0]=3 2751 B8R0.5 C=CCC(N)CC(=O)O MCULE-1468461223 [0,1,1,0,0,0|1,0,1]=4 2752 B8R0.5 C=CCC(N)CC(=O)O MCULE-3288937491 [0,1,1,0,0,0|1,0,1]=4 2753 B8R0.5 C=CCC(N)CC(=O)O MCULE-4022730599 [0,1,1,0,0,0|1,0,1]=4 2754 B8R0.5 C=CCC(N)CC(=O)O MCULE-5843795649 [0,1,1,0,0,0|1,0,1]=4 2755 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-4754294062 [0,1,1,0,0,0|1,0,1]=4 2756 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-7831408077 [0,1,1,0,0,0|1,0,1]=4 2757 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-8503288377 [0,1,1,0,0,0|1,0,1]=4 2758 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-9398972010 [0,1,1,0,0,0|1,0,1]=4 2759 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-1784444892 [0,1,1,0,0,0|1,0,1]=4 2760 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-3247296447 [0,1,1,0,0,0|1,0,1]=4 2761 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-5484030094 [0,1,1,0,0,0|1,0,1]=4 2762 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-8982980423 [0,1,1,0,0,0|1,0,1]=4 2763 B8R0.5 CC(=O)CN(C)CCO MCULE-4972701308 [0,1,1,0,0,0|2,0,0]=4 2764 B8R0.5 CC(O)CC(O)CCO MCULE-4888514297 [0,1,1,0,0,0|1,0,1]=4 2765 B8R0.5 CCC/C(=C/C(=O)O)/C MCULE-2055195599 [0,1,1,0,0,0|1,0,1]=4 2766 B8R0.5 CCCC(=CC(=O)O)C MCULE-9033187683 [0,1,1,0,0,0|1,0,1]=4 2767 B8R0.5 CCCC(=O)CC(=O)C MCULE-1126963023 [0,1,1,0,0,0|2,0,0]=4 2768 B8R0.5 CCCC(=O)CC(=O)O MCULE-8977313826 [0,1,1,0,0,0|1,0,0]=3 2769 B8R0.5 CCCC(C)CC(=O)C MCULE-7925360299 [0,1,1,0,0,0|2,0,0]=4 2770 B8R0.5 CCCC(C)CC(=O)O MCULE-6002154473 [0,1,1,0,0,0|1,0,0]=3 2771 B8R0.5 CCCC(N)CC(=O)O MCULE-1356349547 [0,1,1,0,0,0|1,0,0]=3 2772 B8R0.5 CCCC(N)CC(=O)O MCULE-4946770886 [0,1,1,0,0,0|1,0,0]=3 2773 B8R0.5 CCCC(N)CC(=O)O MCULE-5502250330 [0,1,1,0,0,0|1,0,0]=3 2774 B8R0.5 CCCC(N)CC(=O)O MCULE-9959180111 [0,1,1,0,0,0|1,0,0]=3 2775 B8R0.5 CCCC(O)CC(=O)O MCULE-3158579605 [0,1,1,0,0,0|1,0,0]=3 2776 B8R0.5 CCCN(C)CC(=O)O MCULE-2690950295 [0,1,1,0,0,0|1,0,0]=3 2777 B8R0.5 CCCN(C)CC(=O)O MCULE-9588106269 [0,1,1,0,0,0|1,0,0]=3 2778 B8R0.5 CCCS(=O)CC(=O)O MCULE-4278595326 [0,1,1,0,0,0|0,1,0]=3 2779 B8R0.5 CCC[C@@H](N)CC(=O)O MCULE-9961668094 [0,1,1,0,0,0|1,0,0]=3 2780 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-1726586898 [0,1,1,0,0,0|1,0,0]=3 2781 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5359238908 [0,1,1,0,0,0|1,0,0]=3 2782 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5593873511 [0,1,1,0,0,0|1,0,0]=3 2783 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-7588873691 [0,1,1,0,0,0|1,0,0]=3 2784 B8R0.5 CCNC(=O)CC(=O)O MCULE-6073095545 [0,1,1,0,0,0|2,0,0]=4 2785 B8R0.5 CCNC(C)CC(=O)O MCULE-2938286546 [0,1,1,0,0,0|2,0,0]=4 2786 B8R0.5 CCNC(C)CC(=O)O MCULE-4848873654 [0,1,1,0,0,0|2,0,0]=4 2787 B8R0.5 CCOC(=O)CC(=O)O MCULE-9495505919 [0,1,1,0,0,0|2,0,0]=4 2788 B8R0.5 CCSC(C)CC(=O)O MCULE-9735540046 [0,1,1,0,0,0|2,0,0]=4 2789 B8R0.5 CN(CCO)CC(=O)O MCULE-9266824629 [0,1,1,0,0,0|1,0,0]=3 2790 B8R0.5 CNCC(O)CC(=O)O MCULE-4502865855 [0,1,1,0,0,0|2,0,0]=4 2791 B8R0.5 CNCC(O)CC(=O)O MCULE-5628718703 [0,1,1,0,0,0|2,0,0]=4 2792 B8R0.5 COCC(C)CC(=O)O MCULE-7551495663 [0,1,1,0,0,0|2,0,0]=4 2793 B8R0.5 NCCC(O)CC(=O)O MCULE-3095949832 [0,1,1,0,0,0|1,0,0]=3 2794 B8R0.5 NCCC(O)CC(=O)O MCULE-8864780829 [0,1,1,0,0,0|1,0,0]=3 2795 B8R0.6 C#CCCCC(=O)OC MCULE-1834140672 [0,1,1,0,0,0|1,0,1]=4 2796 B8R0.6 C#CCOCC(=O)OC MCULE-8743984162 [0,1,1,0,0,0|0,0,2]=4 2797 B8R0.6 C=CC(=O)CCCCC MCULE-9094274880 [0,1,1,0,0,0|2,0,0]=4 2798 B8R0.6 C=CC(=O)OCCCO MCULE-7957370216 [0,1,1,0,0,0|2,0,0]=4 2799 B8R0.6 C=CCCCC(=O)OC MCULE-4913183131 [0,1,1,0,0,0|1,0,1]=4 2800 B8R0.6 C=CCOCC(=O)OC MCULE-7670885186 [0,1,1,0,0,0|0,0,2]=4 2801 B8R0.6 CCC/C=C/C(=O)OC MCULE-6273561448 [0,1,1,0,0,0|1,0,1]=4 2802 B8R0.6 CCC=CCC(=O)OC MCULE-6432541061 [0,1,1,0,0,0|1,0,1]=4 2803 B8R0.6 CCCC#CC(=O)OC MCULE-1573744334 [0,1,1,0,0,0|1,0,1]=4 2804 B8R0.6 CCCC=CC(=O)OC MCULE-1227063444 [0,1,1,0,0,0|1,0,1]=4 2805 B8R0.6 CCCCCC(=N)NO MCULE-4721600537 [0,1,1,0,0,0|2,0,0]=4 2806 B8R0.6 CCCCCC(=O)CBr MCULE-6642335283 [0,1,1,0,0,0|2,0,0]=4 2807 B8R0.6 CCCCCC(=O)CC MCULE-2012071553 [0,1,1,0,0,0|2,0,0]=4 2808 B8R0.6 CCCCCC(=O)NN MCULE-3138841743 [0,1,1,0,0,0|2,0,0]=4 2809 B8R0.6 CCCCCC(=O)NO MCULE-8432990947 [0,1,1,0,0,0|1,0,0]=3 2810 B8R0.6 CCCCCC(=O)OC MCULE-2317616388 [0,1,1,0,0,0|1,0,0]=3 2811 B8R0.6 CCCCOC(=O)CO MCULE-4016266350 [0,1,1,0,0,0|2,0,0]=4 2812 B8R0.6 CCCNCC(=O)NC MCULE-4750972571 [0,1,1,0,0,0|2,0,0]=4 2813 B8R0.6 CCCNCC(=O)OC MCULE-3321545319 [0,1,1,0,0,0|1,0,0]=3 2814 B8R0.6 CCCNCC(=O)OC MCULE-5989619684 [0,1,1,0,0,0|1,0,0]=3 2815 B8R0.6 CCCOCC(C)CO MCULE-8326797774 [0,1,1,0,0,0|1,0,1]=4 2816 B8R0.6 CCCOCC(O)CO MCULE-8815613620 [0,1,1,0,0,0|0,0,2]=4 2817 B8R0.6 CCCOC[C@H](O)CO MCULE-7750792134 [0,1,1,0,0,0|0,0,2]=4 2818 B8R0.6 CCCSCC(=O)OC MCULE-3865642484 [0,1,1,0,0,0|0,1,0]=3 2819 B8R0.6 CCNCCC(=O)OC MCULE-4846173976 [0,1,1,0,0,0|2,0,0]=4 2820 B8R0.6 CCSCCC(=O)OC MCULE-5773388371 [0,1,1,0,0,0|2,0,0]=4 2821 B8R0.6 CNC(=O)NCCCO MCULE-3093590717 [0,1,1,0,0,0|2,0,0]=4 2822 B8R0.6 CNCCCC(=O)OC MCULE-2437073705 [0,1,1,0,0,0|2,0,0]=4 2823 B8R0.6 CNCCCC(=O)OC MCULE-6776715081 [0,1,1,0,0,0|2,0,0]=4 2824 B8R0.6 COC(=O)CCCC#N MCULE-9088492518 [0,1,1,0,0,0|1,0,1]=4 2825 B8R0.6 COC(=O)CCCC=O MCULE-2183669341 [0,1,1,0,0,0|0,0,2]=4 2826 B8R0.6 COC(=O)CCCCBr MCULE-8354790214 [0,1,1,0,0,0|1,0,0]=3 2827 B8R0.6 COC(=O)CCCCCl MCULE-7057883989 [0,1,1,0,0,0|1,0,0]=3 2828 B8R0.6 COC(=O)CCCCI MCULE-1527923255 [0,1,1,0,0,0|1,0,0]=3 2829 B8R0.6 COC(=O)CCCCN MCULE-3452725442 [0,1,1,0,0,0|1,0,0]=3 2830 B8R0.6 COC(=O)CCCCN MCULE-8816545129 [0,1,1,0,0,0|1,0,0]=3 2831 B8R0.6 COC(=O)CCCCO MCULE-2443996181 [0,1,1,0,0,0|0,0,0]=2 2832 B8R0.6 COC(=O)CCCCS MCULE-5194099368 [0,1,1,0,0,0|0,1,0]=3 2833 B8R0.6 COC(=O)CCCON MCULE-1522874324 [0,1,1,0,0,0|2,0,0]=4 2834 B8R0.6 COC(=O)CCCON MCULE-4748610058 [0,1,1,0,0,0|2,0,0]=4 2835 B8R0.6 COC(=O)CCCSC MCULE-7320944174 [0,1,1,0,0,0|2,0,0]=4 2836 B8R0.6 COC(=O)COCCCl MCULE-4344602258 [0,1,1,0,0,0|1,0,0]=3 2837 B8R0.6 COC(=O)COCCN MCULE-5090944064 [0,1,1,0,0,0|1,0,0]=3 2838 B8R0.6 COC(=O)COCCN MCULE-6748820855 [0,1,1,0,0,0|1,0,0]=3 2839 B8R0.6 COC(=O)COCCO MCULE-7869619911 [0,1,1,0,0,0|1,0,0]=3 2840 B8R0.6 COC(=O)CSCCN MCULE-5578128958 [0,1,1,0,0,0|1,1,0]=4 2841 B8R0.6 COC(=O)CSCCN MCULE-6891143571 [0,1,1,0,0,0|1,1,0]=4 2842 B8R0.6 COCCCC(=O)OC MCULE-4109110804 [0,1,1,0,0,0|2,0,0]=4 2843 B8R0.6 N#CC(O)CCCCO MCULE-3554580179 [0,1,1,0,0,0|1,0,1]=4 2844 B8R0.6 NCC(=O)NCCCO MCULE-3346996357 [0,1,1,0,0,0|2,0,0]=4 2845 B8R0.6 NCC(=O)NCCCO MCULE-5088922472 [0,1,1,0,0,0|2,0,0]=4 2846 B8R0.6 NNC(=O)COCCO MCULE-8424164288 [0,1,1,0,0,0|2,0,0]=4 2847 B8R0.6 O=C(CCl)NCCCO MCULE-7154051707 [0,1,1,0,0,0|2,0,0]=4 2848 B8R0.6 OCCCCC(O)CO MCULE-5891501842 [0,1,1,0,0,0|0,0,2]=4 2849 B8R0.7 C#CCCCCC(=O)O MCULE-5828767633 [0,1,1,0,0,0|1,0,0]=3 2850 B8R0.7 C#CCCOCC(=O)O MCULE-5200842540 [0,1,1,0,0,0|0,0,1]=3 2851 B8R0.7 C#CCOCCC(=O)O MCULE-9710662304 [0,1,1,0,0,0|0,0,2]=4 2852 B8R0.7 C=CCCCCC(=O)C MCULE-4268619428 [0,1,1,0,0,0|2,0,0]=4 2853 B8R0.7 C=CCCCCC(=O)O MCULE-1991116122 [0,1,1,0,0,0|1,0,0]=3 2854 B8R0.7 C=CCCNCC(=O)O MCULE-7775351645 [0,1,1,0,0,0|1,0,1]=4 2855 B8R0.7 C=CCCOCC(=O)O MCULE-8626594933 [0,1,1,0,0,0|0,0,1]=3 2856 B8R0.7 C=CCOCCC(=O)O MCULE-6102747899 [0,1,1,0,0,0|0,0,2]=4 2857 B8R0.7 CC#CCCCC(=O)O MCULE-2531382210 [0,1,1,0,0,0|1,0,1]=4 2858 B8R0.7 CC(=O)CCCCC#N MCULE-2841814511 [0,1,1,0,0,0|2,0,0]=4 2859 B8R0.7 CC(=O)CCCCCBr MCULE-8946921118 [0,1,1,0,0,0|2,0,0]=4 2860 B8R0.7 CC(=O)CCCCCN MCULE-3568024595 [0,1,1,0,0,0|2,0,0]=4 2861 B8R0.7 CC(=O)CCCCCN MCULE-9938894581 [0,1,1,0,0,0|2,0,0]=4 2862 B8R0.7 CC(=O)NCCCCN MCULE-6666803790 [0,1,1,0,0,0|2,0,0]=4 2863 B8R0.7 CC(=O)NCCCCN MCULE-8971714473 [0,1,1,0,0,0|2,0,0]=4 2864 B8R0.7 CC(=O)NCCCCO MCULE-5119895862 [0,1,1,0,0,0|1,0,0]=3 2865 B8R0.7 CC(=O)OCCCCBr MCULE-6081921662 [0,1,1,0,0,0|2,0,0]=4 2866 B8R0.7 CC(=O)OCCCCCl MCULE-3999602136 [0,1,1,0,0,0|2,0,0]=4 2867 B8R0.7 CC(=O)OCCCCI MCULE-6699791525 [0,1,1,0,0,0|2,0,0]=4 2868 B8R0.7 CC(=O)OCCCCO MCULE-7064721476 [0,1,1,0,0,0|1,0,0]=3 2869 B8R0.7 CC(=O)SCCCCBr MCULE-1636667997 [0,1,1,0,0,0|2,0,0]=4 2870 B8R0.7 CC(=O)SCCCCN MCULE-2425585672 [0,1,1,0,0,0|2,0,0]=4 2871 B8R0.7 CC(=O)SCCCCN MCULE-9899884734 [0,1,1,0,0,0|2,0,0]=4 2872 B8R0.7 CC=CCCCC(=O)O MCULE-3300087433 [0,1,1,0,0,0|1,0,1]=4 2873 B8R0.7 CCCC/C=C/C(=O)O MCULE-6916224344 [0,1,1,0,0,0|1,0,1]=4 2874 B8R0.7 CCCC=CCC(=O)O MCULE-3879649411 [0,1,1,0,0,0|1,0,0]=3 2875 B8R0.7 CCCCC#CC(=O)O MCULE-4160128187 [0,1,1,0,0,0|1,0,1]=4 2876 B8R0.7 CCCCC=CC(=O)O MCULE-6837768730 [0,1,1,0,0,0|1,0,1]=4 2877 B8R0.7 CCCCCCC(=O)C MCULE-1152821440 [0,1,1,0,0,0|2,0,0]=4 2878 B8R0.7 CCCCCCC(=O)Cl MCULE-8559884798 [0,1,1,0,0,0|2,0,0]=4 2879 B8R0.7 CCCCCCC(=O)N MCULE-1210996881 [0,1,1,0,0,0|2,0,0]=4 2880 B8R0.7 CCCCCCC(=O)O MCULE-1489137568 [0,1,1,0,0,0|1,0,0]=3 2881 B8R0.7 CCCCCCC(=O)[O-] MCULE-1711655800 [0,1,1,0,0,0|1,0,1]=4 2882 B8R0.7 CCCCCNC(=O)N MCULE-3139270247 [0,1,1,0,0,0|2,0,0]=4 2883 B8R0.7 CCCCCOC(=O)C MCULE-4911325533 [0,1,1,0,0,0|2,0,0]=4 2884 B8R0.7 CCCCCOC(=O)Cl MCULE-2896207255 [0,1,1,0,0,0|2,0,0]=4 2885 B8R0.7 CCCCNCC(=O)N MCULE-1276341431 [0,1,1,0,0,0|2,0,0]=4 2886 B8R0.7 CCCCNCC(=O)N MCULE-6579402071 [0,1,1,0,0,0|2,0,0]=4 2887 B8R0.7 CCCCNCC(=O)O MCULE-4725221957 [0,1,1,0,0,0|1,0,0]=3 2888 B8R0.7 CCCCOCC(=O)O MCULE-9634255761 [0,1,1,0,0,0|0,0,0]=2 2889 B8R0.7 CCCCOCC(C)O MCULE-6350800869 [0,1,1,0,0,0|1,0,1]=4 2890 B8R0.7 CCCCSCC(=O)O MCULE-3580384865 [0,1,1,0,0,0|0,1,0]=3 2891 B8R0.7 CCCNCCC(=O)N MCULE-2654608736 [0,1,1,0,0,0|2,0,0]=4 2892 B8R0.7 CCCNCCC(=O)N MCULE-2683588523 [0,1,1,0,0,0|2,0,0]=4 2893 B8R0.7 CCCNCCC(=O)O MCULE-3144740259 [0,1,1,0,0,0|1,0,0]=3 2894 B8R0.7 CCCNCCC(=O)O MCULE-3866165037 [0,1,1,0,0,0|1,0,0]=3 2895 B8R0.7 CCCOCCC(=O)O MCULE-1927238608 [0,1,1,0,0,0|0,0,0]=2 2896 B8R0.7 CCCSC=CC(=O)O MCULE-3074287995 [0,1,1,0,0,0|0,1,1]=4 2897 B8R0.7 CCCSCCC(=O)O MCULE-6454518290 [0,1,1,0,0,0|0,1,0]=3 2898 B8R0.7 CCNCCCC(=O)O MCULE-7019386199 [0,1,1,0,0,0|1,0,0]=3 2899 B8R0.7 CCNCCCC(=O)O MCULE-8568253592 [0,1,1,0,0,0|1,0,0]=3 2900 B8R0.7 CCOCCCC(=O)O MCULE-9064011886 [0,1,1,0,0,0|1,0,0]=3 2901 B8R0.7 CNCCCCC(=O)O MCULE-4298567521 [0,1,1,0,0,0|1,0,0]=3 2902 B8R0.7 CNCCCCC(=O)O MCULE-5688320983 [0,1,1,0,0,0|1,0,0]=3 2903 B8R0.7 CNCCOCC(=O)O MCULE-5408672373 [0,1,1,0,0,0|0,0,0]=2 2904 B8R0.7 COCCCCB(O)O MCULE-5339704839 [0,1,1,0,0,0|1,0,1]=4 2905 B8R0.7 COCCCCC(=O)O MCULE-1268596288 [0,1,1,0,0,0|0,0,0]=2 2906 B8R0.7 COCCCCN(=O)=O MCULE-3527542330 [0,1,1,0,0,0|1,0,1]=4 2907 B8R0.7 COCCCNC(=O)C MCULE-4149128250 [0,1,1,0,0,0|2,0,0]=4 2908 B8R0.7 COCCCNC(=O)N MCULE-4038737956 [0,1,1,0,0,0|2,0,0]=4 2909 B8R0.7 COCCNCC(=O)N MCULE-2300508230 [0,1,1,0,0,0|2,0,0]=4 2910 B8R0.7 COCCNCC(=O)N MCULE-7059174365 [0,1,1,0,0,0|2,0,0]=4 2911 B8R0.7 COCCNCC(=O)O MCULE-2703110743 [0,1,1,0,0,0|1,0,0]=3 2912 B8R0.7 COCCNCC(=O)O MCULE-5854004501 [0,1,1,0,0,0|1,0,0]=3 2913 B8R0.7 COCCOCC(=O)C MCULE-5956367525 [0,1,1,0,0,0|1,0,0]=3 2914 B8R0.7 COCCOCC(=O)Cl MCULE-9321414156 [0,1,1,0,0,0|1,0,0]=3 2915 B8R0.7 COCCOCC(=O)N MCULE-8987780803 [0,1,1,0,0,0|1,0,0]=3 2916 B8R0.7 COCCOCC(=O)O MCULE-2561278418 [0,1,1,0,0,0|0,0,0]=2 2917 B8R0.7 COCCSCC(=O)O MCULE-2908610834 [0,1,1,0,0,0|0,1,0]=3 2918 B8R0.7 CSCCCCC(=O)O MCULE-4498129620 [0,1,1,0,0,0|0,1,0]=3 2919 B8R0.7 CSCCNCC(=O)O MCULE-1747724833 [0,1,1,0,0,0|1,0,0]=3 2920 B8R0.7 CSCCNCC(=O)O MCULE-9991325079 [0,1,1,0,0,0|1,0,0]=3 2921 B8R0.7 CSCCOCC(=O)O MCULE-2038020159 [0,1,1,0,0,0|0,0,0]=2 2922 B8R0.7 CSSCCCC(=O)O MCULE-7947744639 [0,1,1,0,0,0|1,1,0]=4 2923 B8R0.7 N#CCCCCC(=O)N MCULE-7791035164 [0,1,1,0,0,0|2,0,0]=4 2924 B8R0.7 N#CCCCCC(=O)O MCULE-1900756226 [0,1,1,0,0,0|1,0,0]=3 2925 B8R0.7 N#CCCNCC(=O)O MCULE-9226456604 [0,1,1,0,0,0|1,0,1]=4 2926 B8R0.7 N#N=NCCCC(=O)O MCULE-1397586704 [0,1,1,0,0,0|2,0,0]=4 2927 B8R0.7 NC(=O)CCCCCBr MCULE-6938202710 [0,1,1,0,0,0|2,0,0]=4 2928 B8R0.7 NC(=O)CCCCCO MCULE-2654184294 [0,1,1,0,0,0|1,0,0]=3 2929 B8R0.7 NC(=O)CCNCCS MCULE-4682566242 [0,1,1,0,0,0|1,1,0]=4 2930 B8R0.7 NCCCCCC(=O)N MCULE-1692086577 [0,1,1,0,0,0|2,0,0]=4 2931 B8R0.7 NCCCCCC(=O)N MCULE-2191237198 [0,1,1,0,0,0|2,0,0]=4 2932 B8R0.7 NCCCCCC(=O)O MCULE-3640363033 [0,1,1,0,0,0|1,0,0]=3 2933 B8R0.7 NCCCCCC(=O)O MCULE-6389520144 [0,1,1,0,0,0|1,0,0]=3 2934 B8R0.7 NCCCCCC(=O)[O-] MCULE-7336458907 [0,1,1,0,0,0|1,0,1]=4 2935 B8R0.7 NCCCCNC(=O)N MCULE-6339634491 [0,1,1,0,0,0|2,0,0]=4 2936 B8R0.7 NCCCCNC(=O)N MCULE-8210849027 [0,1,1,0,0,0|2,0,0]=4 2937 B8R0.7 NCCCNCC(=O)O MCULE-6526080048 [0,1,1,0,0,0|1,0,0]=3 2938 B8R0.7 NCCCNCC(=O)O MCULE-6762903438 [0,1,1,0,0,0|1,0,0]=3 2939 B8R0.7 NCCCOCC(=O)O MCULE-6428539436 [0,1,1,0,0,0|0,0,0]=2 2940 B8R0.7 NCCNCCC(=O)O MCULE-6596967912 [0,1,1,0,0,0|1,0,0]=3 2941 B8R0.7 NCCNCCC(=O)[O-] MCULE-8896439746 [0,1,1,0,0,0|1,0,1]=4 2942 B8R0.7 NCCOCCC(=O)O MCULE-8535110656 [0,1,1,0,0,0|1,0,0]=3 2943 B8R0.7 NCCOCCC(=O)O MCULE-9124828795 [0,1,1,0,0,0|1,0,0]=3 2944 B8R0.7 NCCSCCC(=O)O MCULE-5309234181 [0,1,1,0,0,0|1,0,0]=3 2945 B8R0.7 NOCCCCC(=O)O MCULE-2022616022 [0,1,1,0,0,0|0,0,0]=2 2946 B8R0.7 NOCCCCC(=O)O MCULE-9375312454 [0,1,1,0,0,0|0,0,0]=2 2947 B8R0.7 O=C(Cl)CCCCCBr MCULE-4314610726 [0,1,1,0,0,0|2,0,0]=4 2948 B8R0.7 O=C(Cl)CCCCCCl MCULE-4526081631 [0,1,1,0,0,0|2,0,0]=4 2949 B8R0.7 O=C(Cl)OCCCCCl MCULE-4992919323 [0,1,1,0,0,0|2,0,0]=4 2950 B8R0.7 O=C(O)CCCCCBr MCULE-2086088700 [0,1,1,0,0,0|1,0,0]=3 2951 B8R0.7 O=C(O)CCCCCCl MCULE-3419329115 [0,1,1,0,0,0|1,0,0]=3 2952 B8R0.7 O=C(O)CCCCCF MCULE-6736431365 [0,1,1,0,0,0|1,0,0]=3 2953 B8R0.7 O=C(O)CCCCCO MCULE-9202536119 [0,1,1,0,0,0|0,0,0]=2 2954 B8R0.7 O=C(O)CCCCCS MCULE-1414350107 [0,1,1,0,0,0|0,1,0]=3 2955 B8R0.7 O=C(O)CCNCCO MCULE-6594831168 [0,1,1,0,0,0|0,0,0]=2 2956 B8R0.7 O=C(O)CCOCCBr MCULE-8991363781 [0,1,1,0,0,0|1,0,0]=3 2957 B8R0.7 O=C(O)CCOCCO MCULE-7271806926 [0,1,1,0,0,0|0,0,0]=2 2958 B8R0.7 O=C(O)CCOCCS MCULE-2136117046 [0,1,1,0,0,0|0,1,0]=3 2959 B8R0.7 O=C(O)CCSCCO MCULE-4689447674 [0,1,1,0,0,0|0,0,0]=2 2960 B8R0.7 O=C(O)COCCCBr MCULE-2393807719 [0,1,1,0,0,0|0,0,0]=2 2961 B8R0.7 O=C([O-])CCCCCCl MCULE-7341419838 [0,1,1,0,0,0|1,0,1]=4 2962 B8R0.7 O=C([O-])CCCCCO MCULE-5897469112 [0,1,1,0,0,0|0,0,1]=3 2963 B8R0.7 O=C([O-])CCCCCO MCULE-9397608140 [0,1,1,0,0,0|0,0,1]=3 2964 B8R0.7 O=CCCCCC(=O)O MCULE-8762346998 [0,1,1,0,0,0|0,0,1]=3 2965 B8R0.7 O=CNCCCC(=O)O MCULE-9120755173 [0,1,1,0,0,0|0,0,2]=4 2966 B8R0.7 O=N(=O)CCCCCO MCULE-8742649710 [0,1,1,0,0,0|1,0,1]=4 2967 B8R0.7 O=N(=O)OCCCCO MCULE-8113401389 [0,1,1,0,0,0|1,0,1]=4 2968 B8R0.8 C#CCCC(N)C(=O)O MCULE-2306841483 [0,1,1,0,0,0|1,0,1]=4 2969 B8R0.8 C#CCCC(O)C(=O)O MCULE-1983462487 [0,1,1,0,0,0|1,0,1]=4 2970 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-3328230047 [0,1,1,0,0,0|1,0,1]=4 2971 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-8588363102 [0,1,1,0,0,0|1,0,1]=4 2972 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-3269292516 [0,1,1,0,0,0|1,0,1]=4 2973 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6769399323 [0,1,1,0,0,0|1,0,1]=4 2974 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6930343823 [0,1,1,0,0,0|1,0,1]=4 2975 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-9522590396 [0,1,1,0,0,0|1,0,1]=4 2976 B8R0.8 C#CCOC(C)C(=O)O MCULE-7792481116 [0,1,1,0,0,0|0,0,2]=4 2977 B8R0.8 C(N)(CCCC)C(=O)N MCULE-1406613793 [0,1,1,0,0,0|2,0,0]=4 2978 B8R0.8 C(N)(CCCC)C(=O)N MCULE-4692008742 [0,1,1,0,0,0|2,0,0]=4 2979 B8R0.8 C=CCCC(C)C(=O)O MCULE-3089071984 [0,1,1,0,0,0|1,0,1]=4 2980 B8R0.8 C=CCCC(N)C(=O)O MCULE-1524160350 [0,1,1,0,0,0|1,0,1]=4 2981 B8R0.8 C=CCCC(N)C(=O)O MCULE-5522822192 [0,1,1,0,0,0|1,0,1]=4 2982 B8R0.8 C=CCCC(N)C(=O)O MCULE-7998584890 [0,1,1,0,0,0|1,0,1]=4 2983 B8R0.8 C=CCC[C@@H](N)C(=O)O MCULE-4571532321 [0,1,1,0,0,0|1,0,1]=4 2984 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-2235047291 [0,1,1,0,0,0|1,0,1]=4 2985 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-4644458098 [0,1,1,0,0,0|1,0,1]=4 2986 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-7821274952 [0,1,1,0,0,0|1,0,1]=4 2987 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-9807212949 [0,1,1,0,0,0|1,0,1]=4 2988 B8R0.8 C=CCOC(C)C(=O)O MCULE-4801958900 [0,1,1,0,0,0|0,0,2]=4 2989 B8R0.8 CC(CCCCl)C(=O)O MCULE-6504631587 [0,1,1,0,0,0|1,0,0]=3 2990 B8R0.8 CC(OCCN)C(=O)O MCULE-4117277894 [0,1,1,0,0,0|1,0,0]=3 2991 B8R0.8 CC(OCCN)C(=O)O MCULE-6407651037 [0,1,1,0,0,0|1,0,0]=3 2992 B8R0.8 CC(OCCO)C(=O)O MCULE-4305620136 [0,1,1,0,0,0|1,0,0]=3 2993 B8R0.8 CCC/C=C(\C)/C(=O)O MCULE-4080682767 [0,1,1,0,0,0|1,0,1]=4 2994 B8R0.8 CCCC=C(C)C(=O)O MCULE-1072900673 [0,1,1,0,0,0|1,0,1]=4 2995 B8R0.8 CCCCC(=O)C(=O)O MCULE-7796922508 [0,1,1,0,0,0|1,0,1]=4 2996 B8R0.8 CCCCC(Br)C(=O)N MCULE-9831415558 [0,1,1,0,0,0|2,0,0]=4 2997 B8R0.8 CCCCC(Br)C(=O)O MCULE-5428502537 [0,1,1,0,0,0|1,0,0]=3 2998 B8R0.8 CCCCC(C)C(=O)C MCULE-2303839464 [0,1,1,0,0,0|2,0,0]=4 2999 B8R0.8 CCCCC(C)C(=O)Cl MCULE-1718383314 [0,1,1,0,0,0|2,0,0]=4 3000 B8R0.8 CCCCC(C)C(=O)N MCULE-6062124512 [0,1,1,0,0,0|2,0,0]=4 3001 B8R0.8 CCCCC(C)C(=O)O MCULE-7933263354 [0,1,1,0,0,0|1,0,0]=3 3002 B8R0.8 CCCCC(F)C(=O)O MCULE-2276381656 [0,1,1,0,0,0|1,0,0]=3 3003 B8R0.8 CCCCC(N)C(=O)C MCULE-2471947344 [0,1,1,0,0,0|2,0,0]=4 3004 B8R0.8 CCCCC(N)C(=O)C MCULE-4947552776 [0,1,1,0,0,0|2,0,0]=4 3005 B8R0.8 CCCCC(N)C(=O)O MCULE-4930484202 [0,1,1,0,0,0|1,0,0]=3 3006 B8R0.8 CCCCC(O)C(=O)N MCULE-1063256537 [0,1,1,0,0,0|2,0,0]=4 3007 B8R0.8 CCCCC(O)C(=O)O MCULE-2557585903 [0,1,1,0,0,0|1,0,0]=3 3008 B8R0.8 CCCC[C@@H](C)C(=O)O MCULE-3454696473 [0,1,1,0,0,0|1,0,0]=3 3009 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-3687527484 [0,1,1,0,0,0|1,0,0]=3 3010 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-9410581572 [0,1,1,0,0,0|1,0,0]=3 3011 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9016844851 [0,1,1,0,0,0|1,0,0]=3 3012 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9437190196 [0,1,1,0,0,0|1,0,0]=3 3013 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-1555661156 [0,1,1,0,0,0|2,0,0]=4 3014 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9202467107 [0,1,1,0,0,0|2,0,0]=4 3015 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9573872199 [0,1,1,0,0,0|2,0,0]=4 3016 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9773159994 [0,1,1,0,0,0|2,0,0]=4 3017 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-3656145338 [0,1,1,0,0,0|1,0,0]=3 3018 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-7427914532 [0,1,1,0,0,0|1,0,0]=3 3019 B8R0.8 CCCNC(=O)C(=O)O MCULE-6074987864 [0,1,1,0,0,0|1,0,1]=4 3020 B8R0.8 CCCOC(C)C(=O)O MCULE-4477829415 [0,1,1,0,0,0|0,0,0]=2 3021 B8R0.8 CCNCC(C)C(=O)O MCULE-3863191122 [0,1,1,0,0,0|2,0,0]=4 3022 B8R0.8 CCNCC(C)C(=O)O MCULE-4164323563 [0,1,1,0,0,0|2,0,0]=4 3023 B8R0.8 CCOCC(C)C(=O)O MCULE-5346959026 [0,1,1,0,0,0|2,0,0]=4 3024 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9199053225 [0,1,1,0,0,0|2,0,0]=4 3025 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9684903914 [0,1,1,0,0,0|2,0,0]=4 3026 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-6351196285 [0,1,1,0,0,0|2,0,0]=4 3027 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-7653589662 [0,1,1,0,0,0|2,0,0]=4 3028 B8R0.8 CCSCC(N)C(=O)O MCULE-9449250733 [0,1,1,0,0,0|2,0,0]=4 3029 B8R0.8 COCCC(C)C(=O)O MCULE-5066180613 [0,1,1,0,0,0|2,0,0]=4 3030 B8R0.8 COCCC(N)C(=O)O MCULE-3018605108 [0,1,1,0,0,0|2,0,0]=4 3031 B8R0.8 COCC[C@H](N)C(=O)O MCULE-6748608543 [0,1,1,0,0,0|2,0,0]=4 3032 B8R0.8 COCC[C@H](N)C(=O)O MCULE-8586358852 [0,1,1,0,0,0|2,0,0]=4 3033 B8R0.8 CSCCC(N)C(=O)O MCULE-5626142345 [0,1,1,0,0,0|2,0,0]=4 3034 B8R0.8 CSCCC(O)C(=O)O MCULE-3684026487 [0,1,1,0,0,0|2,0,0]=4 3035 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-2209985195 [0,1,1,0,0,0|2,0,0]=4 3036 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-9944164883 [0,1,1,0,0,0|2,0,0]=4 3037 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-3383932641 [0,1,1,0,0,0|2,0,0]=4 3038 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-4603455639 [0,1,1,0,0,0|2,0,0]=4 3039 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-7228063662 [0,1,1,0,0,0|2,0,0]=4 3040 B8R0.8 C[Se]CCC(N)C(=O)O MCULE-9212969564 [0,1,1,0,0,0|2,0,0]=4 3041 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5333020269 [0,1,1,0,0,0|2,0,0]=4 3042 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5980340572 [0,1,1,0,0,0|2,0,0]=4 3043 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [0,1,1,0,0,0|0,0,0]=2 3044 B8R0.8 NCCCC(N)C(=O)O MCULE-1970642620 [0,1,1,0,0,0|1,0,0]=3 3045 B8R0.8 NCCCC(N)C(=O)O MCULE-4486209373 [0,1,1,0,0,0|1,0,0]=3 3046 B8R0.8 NCCCC(N)C(=O)O MCULE-8193724048 [0,1,1,0,0,0|1,0,0]=3 3047 B8R0.8 NCCCC(N)C(=O)O MCULE-9223414094 [0,1,1,0,0,0|1,0,0]=3 3048 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-1634156072 [0,1,1,0,0,0|1,0,0]=3 3049 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2602820298 [0,1,1,0,0,0|1,0,0]=3 3050 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2719848774 [0,1,1,0,0,0|1,0,0]=3 3051 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-8413545449 [0,1,1,0,0,0|1,0,0]=3 3052 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2588005079 [0,1,1,0,0,0|1,0,0]=3 3053 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2852667696 [0,1,1,0,0,0|1,0,0]=3 3054 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-3029872280 [0,1,1,0,0,0|1,0,0]=3 3055 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-4242810787 [0,1,1,0,0,0|1,0,0]=3 3056 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-6924538097 [0,1,1,0,0,0|1,0,0]=3 3057 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-8642266626 [0,1,1,0,0,0|1,0,0]=3 3058 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9352931710 [0,1,1,0,0,0|1,0,0]=3 3059 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9532999202 [0,1,1,0,0,0|1,0,0]=3 3060 B8R0.8 NOCCC(N)C(=O)O MCULE-1540658941 [0,1,1,0,0,0|2,0,0]=4 3061 B8R0.8 NOCCC(N)C(=O)O MCULE-3729513992 [0,1,1,0,0,0|2,0,0]=4 3062 B8R0.8 NOCC[C@@H](N)C(=O)O MCULE-3273727827 [0,1,1,0,0,0|2,0,0]=4 3063 B8R0.8 NOCC[C@H](N)C(=O)O MCULE-2315172974 [0,1,1,0,0,0|2,0,0]=4 3064 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [0,1,1,0,0,0|0,0,0]=2 3065 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [0,1,1,0,0,0|0,0,0]=2 3066 B8R0.8 O=C(O)C(O)CCCO MCULE-9386031706 [0,1,1,0,0,0|0,0,0]=2 3067 B8R0.8 O=C([O-])C(O)CCCO MCULE-5137868319 [0,1,1,0,0,0|0,0,1]=3 3068 B8R0.8 [C@@H](N)(CCC=C)C(=O)O MCULE-9648209291 [0,1,1,0,0,0|1,0,1]=4 3069 B8R0.8 [C@H](N)(CCON)C(=O)O MCULE-1309966773 [0,1,1,0,0,0|2,0,0]=4 3070 B8R0.9 C=CC(N)CCC(=O)O MCULE-3453656580 [0,1,1,0,0,0|1,0,1]=4 3071 B8R0.9 C=CC(N)CCC(=O)O MCULE-4435406748 [0,1,1,0,0,0|1,0,1]=4 3072 B8R0.9 C=C[C@@H](N)CCC(=O)O MCULE-5470042954 [0,1,1,0,0,0|1,0,1]=4 3073 B8R0.9 C=C[C@@H](N)CCC(=O)O MCULE-9017090012 [0,1,1,0,0,0|1,0,1]=4 3074 B8R0.9 C=C[C@H](N)CCC(=O)O MCULE-4615585642 [0,1,1,0,0,0|1,0,1]=4 3075 B8R0.9 CC(=NO)CCC(=O)O MCULE-2481442220 [0,1,1,0,0,0|1,0,1]=4 3076 B8R0.9 CC(=O)OCC(N)CO MCULE-3133254167 [0,1,1,0,0,0|2,0,0]=4 3077 B8R0.9 CC(=O)OCC(N)CO MCULE-4867842020 [0,1,1,0,0,0|2,0,0]=4 3078 B8R0.9 CC(=O)OCC(O)CO MCULE-7518673015 [0,1,1,0,0,0|2,0,0]=4 3079 B8R0.9 CC(=O)OC[C@H](C)CO MCULE-2650760220 [0,1,1,0,0,0|2,0,0]=4 3080 B8R0.9 CC(=O)OC[C@H](C)CO MCULE-7616916740 [0,1,1,0,0,0|2,0,0]=4 3081 B8R0.9 CC(C#N)CCC(=O)O MCULE-6867167636 [0,1,1,0,0,0|1,0,1]=4 3082 B8R0.9 CC(CCl)CCC(=O)Cl MCULE-3716923938 [0,1,1,0,0,0|2,0,0]=4 3083 B8R0.9 CCC(=CCC(=O)O)C MCULE-3358969895 [0,1,1,0,0,0|1,0,1]=4 3084 B8R0.9 CCC(=O)CCC(=O)O MCULE-4505750030 [0,1,1,0,0,0|1,0,1]=4 3085 B8R0.9 CCC(=O)NCC(=O)O MCULE-9173889437 [0,1,1,0,0,0|1,0,1]=4 3086 B8R0.9 CCC(C)CCC(=O)C MCULE-6498666006 [0,1,1,0,0,0|2,0,0]=4 3087 B8R0.9 CCC(C)CCC(=O)O MCULE-9270270979 [0,1,1,0,0,0|1,0,0]=3 3088 B8R0.9 CCC(C)NCC(=O)O MCULE-1578825700 [0,1,1,0,0,0|1,0,0]=3 3089 B8R0.9 CCC(C)NCC(=O)O MCULE-8981987872 [0,1,1,0,0,0|1,0,0]=3 3090 B8R0.9 CCC(C)OCC(=O)O MCULE-8235265405 [0,1,1,0,0,0|0,0,0]=2 3091 B8R0.9 CCC(Cl)CCC(=O)Cl MCULE-3849391288 [0,1,1,0,0,0|2,0,0]=4 3092 B8R0.9 CCC(N)CCC(=O)O MCULE-3116763773 [0,1,1,0,0,0|1,0,0]=3 3093 B8R0.9 CCC(N)CCC(=O)O MCULE-9126260921 [0,1,1,0,0,0|1,0,0]=3 3094 B8R0.9 CCC(O)CCC(=O)O MCULE-1512608136 [0,1,1,0,0,0|1,0,0]=3 3095 B8R0.9 CCC(O)CCC(=O)[O-] MCULE-6831827135 [0,1,1,0,0,0|1,0,1]=4 3096 B8R0.9 CCN(C)CCC(=O)O MCULE-2510720087 [0,1,1,0,0,0|2,0,0]=4 3097 B8R0.9 CCN(C)CCC(=O)O MCULE-4192684079 [0,1,1,0,0,0|2,0,0]=4 3098 B8R0.9 CCS(=O)CCC(=O)O MCULE-4027618720 [0,1,1,0,0,0|2,0,0]=4 3099 B8R0.9 CC[C@H](N)C=CC(=O)O MCULE-8933495159 [0,1,1,0,0,0|1,0,1]=4 3100 B8R0.9 COC(C)CCC(=O)O MCULE-5873043454 [0,1,1,0,0,0|2,0,0]=4 3101 B8R0.9 CSC(C)CCC(=O)O MCULE-3505570511 [0,1,1,0,0,0|2,0,0]=4 3102 B8R0.9 C[C@@H](CO)CC[N+](=O)[O-] MCULE-1706050650 [0,1,1,0,0,0|1,0,1]=4 3103 B8R0.9 C[C@@H](CO)CC[N+](=O)[O-] MCULE-8419848254 [0,1,1,0,0,0|1,0,1]=4 3104 B8R0.9 NCC(=O)CCC(=O)O MCULE-6371115085 [0,1,1,0,0,0|1,0,1]=4 3105 B8R0.9 NCC(=O)CCC(=O)O MCULE-8125179397 [0,1,1,0,0,0|1,0,1]=4 3106 B8R0.9 NCC(=O)CCC(=O)O MCULE-8676354165 [0,1,1,0,0,0|1,0,1]=4 3107 B8R0.9 NCC(N)CCC(=O)O MCULE-1054409990 [0,1,1,0,0,0|1,0,0]=3 3108 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-2916881042 [0,1,1,0,0,0|1,0,0]=3 3109 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-7249154843 [0,1,1,0,0,0|1,0,0]=3 3110 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-1233079264 [0,1,1,0,0,0|0,0,0]=2 3111 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-8091475267 [0,1,1,0,0,0|0,0,0]=2 3112 B8R0.9 O=C(O)CCC(=O)CBr MCULE-8373387398 [0,1,1,0,0,0|1,0,1]=4 3113 B8R0.9 O=C(O)CCC(=O)NO MCULE-2226202964 [0,1,1,0,0,0|1,0,1]=4 3114 B8R0.9 O=C(O)CCP(=O)CO MCULE-3163541128 [0,1,1,0,0,0|1,0,0]=3 3115 B8R0.9 O=C(O)COC(=O)CO MCULE-4022202206 [0,1,1,0,0,0|1,0,1]=4 3116 B8R0.21 CC(C)(O)CCCCO MCULE-2749019232 [0,1,1,0,0,0|1,0,1]=4 3117 B8R0.21 CCCCCS(=O)(=O)O MCULE-3941343492 [0,1,1,0,0,0|2,0,0]=4 3118 B8R0.21 CS(=O)(=O)CCCCO MCULE-5624209550 [0,1,1,0,0,0|1,0,1]=4 3119 B8R0.21 NCCCCP(=O)(O)O MCULE-2632534074 [0,1,1,0,0,0|2,0,0]=4 3120 B8R0.21 O=P(O)(O)CCCCBr MCULE-5686227952 [0,1,1,0,0,0|2,0,0]=4 3121 B8R0.21 O=S(=O)(O)CCCCO MCULE-7293075600 [0,1,1,0,0,0|1,0,0]=3 3122 B8R0.21 O=S(=O)(O)NCCCO MCULE-8740563073 [0,1,1,0,0,0|2,0,0]=4 3123 B8R0.21 O=S(=O)([O-])CCCCO MCULE-9692115991 [0,1,1,0,0,0|1,0,1]=4 3124 B8R0.28 C=C(Br)CCCC(=O)O MCULE-5394609034 [0,1,1,0,0,0|1,0,1]=4 3125 B8R0.28 C=C(C)CCCC(=O)O MCULE-1282031449 [0,1,1,0,0,0|1,0,1]=4 3126 B8R0.28 C=C(Cl)CCCC(=O)O MCULE-9525654231 [0,1,1,0,0,0|1,0,1]=4 3127 B8R0.28 CC(=O)CCCC(=O)O MCULE-2498129200 [0,1,1,0,0,0|0,0,2]=4 3128 B8R0.28 CC(=O)CCCC(C)C MCULE-7256575819 [0,1,1,0,0,0|2,0,0]=4 3129 B8R0.28 CC(=O)CNCC(C)C MCULE-3943786157 [0,1,1,0,0,0|2,0,0]=4 3130 B8R0.28 CC(=O)CNCC(C)C MCULE-9329085422 [0,1,1,0,0,0|2,0,0]=4 3131 B8R0.28 CC(=O)COCC(=O)C MCULE-1945925794 [0,1,1,0,0,0|1,0,1]=4 3132 B8R0.28 CC(=O)CSCC(C)C MCULE-1710631404 [0,1,1,0,0,0|1,1,0]=4 3133 B8R0.28 CC(C)/C=C/CC(=O)O MCULE-6288178603 [0,1,1,0,0,0|1,0,1]=4 3134 B8R0.28 CC(C)C=CCC(=O)O MCULE-1057297040 [0,1,1,0,0,0|1,0,1]=4 3135 B8R0.28 CC(C)CC=CC(=O)O MCULE-4966710694 [0,1,1,0,0,0|1,0,1]=4 3136 B8R0.28 CC(C)CCCC(=O)O MCULE-3645348479 [0,1,1,0,0,0|1,0,0]=3 3137 B8R0.28 CC(C)CNCC(=O)N MCULE-6834225327 [0,1,1,0,0,0|2,0,0]=4 3138 B8R0.28 CC(C)CNCC(=O)N MCULE-8464570977 [0,1,1,0,0,0|2,0,0]=4 3139 B8R0.28 CC(C)CNCC(=O)O MCULE-4695293444 [0,1,1,0,0,0|1,0,0]=3 3140 B8R0.28 CC(C)CNCC(=O)O MCULE-9936739681 [0,1,1,0,0,0|1,0,0]=3 3141 B8R0.28 CC(C)COCC(=O)N MCULE-8148336060 [0,1,1,0,0,0|1,0,0]=3 3142 B8R0.28 CC(C)COCC(=O)O MCULE-8643896966 [0,1,1,0,0,0|0,0,0]=2 3143 B8R0.28 CC(C)COCC(C)O MCULE-2243697829 [0,1,1,0,0,0|1,0,1]=4 3144 B8R0.28 CC(C)CSCC(=O)O MCULE-5182400762 [0,1,1,0,0,0|0,1,0]=3 3145 B8R0.28 CC(C)NCCC(=O)O MCULE-2087792459 [0,1,1,0,0,0|2,0,0]=4 3146 B8R0.28 CC(C)NCCC(=O)O MCULE-6893587807 [0,1,1,0,0,0|2,0,0]=4 3147 B8R0.28 CC(C)OCCC(=O)O MCULE-6533666992 [0,1,1,0,0,0|2,0,0]=4 3148 B8R0.28 CC(C)SCCC(=O)O MCULE-1434094352 [0,1,1,0,0,0|2,0,0]=4 3149 B8R0.28 CC(Cl)CCCC(=O)Cl MCULE-6993455396 [0,1,1,0,0,0|2,0,0]=4 3150 B8R0.28 CC(O)CCCC(=O)O MCULE-6696855762 [0,1,1,0,0,0|0,0,0]=2 3151 B8R0.28 CC(O)CCCC(=O)[O-] MCULE-7722587632 [0,1,1,0,0,0|0,0,1]=3 3152 B8R0.28 CC(O)COCC(C)O MCULE-9464290948 [0,1,1,0,0,0|1,0,1]=4 3153 B8R0.28 CN(C)CCCC(=O)O MCULE-5562283434 [0,1,1,0,0,0|2,0,0]=4 3154 B8R0.28 CN(C)CCCC(=O)O MCULE-5657963851 [0,1,1,0,0,0|2,0,0]=4 3155 B8R0.28 NC(=O)CCCC(=O)O MCULE-9714346244 [0,1,1,0,0,0|0,0,2]=4 3156 B8R0.28 NC(=O)COCC(=O)O MCULE-3868584388 [0,1,1,0,0,0|1,0,1]=4 3157 B8R0.28 O=C(O)CCCC(=O)O MCULE-4286022994 [0,1,1,0,0,0|0,0,1]=3 3158 B8R0.28 O=C(O)CCCC(F)F MCULE-1906281877 [0,1,1,0,0,0|1,0,0]=3 3159 B8R0.28 O=C(O)CCCN(=O)=O MCULE-2601801792 [0,1,1,0,0,0|1,0,1]=4 3160 B8R0.28 O=C(O)CNCC(=O)O MCULE-4131542591 [0,1,1,0,0,0|1,0,1]=4 3161 B8R0.28 O=C(O)COCC(=O)O MCULE-5687758679 [0,1,1,0,0,0|1,0,1]=4 3162 B8R0.28 O=C(O)COCC(F)F MCULE-2599944385 [0,1,1,0,0,0|1,0,0]=3 3163 B8R0.28 O=C(O)CSCC(=O)O MCULE-8112166808 [0,1,1,0,0,0|1,0,1]=4 3164 B8R0.28 O=C([O-])COCC(=O)O MCULE-3773620396 [0,1,1,0,0,0|1,0,1]=4 3165 B8R0.28 O=C([O-])COCC(=O)O MCULE-5768077440 [0,1,1,0,0,0|1,0,1]=4 3166 B8R0.2 CC(=O)C(O)C(O)CO MCULE-1853649042 [0,1,1,0,0,0|2,0,0]=4 3167 B8R0.2 CC(=O)[C@@H](O)[C@H](O)CO MCULE-9565941206 [0,1,1,0,0,0|2,0,0]=4 3168 B8R0.2 CCC(=O)C(C)C(=O)O MCULE-9192813670 [0,1,1,0,0,0|1,0,0]=3 3169 B8R0.2 CCC(C)C(=O)C(=O)O MCULE-2376245949 [0,1,1,0,0,0|0,0,2]=4 3170 B8R0.2 CCC(C)C(Br)C(=O)O MCULE-1124609284 [0,1,1,0,0,0|1,0,0]=3 3171 B8R0.2 CCC(C)C(C)C(=O)C MCULE-4030096724 [0,1,1,0,0,0|2,0,0]=4 3172 B8R0.2 CCC(C)C(C)C(=O)O MCULE-9360443230 [0,1,1,0,0,0|1,0,0]=3 3173 B8R0.2 CCC(C)C(N)C(=O)N MCULE-7314175276 [0,1,1,0,0,0|2,0,0]=4 3174 B8R0.2 CCC(C)C(N)C(=O)N MCULE-8895055670 [0,1,1,0,0,0|2,0,0]=4 3175 B8R0.2 CCC(C)C(N)C(=O)O MCULE-9861955295 [0,1,1,0,0,0|1,0,0]=3 3176 B8R0.2 CCC(C)C(O)C(=O)N MCULE-2649023234 [0,1,1,0,0,0|1,0,0]=3 3177 B8R0.2 CCC(C)C(O)C(=O)O MCULE-4300622531 [0,1,1,0,0,0|0,0,0]=2 3178 B8R0.2 CCC(O)C(C)C(=O)O MCULE-7278088016 [0,1,1,0,0,0|1,0,0]=3 3179 B8R0.2 CCC(O)C(N)C(=O)O MCULE-5277569808 [0,1,1,0,0,0|1,0,0]=3 3180 B8R0.2 CCC(O)[C@H](N)C(=O)O MCULE-7480930876 [0,1,1,0,0,0|1,0,0]=3 3181 B8R0.2 CCN(C)C(C)C(=O)O MCULE-6064336068 [0,1,1,0,0,0|1,0,0]=3 3182 B8R0.2 CCN(C)[C@@H](C)C(=O)O MCULE-9158211664 [0,1,1,0,0,0|1,0,0]=3 3183 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-1413119398 [0,1,1,0,0,0|1,0,0]=3 3184 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-5186925599 [0,1,1,0,0,0|1,0,0]=3 3185 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O MCULE-5041492133 [0,1,1,0,0,0|1,0,0]=3 3186 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-2706440971 [0,1,1,0,0,0|1,0,0]=3 3187 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-8101207882 [0,1,1,0,0,0|1,0,0]=3 3188 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-1048734191 [0,1,1,0,0,0|1,0,0]=3 3189 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-1935827385 [0,1,1,0,0,0|1,0,0]=3 3190 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-8753855708 [0,1,1,0,0,0|1,0,0]=3 3191 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-9854510560 [0,1,1,0,0,0|1,0,0]=3 3192 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1200159118 [0,1,1,0,0,0|1,0,0]=3 3193 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1359318144 [0,1,1,0,0,0|1,0,0]=3 3194 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-9629903099 [0,1,1,0,0,0|1,0,0]=3 3195 B8R0.2 CC[C@H](C)[C@@H](O)C(=O)O MCULE-6017510763 [0,1,1,0,0,0|0,0,0]=2 3196 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-1760352503 [0,1,1,0,0,0|1,0,0]=3 3197 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-2341573677 [0,1,1,0,0,0|1,0,0]=3 3198 B8R0.2 CC[C@H](C)[C@H](N)C(=O)N MCULE-3415036603 [0,1,1,0,0,0|2,0,0]=4 3199 B8R0.2 CC[C@H](C)[C@H](N)C(=O)N MCULE-9677139342 [0,1,1,0,0,0|2,0,0]=4 3200 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-2215911951 [0,1,1,0,0,0|1,0,0]=3 3201 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-3217669453 [0,1,1,0,0,0|1,0,0]=3 3202 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-2804875804 [0,1,1,0,0,0|0,0,0]=2 3203 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-4272353967 [0,1,1,0,0,0|0,0,0]=2 3204 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-6087026464 [0,1,1,0,0,0|0,0,0]=2 3205 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-2118005753 [0,1,1,0,0,0|1,0,0]=3 3206 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-2420221886 [0,1,1,0,0,0|1,0,0]=3 3207 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-7168739287 [0,1,1,0,0,0|1,0,0]=3 3208 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-7351381830 [0,1,1,0,0,0|1,0,0]=3 3209 B8R0.2 COC(=O)C(C)C(=O)O MCULE-6548116408 [0,1,1,0,0,0|2,0,0]=4 3210 B8R0.2 COC(C)C(Br)C(=O)O MCULE-2500266383 [0,1,1,0,0,0|2,0,0]=4 3211 B8R0.2 COC(C)C(O)C(=O)O MCULE-2673265957 [0,1,1,0,0,0|1,0,0]=3 3212 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O MCULE-2479965444 [0,1,1,0,0,0|2,0,0]=4 3213 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O MCULE-3288712191 [0,1,1,0,0,0|2,0,0]=4 3214 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O MCULE-6827226453 [0,1,1,0,0,0|2,0,0]=4 3215 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O MCULE-6762158780 [0,1,1,0,0,0|2,0,0]=4 3216 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O MCULE-9087542117 [0,1,1,0,0,0|2,0,0]=4 3217 B8R0.2 CO[C@H](C)[C@@H](N)C(=O)O MCULE-6235935164 [0,1,1,0,0,0|2,0,0]=4 3218 B8R0.2 CO[C@H](C)[C@@H](N)C(=O)O MCULE-6758536252 [0,1,1,0,0,0|2,0,0]=4 3219 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O MCULE-7334607468 [0,1,1,0,0,0|2,0,0]=4 3220 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O MCULE-8564530384 [0,1,1,0,0,0|2,0,0]=4 3221 B8R0.2 CSC(C)C(N)C(=O)O MCULE-6226096646 [0,1,1,0,0,0|2,0,0]=4 3222 B8R0.2 O=C(O)C(O)C(O)CO MCULE-1397527919 [0,1,1,0,0,0|1,0,0]=3 3223 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-1531474304 [0,1,1,0,0,0|1,0,0]=3 3224 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-3829421433 [0,1,1,0,0,0|1,0,0]=3 3225 B8R0.2 O=C([O-])C(O)C(O)CO MCULE-4453733473 [0,1,1,0,0,0|1,0,1]=4 3226 B8R0.2 O=C([O-])[C@H](O)[C@H](O)CO MCULE-1044422592 [0,1,1,0,0,0|1,0,1]=4 3227 B8R0.2 O=C([O-])[C@H](O)[C@H](O)CO MCULE-1805281668 [0,1,1,0,0,0|1,0,1]=4 3228 B8R0.2 [C@H](C)(CC)[C@H](N)C(=O)N MCULE-1416545198 [0,1,1,0,0,0|2,0,0]=4 3229 B8R0.2 [C@H](C)(CC)[C@H](N)C(=O)N MCULE-1950370478 [0,1,1,0,0,0|2,0,0]=4 3230 B8R0.3 C=CC[C@@H](O)C(=O)OC MCULE-5528424936 [0,1,1,0,0,0|0,0,2]=4 3231 B8R0.3 CCC=C(C)C(=O)OC MCULE-1695208139 [0,1,1,0,0,0|1,0,1]=4 3232 B8R0.3 CCCC(=O)C(=O)OC MCULE-5789275467 [0,1,1,0,0,0|0,0,2]=4 3233 B8R0.3 CCCC(Br)C(=O)OC MCULE-2779995445 [0,1,1,0,0,0|1,0,0]=3 3234 B8R0.3 CCCC(C)C(=O)CC MCULE-9990200653 [0,1,1,0,0,0|2,0,0]=4 3235 B8R0.3 CCCC(C)C(=O)OC MCULE-6953134216 [0,1,1,0,0,0|1,0,0]=3 3236 B8R0.3 CCCC(N)C(=O)NC MCULE-3980097421 [0,1,1,0,0,0|2,0,0]=4 3237 B8R0.3 CCCC(N)C(=O)NO MCULE-2069838283 [0,1,1,0,0,0|1,0,0]=3 3238 B8R0.3 CCCC(N)C(=O)OC MCULE-1453218994 [0,1,1,0,0,0|1,0,0]=3 3239 B8R0.3 CCCC(N)C(=O)OC MCULE-4171872835 [0,1,1,0,0,0|1,0,0]=3 3240 B8R0.3 CCCC(N)C(=O)OC MCULE-4324009425 [0,1,1,0,0,0|1,0,0]=3 3241 B8R0.3 CCCC(N)C(=O)OC MCULE-9533158990 [0,1,1,0,0,0|1,0,0]=3 3242 B8R0.3 CCCC(O)C(N)CO MCULE-6983866986 [0,1,1,0,0,0|1,0,1]=4 3243 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-1310673609 [0,1,1,0,0,0|1,0,0]=3 3244 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5850698619 [0,1,1,0,0,0|1,0,0]=3 3245 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5854286766 [0,1,1,0,0,0|1,0,0]=3 3246 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-9793822862 [0,1,1,0,0,0|1,0,0]=3 3247 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-2009036281 [0,1,1,0,0,0|1,0,0]=3 3248 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5609199650 [0,1,1,0,0,0|1,0,0]=3 3249 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5628439347 [0,1,1,0,0,0|1,0,0]=3 3250 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-8724830592 [0,1,1,0,0,0|1,0,0]=3 3251 B8R0.3 CCNC(C)C(=O)OC MCULE-3289750233 [0,1,1,0,0,0|1,0,0]=3 3252 B8R0.3 CCNC(C)C(=O)OC MCULE-6862987622 [0,1,1,0,0,0|1,0,0]=3 3253 B8R0.3 CCN[C@@H](C)C(=O)OC MCULE-5663920756 [0,1,1,0,0,0|1,0,0]=3 3254 B8R0.3 CCOC(C)/C(=N/O)/N MCULE-2085332041 [0,1,1,0,0,0|1,0,0]=3 3255 B8R0.3 CCOC(C)C(=O)NN MCULE-1066133056 [0,1,1,0,0,0|1,0,0]=3 3256 B8R0.3 CCOC(C)C(=O)NN MCULE-9272616432 [0,1,1,0,0,0|1,0,0]=3 3257 B8R0.3 CCON(C)C(=O)CN MCULE-5915406823 [0,1,1,0,0,0|2,0,0]=4 3258 B8R0.3 CCON(C)C(=O)CN MCULE-6850903466 [0,1,1,0,0,0|2,0,0]=4 3259 B8R0.3 CNCC(Br)C(=O)OC MCULE-2818400613 [0,1,1,0,0,0|2,0,0]=4 3260 B8R0.3 CNCC(Br)C(=O)OC MCULE-5823314810 [0,1,1,0,0,0|2,0,0]=4 3261 B8R0.3 CNCC(C)C(=O)OC MCULE-5525958870 [0,1,1,0,0,0|2,0,0]=4 3262 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-6377659413 [0,1,1,0,0,0|2,0,0]=4 3263 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-9611469994 [0,1,1,0,0,0|2,0,0]=4 3264 B8R0.3 COC(=O)C(Br)CCBr MCULE-4290973865 [0,1,1,0,0,0|2,0,0]=4 3265 B8R0.3 COC(=O)C(C)CCBr MCULE-7970722391 [0,1,1,0,0,0|2,0,0]=4 3266 B8R0.3 COC(=O)C(C)CCCl MCULE-3423199485 [0,1,1,0,0,0|2,0,0]=4 3267 B8R0.3 COC(=O)C(C)CCN MCULE-4788413403 [0,1,1,0,0,0|2,0,0]=4 3268 B8R0.3 COC(=O)C(C)CCN MCULE-6075427964 [0,1,1,0,0,0|2,0,0]=4 3269 B8R0.3 COC(=O)C(N)CCBr MCULE-5668145888 [0,1,1,0,0,0|2,0,0]=4 3270 B8R0.3 COC(=O)C(N)CCBr MCULE-5831054247 [0,1,1,0,0,0|2,0,0]=4 3271 B8R0.3 COC(=O)C(N)CCF MCULE-3356013030 [0,1,1,0,0,0|2,0,0]=4 3272 B8R0.3 COC(=O)C(N)CCF MCULE-6443244944 [0,1,1,0,0,0|2,0,0]=4 3273 B8R0.3 COC(=O)C(N)CCS MCULE-8178229832 [0,1,1,0,0,0|2,0,0]=4 3274 B8R0.3 COC(=O)C(N)CSC MCULE-6702025743 [0,1,1,0,0,0|2,0,0]=4 3275 B8R0.3 COC(=O)C(N)CSC MCULE-7180641175 [0,1,1,0,0,0|2,0,0]=4 3276 B8R0.3 COC(=O)C(O)CCN MCULE-7139144229 [0,1,1,0,0,0|1,0,0]=3 3277 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-1252477377 [0,1,1,0,0,0|2,0,0]=4 3278 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-6780159971 [0,1,1,0,0,0|2,0,0]=4 3279 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-8129635461 [0,1,1,0,0,0|2,0,0]=4 3280 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-9824385803 [0,1,1,0,0,0|2,0,0]=4 3281 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-5345736899 [0,1,1,0,0,0|2,0,0]=4 3282 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-8434362314 [0,1,1,0,0,0|2,0,0]=4 3283 B8R0.3 COC(=O)[C@@H](N)CCS MCULE-1895611205 [0,1,1,0,0,0|2,0,0]=4 3284 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-2532401863 [0,1,1,0,0,0|2,0,0]=4 3285 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-3321267517 [0,1,1,0,0,0|2,0,0]=4 3286 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-5693942065 [0,1,1,0,0,0|2,0,0]=4 3287 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-7597642447 [0,1,1,0,0,0|2,0,0]=4 3288 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-1204029497 [0,1,1,0,0,0|1,0,0]=3 3289 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-2464186416 [0,1,1,0,0,0|1,0,0]=3 3290 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-4887582087 [0,1,1,0,0,0|1,0,0]=3 3291 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-8785450046 [0,1,1,0,0,0|1,0,0]=3 3292 B8R0.3 COC(=O)[C@H](N)CCN MCULE-1821826306 [0,1,1,0,0,0|2,0,0]=4 3293 B8R0.3 COC(=O)[C@H](N)CCN MCULE-8161776969 [0,1,1,0,0,0|2,0,0]=4 3294 B8R0.3 COC(=O)[C@H](N)CCO MCULE-1194830786 [0,1,1,0,0,0|2,0,0]=4 3295 B8R0.3 COC(=O)[C@H](N)CCO MCULE-2532522705 [0,1,1,0,0,0|2,0,0]=4 3296 B8R0.3 COC(=O)[C@H](N)CCS MCULE-8558179208 [0,1,1,0,0,0|2,0,0]=4 3297 B8R0.3 COCC(Br)C(=O)OC MCULE-5792855565 [0,1,1,0,0,0|2,0,0]=4 3298 B8R0.3 COCC(C)C(=O)OC MCULE-4110856609 [0,1,1,0,0,0|2,0,0]=4 3299 B8R0.3 COCC(N)C(=O)OC MCULE-1717271658 [0,1,1,0,0,0|2,0,0]=4 3300 B8R0.3 COCC(N)C(=O)OC MCULE-4567479747 [0,1,1,0,0,0|2,0,0]=4 3301 B8R0.3 COCC(N)C(=O)OC MCULE-4859095599 [0,1,1,0,0,0|2,0,0]=4 3302 B8R0.3 COCC(N)C(=O)OC MCULE-8125210840 [0,1,1,0,0,0|2,0,0]=4 3303 B8R0.3 COCC(O)C(=O)OC MCULE-6071304250 [0,1,1,0,0,0|1,0,0]=3 3304 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-2867072950 [0,1,1,0,0,0|2,0,0]=4 3305 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-5445193744 [0,1,1,0,0,0|2,0,0]=4 3306 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8505505456 [0,1,1,0,0,0|2,0,0]=4 3307 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8525451378 [0,1,1,0,0,0|2,0,0]=4 3308 B8R0.12 CC(C)(CCN)C(=O)O MCULE-2948071531 [0,1,1,0,0,0|2,0,0]=4 3309 B8R0.12 CC(C)(CCN)C(=O)O MCULE-9113980340 [0,1,1,0,0,0|2,0,0]=4 3310 B8R0.12 CC(C)(CCO)C(=O)O MCULE-1566648548 [0,1,1,0,0,0|2,0,0]=4 3311 B8R0.12 CC(N)(CCF)C(=O)O MCULE-5797177130 [0,1,1,0,0,0|2,0,0]=4 3312 B8R0.12 CC(N)(CCF)C(=O)O MCULE-9911119608 [0,1,1,0,0,0|2,0,0]=4 3313 B8R0.12 CCCC(C)(C)C(=O)C MCULE-3472590451 [0,1,1,0,0,0|2,0,0]=4 3314 B8R0.12 CCCC(C)(C)C(=O)Cl MCULE-1035499713 [0,1,1,0,0,0|2,0,0]=4 3315 B8R0.12 CCCC(C)(C)C(=O)O MCULE-7950118630 [0,1,1,0,0,0|1,0,0]=3 3316 B8R0.12 CCCC(C)(N)C(=O)O MCULE-3079931045 [0,1,1,0,0,0|1,0,0]=3 3317 B8R0.12 CCCC(C)(O)C(=O)N MCULE-5398805490 [0,1,1,0,0,0|1,0,0]=3 3318 B8R0.12 CCCC(C)(O)C(=O)O MCULE-5292180056 [0,1,1,0,0,0|0,0,0]=2 3319 B8R0.12 CCCC(F)(F)C(=O)O MCULE-9926038462 [0,1,1,0,0,0|1,0,0]=3 3320 B8R0.12 CCC[C@](C)(N)C(=O)O MCULE-8569302783 [0,1,1,0,0,0|1,0,0]=3 3321 B8R0.12 CCNC(C)(C)C(=O)N MCULE-9687659825 [0,1,1,0,0,0|2,0,0]=4 3322 B8R0.12 CCNC(C)(C)C(=O)O MCULE-5196592202 [0,1,1,0,0,0|1,0,0]=3 3323 B8R0.12 CCNC(C)(C)C(=O)O MCULE-7185239447 [0,1,1,0,0,0|1,0,0]=3 3324 B8R0.12 CCOC(C)(C)C(=O)N MCULE-6728122742 [0,1,1,0,0,0|1,0,0]=3 3325 B8R0.12 CCOC(C)(C)C(=O)O MCULE-7344066576 [0,1,1,0,0,0|0,0,0]=2 3326 B8R0.12 CCOP(=O)(O)C(=O)O MCULE-8851144535 [0,1,1,0,0,0|2,0,0]=4 3327 B8R0.12 CNCC(C)(C)C(=O)O MCULE-1701621773 [0,1,1,0,0,0|2,0,0]=4 3328 B8R0.12 CNCC(C)(C)C(=O)O MCULE-7669976515 [0,1,1,0,0,0|2,0,0]=4 3329 B8R0.12 CNCC(F)(F)C(=O)O MCULE-3707622806 [0,1,1,0,0,0|2,0,0]=4 3330 B8R0.12 CNCC(F)(F)C(=O)O MCULE-4421374171 [0,1,1,0,0,0|2,0,0]=4 3331 B8R0.12 COCC(C)(C)C(=O)O MCULE-9074673500 [0,1,1,0,0,0|2,0,0]=4 3332 B8R0.12 COCC(C)(O)C(=O)O MCULE-7674892239 [0,1,1,0,0,0|1,0,0]=3 3333 B8R0.12 COCC(F)(F)C(=O)O MCULE-6981513055 [0,1,1,0,0,0|2,0,0]=4 3334 B8R0.12 CSCC(C)(C)C(=O)O MCULE-8010872211 [0,1,1,0,0,0|2,0,0]=4 3335 B8R0.12 NCCC(F)(F)C(=O)O MCULE-3814517866 [0,1,1,0,0,0|2,0,0]=4 3336 B8R0.15 C#CC(OCC)C(=O)O MCULE-4920328481 [0,1,1,0,0,0|0,0,1]=3 3337 B8R0.15 CCC(CCN)C(=O)O MCULE-3540595708 [0,1,1,0,0,0|2,0,0]=4 3338 B8R0.15 CCC(CCN)C(=O)O MCULE-6369668711 [0,1,1,0,0,0|2,0,0]=4 3339 B8R0.15 CCCC(=NO)C(=O)N MCULE-4974052536 [0,1,1,0,0,0|1,0,1]=4 3340 B8R0.15 CCCC(C#N)C(=O)O MCULE-8231205596 [0,1,1,0,0,0|1,0,0]=3 3341 B8R0.15 CCCC(CC)C(=O)C MCULE-3483794250 [0,1,1,0,0,0|2,0,0]=4 3342 B8R0.15 CCCC(CC)C(=O)O MCULE-2070546888 [0,1,1,0,0,0|1,0,0]=3 3343 B8R0.15 CCCC(CO)C(=O)O MCULE-2653026260 [0,1,1,0,0,0|0,0,0]=2 3344 B8R0.15 CCCC(NC)C(=O)O MCULE-5292420123 [0,1,1,0,0,0|1,0,0]=3 3345 B8R0.15 CCCC(NC)C(=O)O MCULE-5734283547 [0,1,1,0,0,0|1,0,0]=3 3346 B8R0.15 CCCC(NC)C(=O)O MCULE-9559460593 [0,1,1,0,0,0|1,0,0]=3 3347 B8R0.15 CCCC(NO)C(=O)O MCULE-7484331195 [0,1,1,0,0,0|0,0,0]=2 3348 B8R0.15 CCCC(OC)C(=O)O MCULE-6875744280 [0,1,1,0,0,0|0,0,0]=2 3349 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-3394704356 [0,1,1,0,0,0|1,0,0]=3 3350 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-8140893147 [0,1,1,0,0,0|1,0,0]=3 3351 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-1805025355 [0,1,1,0,0,0|0,0,0]=2 3352 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-3449491143 [0,1,1,0,0,0|0,0,0]=2 3353 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-1028689544 [0,1,1,0,0,0|1,0,0]=3 3354 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-4848752673 [0,1,1,0,0,0|1,0,0]=3 3355 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-5585839502 [0,1,1,0,0,0|1,0,0]=3 3356 B8R0.15 CCC[C@H](NO)C(=O)O MCULE-7455558431 [0,1,1,0,0,0|0,0,0]=2 3357 B8R0.15 CCOC(CBr)C(=O)O MCULE-5345866284 [0,1,1,0,0,0|0,0,0]=2 3358 B8R0.15 CCOC(CC)C(=O)N MCULE-8093014638 [0,1,1,0,0,0|1,0,0]=3 3359 B8R0.15 CCOC(CC)C(=O)O MCULE-1674742787 [0,1,1,0,0,0|0,0,0]=2 3360 B8R0.15 CNC(CCN)C(=O)O MCULE-6687313255 [0,1,1,0,0,0|2,0,0]=4 3361 B8R0.15 CNC(COC)C(=O)O MCULE-4091913769 [0,1,1,0,0,0|2,0,0]=4 3362 B8R0.15 CNC(COC)C(=O)O MCULE-6745647660 [0,1,1,0,0,0|2,0,0]=4 3363 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-4209872941 [0,1,1,0,0,0|2,0,0]=4 3364 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-7202916887 [0,1,1,0,0,0|2,0,0]=4 3365 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-1874728709 [0,1,1,0,0,0|2,0,0]=4 3366 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-3716592032 [0,1,1,0,0,0|2,0,0]=4 3367 B8R0.15 COC(CCN)C(=O)N MCULE-4310174639 [0,1,1,0,0,0|2,0,0]=4 3368 B8R0.15 COC(CCN)C(=O)O MCULE-1510512790 [0,1,1,0,0,0|1,0,0]=3 3369 B8R0.15 COCC(OC)C(=O)O MCULE-5776685365 [0,1,1,0,0,0|1,0,0]=3 3370 B8R0.15 COCC(ON)C(=O)O MCULE-4466158339 [0,1,1,0,0,0|1,0,0]=3 3371 B8R0.15 COCC(ON)C(=O)O MCULE-6084078663 [0,1,1,0,0,0|1,0,0]=3 3372 B8R0.23 C(N)(CC(C)C)C(=O)O MCULE-7664540924 [0,1,1,0,0,0|1,0,0]=3 3373 B8R0.23 C(N)(CS(=O)C)C(=O)O MCULE-3320985154 [0,1,1,0,0,0|2,0,0]=4 3374 B8R0.23 C/C(=C\C(C)C)/C(=O)O MCULE-7989780609 [0,1,1,0,0,0|1,0,1]=4 3375 B8R0.23 C=C(C)CC(C)C(=O)O MCULE-7268483710 [0,1,1,0,0,0|1,0,1]=4 3376 B8R0.23 C=C(C)CC(N)C(=O)O MCULE-5915882776 [0,1,1,0,0,0|1,0,1]=4 3377 B8R0.23 C=C(C)C[C@@H](N)C(=O)O MCULE-2841714882 [0,1,1,0,0,0|1,0,1]=4 3378 B8R0.23 C=C(C)C[C@H](C)C(=O)O MCULE-9053114079 [0,1,1,0,0,0|1,0,1]=4 3379 B8R0.23 C=C(C)C[C@H](N)C(=O)O MCULE-1029058491 [0,1,1,0,0,0|1,0,1]=4 3380 B8R0.23 C=C(C)C[C@H](N)C(=O)O MCULE-6974720260 [0,1,1,0,0,0|1,0,1]=4 3381 B8R0.23 C=C(CC(C)C)C(=O)O MCULE-5929811654 [0,1,1,0,0,0|1,0,1]=4 3382 B8R0.23 CC(=O)C(C)CC(C)C MCULE-9956513410 [0,1,1,0,0,0|2,0,0]=4 3383 B8R0.23 CC(=O)C(N)CC(C)C MCULE-2548441556 [0,1,1,0,0,0|2,0,0]=4 3384 B8R0.23 CC(=O)CC(C)C(=O)O MCULE-4640477792 [0,1,1,0,0,0|1,0,1]=4 3385 B8R0.23 CC(=O)CC(N)C(=O)O MCULE-6275652695 [0,1,1,0,0,0|1,0,1]=4 3386 B8R0.23 CC(=O)CC(N)C(=O)O MCULE-6690241894 [0,1,1,0,0,0|1,0,1]=4 3387 B8R0.23 CC(=O)CC(O)C(=O)C MCULE-3447949844 [0,1,1,0,0,0|1,0,1]=4 3388 B8R0.23 CC(=O)CC(O)C(=O)O MCULE-4728629069 [0,1,1,0,0,0|0,0,1]=3 3389 B8R0.23 CC(=O)NC(C)C(=O)O MCULE-1209958700 [0,1,1,0,0,0|1,0,1]=4 3390 B8R0.23 CC(=O)NC(C)C(=O)O MCULE-6844686208 [0,1,1,0,0,0|1,0,1]=4 3391 B8R0.23 CC(=O)N[C@@H](C)C(=O)O MCULE-7453059048 [0,1,1,0,0,0|1,0,1]=4 3392 B8R0.23 CC(=O)N[C@@H](C)C(=O)O MCULE-9637570463 [0,1,1,0,0,0|1,0,1]=4 3393 B8R0.23 CC(=O)N[C@H](C)C(=O)O MCULE-1908712348 [0,1,1,0,0,0|1,0,1]=4 3394 B8R0.23 CC(=O)N[C@H](C)C(=O)O MCULE-3023888296 [0,1,1,0,0,0|1,0,1]=4 3395 B8R0.23 CC(=O)OC(C)C(=O)C MCULE-7403314261 [0,1,1,0,0,0|1,0,1]=4 3396 B8R0.23 CC(=O)OC(C)C(=O)Cl MCULE-9987734584 [0,1,1,0,0,0|1,0,1]=4 3397 B8R0.23 CC(=O)OC(C)C(=O)O MCULE-6745958064 [0,1,1,0,0,0|0,0,1]=3 3398 B8R0.23 CC(=O)OC(C)C(=O)O MCULE-8940501529 [0,1,1,0,0,0|0,0,1]=3 3399 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl MCULE-6842776649 [0,1,1,0,0,0|1,0,1]=4 3400 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl MCULE-9564324053 [0,1,1,0,0,0|1,0,1]=4 3401 B8R0.23 CC(=O)O[C@@H](C)C(=O)O MCULE-7850132202 [0,1,1,0,0,0|0,0,1]=3 3402 B8R0.23 CC(=O)O[C@@H](C)C(=O)O MCULE-9087871033 [0,1,1,0,0,0|0,0,1]=3 3403 B8R0.23 CC(=O)O[C@H](C)C(=O)Cl MCULE-4690787544 [0,1,1,0,0,0|1,0,1]=4 3404 B8R0.23 CC(=O)O[C@H](C)C(=O)Cl MCULE-6415823129 [0,1,1,0,0,0|1,0,1]=4 3405 B8R0.23 CC(=O)O[C@H](C)C(=O)O MCULE-3788243723 [0,1,1,0,0,0|0,0,1]=3 3406 B8R0.23 CC(=O)O[C@H](C)C(=O)O MCULE-8696299139 [0,1,1,0,0,0|0,0,1]=3 3407 B8R0.23 CC(C)CC(=O)C(=O)O MCULE-4155006996 [0,1,1,0,0,0|0,0,2]=4 3408 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-2778142655 [0,1,1,0,0,0|1,0,0]=3 3409 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-7689846956 [0,1,1,0,0,0|1,0,0]=3 3410 B8R0.23 CC(C)CC(C)C(=O)O MCULE-7217536279 [0,1,1,0,0,0|1,0,0]=3 3411 B8R0.23 CC(C)CC(Cl)C(=O)O MCULE-6347367806 [0,1,1,0,0,0|1,0,0]=3 3412 B8R0.23 CC(C)CC(F)C(=O)O MCULE-6908911956 [0,1,1,0,0,0|1,0,0]=3 3413 B8R0.23 CC(C)CC(N)C(=O)N MCULE-8974870406 [0,1,1,0,0,0|2,0,0]=4 3414 B8R0.23 CC(C)CC(N)C(=O)N MCULE-9193295179 [0,1,1,0,0,0|2,0,0]=4 3415 B8R0.23 CC(C)CC(N)C(=O)O MCULE-2550986320 [0,1,1,0,0,0|1,0,0]=3 3416 B8R0.23 CC(C)CC(N)C(=O)O MCULE-7657212416 [0,1,1,0,0,0|1,0,0]=3 3417 B8R0.23 CC(C)CC(O)C(=O)O MCULE-3638762911 [0,1,1,0,0,0|0,0,0]=2 3418 B8R0.23 CC(C)CC(O)C(=O)O MCULE-4315013875 [0,1,1,0,0,0|0,0,0]=2 3419 B8R0.23 CC(C)C[C@@H](Br)C(=O)O MCULE-2325122781 [0,1,1,0,0,0|1,0,0]=3 3420 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O MCULE-6797937420 [0,1,1,0,0,0|1,0,0]=3 3421 B8R0.23 CC(C)C[C@@H](N)C(=O)N MCULE-6195005494 [0,1,1,0,0,0|2,0,0]=4 3422 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-3041792060 [0,1,1,0,0,0|1,0,0]=3 3423 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-8280206722 [0,1,1,0,0,0|1,0,0]=3 3424 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-4108530385 [0,1,1,0,0,0|0,0,0]=2 3425 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-5253943571 [0,1,1,0,0,0|0,0,0]=2 3426 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-4423121396 [0,1,1,0,0,0|1,0,0]=3 3427 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-7601821889 [0,1,1,0,0,0|1,0,0]=3 3428 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-1038344796 [0,1,1,0,0,0|1,0,0]=3 3429 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-9007168250 [0,1,1,0,0,0|1,0,0]=3 3430 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-3907393760 [0,1,1,0,0,0|2,0,0]=4 3431 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-5393472198 [0,1,1,0,0,0|2,0,0]=4 3432 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-7425207205 [0,1,1,0,0,0|2,0,0]=4 3433 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-8093463847 [0,1,1,0,0,0|2,0,0]=4 3434 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4718215038 [0,1,1,0,0,0|1,0,0]=3 3435 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4930237913 [0,1,1,0,0,0|1,0,0]=3 3436 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-8722899457 [0,1,1,0,0,0|1,0,0]=3 3437 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-1740362996 [0,1,1,0,0,0|0,0,0]=2 3438 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-4466965907 [0,1,1,0,0,0|0,0,0]=2 3439 B8R0.23 CC(C)NC(C)C(=O)O MCULE-1412835872 [0,1,1,0,0,0|1,0,0]=3 3440 B8R0.23 CC(C)NC(C)C(=O)O MCULE-5184634957 [0,1,1,0,0,0|1,0,0]=3 3441 B8R0.23 CC(C)OC(C)C(=O)O MCULE-6571129429 [0,1,1,0,0,0|0,0,0]=2 3442 B8R0.23 CC(C)OC(C)C(=O)[O-] MCULE-2169564496 [0,1,1,0,0,0|0,0,1]=3 3443 B8R0.23 CC(C)SC(C)C(=O)O MCULE-1620493707 [0,1,1,0,0,0|0,1,0]=3 3444 B8R0.23 CC(CC(F)F)C(=O)O MCULE-2211206695 [0,1,1,0,0,0|2,0,0]=4 3445 B8R0.23 CC(CN(C)C)C(=O)O MCULE-7139783268 [0,1,1,0,0,0|2,0,0]=4 3446 B8R0.23 CC(CN(C)C)C(=O)O MCULE-7716649676 [0,1,1,0,0,0|2,0,0]=4 3447 B8R0.23 CC(CS(=O)C)C(=O)O MCULE-4855592077 [0,1,1,0,0,0|2,0,0]=4 3448 B8R0.23 CN(C)CC(N)C(=O)O MCULE-4589211472 [0,1,1,0,0,0|2,0,0]=4 3449 B8R0.23 CN(C)CC(N)C(=O)O MCULE-4873136690 [0,1,1,0,0,0|2,0,0]=4 3450 B8R0.23 CN(C)CC(O)C(=O)O MCULE-2461037518 [0,1,1,0,0,0|1,0,0]=3 3451 B8R0.23 CN(C)C[C@@H](N)C(=O)O MCULE-7056570231 [0,1,1,0,0,0|2,0,0]=4 3452 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-1155351106 [0,1,1,0,0,0|2,0,0]=4 3453 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-2217543416 [0,1,1,0,0,0|2,0,0]=4 3454 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-6989814495 [0,1,1,0,0,0|2,0,0]=4 3455 B8R0.23 CN(C)C[C@H](N)C(=O)O MCULE-7529109312 [0,1,1,0,0,0|2,0,0]=4 3456 B8R0.23 CN(C)C[C@H](O)C(=O)O MCULE-7629489364 [0,1,1,0,0,0|1,0,0]=3 3457 B8R0.23 CS(=O)CC(N)C(=O)O MCULE-5699602621 [0,1,1,0,0,0|2,0,0]=4 3458 B8R0.23 CS(=O)C[C@@H](N)C(=O)O MCULE-8253087333 [0,1,1,0,0,0|2,0,0]=4 3459 B8R0.23 CS(=O)C[C@H](N)C(=O)O MCULE-5080098254 [0,1,1,0,0,0|2,0,0]=4 3460 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5195061270 [0,1,1,0,0,0|1,0,0]=3 3461 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5975065356 [0,1,1,0,0,0|1,0,0]=3 3462 B8R0.23 C[S@](=O)C[C@@H](N)C(=O)O MCULE-4004385080 [0,1,1,0,0,0|2,0,0]=4 3463 B8R0.23 NC(CC(F)F)C(=O)O MCULE-1880803967 [0,1,1,0,0,0|2,0,0]=4 3464 B8R0.23 NC(CC(F)F)C(=O)O MCULE-7276277891 [0,1,1,0,0,0|2,0,0]=4 3465 B8R0.23 N[C@@H](CC(Cl)Cl)C(=O)O MCULE-9426370618 [0,1,1,0,0,0|2,0,0]=4 3466 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-3232895455 [0,1,1,0,0,0|2,0,0]=4 3467 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-3771092799 [0,1,1,0,0,0|2,0,0]=4 3468 B8R0.23 N[C@@H](CC(F)F)C(=O)O MCULE-5990452255 [0,1,1,0,0,0|2,0,0]=4 3469 B8R0.23 N[C@H](CC(F)F)C(=O)O MCULE-2615133633 [0,1,1,0,0,0|2,0,0]=4 3470 B8R0.23 N[C@H](CC(F)F)C(=O)O MCULE-4923641891 [0,1,1,0,0,0|2,0,0]=4 3471 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-5852208511 [0,1,1,0,0,0|1,0,1]=4 3472 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9713558868 [0,1,1,0,0,0|1,0,1]=4 3473 B8R0.23 O=C(O)CC(O)C(=O)O MCULE-9924961830 [0,1,1,0,0,0|1,0,1]=4 3474 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-2239273084 [0,1,1,0,0,0|1,0,1]=4 3475 B8R0.23 O=C(O)C[C@@H](O)C(=O)O MCULE-4984266891 [0,1,1,0,0,0|1,0,1]=4 3476 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8339271078 [0,1,1,0,0,0|1,0,1]=4 3477 B8R0.23 O=C(O)C[C@H](O)C(=O)O MCULE-8865188741 [0,1,1,0,0,0|1,0,1]=4 3478 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-4796212792 [0,1,1,0,0,0|2,0,0]=4 3479 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-7620299780 [0,1,1,0,0,0|2,0,0]=4 3480 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-8990653324 [0,1,1,0,0,0|2,0,0]=4 3481 B8R0.23 [C@H](N)(CS(=O)C)C(=O)O MCULE-5084638505 [0,1,1,0,0,0|2,0,0]=4 3482 B8R0.18 CC(C)C(CN)C(=O)O MCULE-4117902081 [0,1,1,0,0,0|2,0,0]=4 3483 B8R0.18 CC(C)C(CN)C(=O)O MCULE-7615812755 [0,1,1,0,0,0|2,0,0]=4 3484 B8R0.18 CC(C)C(CN)C(=O)O MCULE-7742033605 [0,1,1,0,0,0|2,0,0]=4 3485 B8R0.18 CC(C)C(CO)C(=O)O MCULE-3554430088 [0,1,1,0,0,0|2,0,0]=4 3486 B8R0.18 CC(C)C(NN)C(=O)O MCULE-5064228794 [0,1,1,0,0,0|2,0,0]=4 3487 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-1192054373 [0,1,1,0,0,0|2,0,0]=4 3488 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-3040043200 [0,1,1,0,0,0|2,0,0]=4 3489 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-4353846755 [0,1,1,0,0,0|2,0,0]=4 3490 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-6762829521 [0,1,1,0,0,0|2,0,0]=4 3491 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4384560751 [0,1,1,0,0,0|2,0,0]=4 3492 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4859224613 [0,1,1,0,0,0|2,0,0]=4 3493 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4974717674 [0,1,1,0,0,0|2,0,0]=4 3494 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-7170111497 [0,1,1,0,0,0|2,0,0]=4 3495 B8R0.18 CC(C)[C@H](NO)C(=O)O MCULE-4203177410 [0,1,1,0,0,0|2,0,0]=4 3496 B8R0.18 CCC(C(=O)C)C(=O)C MCULE-2654310210 [0,1,1,0,0,0|2,0,0]=4 3497 B8R0.18 CCC(C(=O)C)C(=O)[O-] MCULE-6595833151 [0,1,1,0,0,0|1,0,1]=4 3498 B8R0.18 CCC(C(=O)C)C(=O)[O-] MCULE-8541174028 [0,1,1,0,0,0|1,0,1]=4 3499 B8R0.18 CCC(C(=O)C)C(C)C MCULE-3028115393 [0,1,1,0,0,0|2,0,0]=4 3500 B8R0.18 CCC(C(=O)O)C(=O)O MCULE-3288957588 [0,1,1,0,0,0|2,0,0]=4 3501 B8R0.18 CCC(C(=O)O)C(C)C MCULE-5914693527 [0,1,1,0,0,0|1,0,0]=3 3502 B8R0.18 CCC(C(=O)O)C(C)N MCULE-2976322800 [0,1,1,0,0,0|1,0,0]=3 3503 B8R0.18 CCC(C(=O)O)C(C)O MCULE-1064081188 [0,1,1,0,0,0|1,0,0]=3 3504 B8R0.18 CCC(C(=O)O)N(C)C MCULE-4235177725 [0,1,1,0,0,0|1,0,0]=3 3505 B8R0.18 CC[C@@H](C(=O)O)N(C)C MCULE-3756764540 [0,1,1,0,0,0|1,0,0]=3 3506 B8R0.18 CC[C@H](C(=O)O)N(C)C MCULE-4719850768 [0,1,1,0,0,0|1,0,0]=3 3507 B8R0.18 CN(C)C(CN)C(=O)O MCULE-6449978430 [0,1,1,0,0,0|2,0,0]=4 3508 B8R0.18 CNC(C(=O)C)C(C)C MCULE-7800115305 [0,1,1,0,0,0|2,0,0]=4 3509 B8R0.18 CNC(C(=O)C)C(C)C MCULE-7817785327 [0,1,1,0,0,0|2,0,0]=4 3510 B8R0.18 CNC(C(=O)O)C(C)C MCULE-2983512448 [0,1,1,0,0,0|1,0,0]=3 3511 B8R0.18 CNC(C(=O)O)C(C)C MCULE-5377326864 [0,1,1,0,0,0|1,0,0]=3 3512 B8R0.18 CNC(C(=O)O)C(C)C MCULE-7319327975 [0,1,1,0,0,0|1,0,0]=3 3513 B8R0.18 CNC(C(=O)O)C(C)O MCULE-8017224741 [0,1,1,0,0,0|1,0,0]=3 3514 B8R0.18 CN[C@@H](C(=O)N)C(C)C MCULE-3721439514 [0,1,1,0,0,0|2,0,0]=4 3515 B8R0.18 CN[C@@H](C(=O)N)C(C)C MCULE-9356028516 [0,1,1,0,0,0|2,0,0]=4 3516 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-4099145544 [0,1,1,0,0,0|1,0,0]=3 3517 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-4380404369 [0,1,1,0,0,0|1,0,0]=3 3518 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-9367123188 [0,1,1,0,0,0|1,0,0]=3 3519 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-9706333586 [0,1,1,0,0,0|1,0,0]=3 3520 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5443567819 [0,1,1,0,0,0|1,0,0]=3 3521 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5552228182 [0,1,1,0,0,0|1,0,0]=3 3522 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5767489702 [0,1,1,0,0,0|1,0,0]=3 3523 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-8822349419 [0,1,1,0,0,0|1,0,0]=3 3524 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-5405618703 [0,1,1,0,0,0|1,0,0]=3 3525 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-6470355986 [0,1,1,0,0,0|1,0,0]=3 3526 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-7261692258 [0,1,1,0,0,0|1,0,0]=3 3527 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-7763091319 [0,1,1,0,0,0|1,0,0]=3 3528 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-8429501411 [0,1,1,0,0,0|1,0,0]=3 3529 B8R0.18 COC(C(=O)C)C(=O)C MCULE-2169553892 [0,1,1,0,0,0|1,0,1]=4 3530 B8R0.18 COC(C(=O)O)C(C)Br MCULE-9261088290 [0,1,1,0,0,0|0,0,0]=2 3531 B8R0.18 COC(C(=O)O)C(C)C MCULE-4922461673 [0,1,1,0,0,0|0,0,0]=2 3532 B8R0.18 COC(C(=O)O)C(C)C MCULE-6661618070 [0,1,1,0,0,0|0,0,0]=2 3533 B8R0.18 COC(C(=O)O)C(C)N MCULE-5882264486 [0,1,1,0,0,0|0,0,0]=2 3534 B8R0.18 CO[C@@H](C(=O)O)C(C)C MCULE-1619707717 [0,1,1,0,0,0|0,0,0]=2 3535 B8R0.18 CO[C@H](C(=O)O)C(C)C MCULE-2291773409 [0,1,1,0,0,0|0,0,0]=2 3536 B8R0.18 CSC(C(=O)O)C(C)C MCULE-9613087260 [0,1,1,0,0,0|0,1,0]=3 3537 B8R0.20 CCC(CC)C(=O)NC MCULE-1491407837 [0,1,1,0,0,0|2,0,0]=4 3538 B8R0.20 CCC(CC)C(=O)NN MCULE-2188897892 [0,1,1,0,0,0|2,0,0]=4 3539 B8R0.20 CCC(CC)C(=O)OC MCULE-4475439540 [0,1,1,0,0,0|1,0,0]=3 3540 B8R0.20 CCC(CN)C(=O)OC MCULE-1321974588 [0,1,1,0,0,0|2,0,0]=4 3541 B8R0.20 CCC(CN)C(=O)OC MCULE-3486156834 [0,1,1,0,0,0|2,0,0]=4 3542 B8R0.20 CCC(CO)C(=O)OC MCULE-3580039708 [0,1,1,0,0,0|2,0,0]=4 3543 B8R0.20 CCC(NC)C(=O)OC MCULE-2432468432 [0,1,1,0,0,0|1,0,0]=3 3544 B8R0.20 CCC(NC)C(=O)OC MCULE-3478855741 [0,1,1,0,0,0|1,0,0]=3 3545 B8R0.20 CCC(OC)C(=O)NN MCULE-3579318749 [0,1,1,0,0,0|1,0,0]=3 3546 B8R0.20 CCC(OC)C(=O)NN MCULE-8374336485 [0,1,1,0,0,0|1,0,0]=3 3547 B8R0.20 CCN(CC)C(=O)CO MCULE-1108898893 [0,1,1,0,0,0|2,0,0]=4 3548 B8R0.20 CCN(OC)C(=O)CN MCULE-2148404310 [0,1,1,0,0,0|2,0,0]=4 3549 B8R0.20 CCN(OC)C(=O)CN MCULE-8510064396 [0,1,1,0,0,0|2,0,0]=4 3550 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-3786730078 [0,1,1,0,0,0|1,0,0]=3 3551 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-5452442009 [0,1,1,0,0,0|1,0,0]=3 3552 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-6957965861 [0,1,1,0,0,0|1,0,0]=3 3553 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-7876560081 [0,1,1,0,0,0|1,0,0]=3 3554 B8R0.20 CNC(CN)C(=O)OC MCULE-3787828683 [0,1,1,0,0,0|2,0,0]=4 3555 B8R0.20 CNC(CO)C(=O)OC MCULE-1017957273 [0,1,1,0,0,0|2,0,0]=4 3556 B8R0.20 CNC(CO)C(=O)OC MCULE-2751377307 [0,1,1,0,0,0|2,0,0]=4 3557 B8R0.20 COC(=O)C(CBr)OC MCULE-1221978209 [0,1,1,0,0,0|1,0,0]=3 3558 B8R0.20 COC(=O)C(CN)OC MCULE-2907367615 [0,1,1,0,0,0|1,0,0]=3 3559 B8R0.20 COC(=O)C(OC)OC MCULE-7706382604 [0,1,1,0,0,0|1,0,0]=3 3560 B8R0.20 COC(=O)[C@H](CN)OC MCULE-7711946747 [0,1,1,0,0,0|1,0,0]=3 3561 B8R0.20 COC(=O)[C@H](CN)OC MCULE-8104475257 [0,1,1,0,0,0|1,0,0]=3 3562 B8R0.20 COC(OC)C(=O)NN MCULE-7537765153 [0,1,1,0,0,0|2,0,0]=4 3563 B8R0.36 C=CC(C)(CC)C(=O)O MCULE-9807737236 [0,1,1,0,0,0|1,0,1]=4 3564 B8R0.36 CCC(Br)(CC)C(=O)O MCULE-6441337805 [0,1,1,0,0,0|1,0,0]=3 3565 B8R0.36 CCC(C)(C#N)C(=O)O MCULE-5558018145 [0,1,1,0,0,0|2,0,0]=4 3566 B8R0.36 CCC(C)(CC)C(=O)C MCULE-2334513479 [0,1,1,0,0,0|2,0,0]=4 3567 B8R0.36 CCC(C)(CC)C(=O)Cl MCULE-4125691098 [0,1,1,0,0,0|2,0,0]=4 3568 B8R0.36 CCC(C)(CC)C(=O)O MCULE-1997463075 [0,1,1,0,0,0|1,0,0]=3 3569 B8R0.36 CCC(C)(CO)C(=O)O MCULE-7481967307 [0,1,1,0,0,0|2,0,0]=4 3570 B8R0.36 CCC(C)(OC)C(=O)O MCULE-9916724590 [0,1,1,0,0,0|0,0,0]=2 3571 B8R0.36 CCC(F)(CC)C(=O)O MCULE-9436369621 [0,1,1,0,0,0|1,0,0]=3 3572 B8R0.36 CCC(N)(CC)C(=O)N MCULE-4886059492 [0,1,1,0,0,0|2,0,0]=4 3573 B8R0.36 CCC(N)(CC)C(=O)N MCULE-8377450478 [0,1,1,0,0,0|2,0,0]=4 3574 B8R0.36 CCC(N)(CC)C(=O)O MCULE-9609626868 [0,1,1,0,0,0|1,0,0]=3 3575 B8R0.36 CCC(N)(CC)C(=O)O MCULE-9646246236 [0,1,1,0,0,0|1,0,0]=3 3576 B8R0.36 CCC(O)(CC)C(=O)C MCULE-8377775342 [0,1,1,0,0,0|2,0,0]=4 3577 B8R0.36 CCC(O)(CC)C(=O)O MCULE-9621851149 [0,1,1,0,0,0|1,0,0]=3 3578 B8R0.36 COC(C)(OC)C(=O)C MCULE-1748868627 [0,1,1,0,0,0|2,0,0]=4 3579 B8R0.36 COC(C)(OC)C(=O)N MCULE-7255859330 [0,1,1,0,0,0|2,0,0]=4 3580 B8R1.1 CC1CCC(C1)C=O MCULE-9381232427 [1,1,0,0,0,0|1,0,0]=3 3581 B8R1.1 CC1CCC(C1)CO MCULE-3130047677 [1,1,0,0,0,0|1,0,1]=4 3582 B8R1.1 CC1CCC(N1)CO MCULE-7935473441 [1,1,0,0,0,0|1,0,1]=4 3583 B8R1.1 CC1CCC(N1)CO MCULE-8743496847 [1,1,0,0,0,0|1,0,1]=4 3584 B8R1.1 CC1CCC(O1)CI MCULE-2805289539 [1,1,0,0,0,0|1,0,1]=4 3585 B8R1.1 CC1CCC(O1)CN MCULE-4161233821 [1,1,0,0,0,0|1,0,1]=4 3586 B8R1.1 CC1CCC(O1)CO MCULE-1587985152 [1,1,0,0,0,0|0,0,1]=3 3587 B8R1.1 CC1CNC(C1)CO MCULE-2461186712 [1,1,0,0,0,0|1,0,1]=4 3588 B8R1.1 CC1CNC(C1)CO MCULE-5209280647 [1,1,0,0,0,0|1,0,1]=4 3589 B8R1.1 CC1COC(C1)CO MCULE-4511313299 [1,1,0,0,0,0|0,0,1]=3 3590 B8R1.1 CC1OCC(O1)CO MCULE-1328866429 [1,1,0,0,0,0|1,0,1]=4 3591 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-5635555767 [1,1,0,0,0,0|1,0,1]=4 3592 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-7103292821 [1,1,0,0,0,0|1,0,1]=4 3593 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-8577607094 [1,1,0,0,0,0|1,0,1]=4 3594 B8R1.1 C[C@@H]1CC[C@@H](N1)CO MCULE-8853557592 [1,1,0,0,0,0|1,0,1]=4 3595 B8R1.1 C[C@@H]1CC[C@@H](O1)CO MCULE-1981408927 [1,1,0,0,0,0|0,0,1]=3 3596 B8R1.1 C[C@@H]1CC[C@@H](O1)CO MCULE-2750103072 [1,1,0,0,0,0|0,0,1]=3 3597 B8R1.1 C[C@@H]1CN[C@@H](C1)CO MCULE-1057201942 [1,1,0,0,0,0|1,0,1]=4 3598 B8R1.1 C[C@@H]1CN[C@@H](C1)CO MCULE-5251520971 [1,1,0,0,0,0|1,0,1]=4 3599 B8R1.1 C[C@H]1CC[C@H](N1)CO MCULE-5943356667 [1,1,0,0,0,0|1,0,1]=4 3600 B8R1.1 C[C@H]1CC[C@H](N1)CO MCULE-6303404144 [1,1,0,0,0,0|1,0,1]=4 3601 B8R1.1 C[C@H]1CC[C@H](O1)CO MCULE-2585928492 [1,1,0,0,0,0|0,0,1]=3 3602 B8R1.1 C[C@H]1CC[C@H](O1)CO MCULE-3715649264 [1,1,0,0,0,0|0,0,1]=3 3603 B8R1.1 C[C@H]1CN[C@@H](C1)CO MCULE-3784655204 [1,1,0,0,0,0|1,0,1]=4 3604 B8R1.1 C[C@H]1CN[C@@H](C1)CO MCULE-3927798393 [1,1,0,0,0,0|1,0,1]=4 3605 B8R1.1 N[C@@H]1CN[C@H](C1)CO MCULE-7916347231 [1,1,0,0,0,0|1,0,1]=4 3606 B8R1.1 N[C@@H]1CN[C@H](C1)CO MCULE-8825406157 [1,1,0,0,0,0|1,0,1]=4 3607 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-3649010281 [1,1,0,0,0,0|1,0,1]=4 3608 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-5102365319 [1,1,0,0,0,0|1,0,1]=4 3609 B8R1.1 N[C@H]1CN[C@@H](C1)CO MCULE-8268517033 [1,1,0,0,0,0|1,0,1]=4 3610 B8R1.1 O=C1CCC(O1)CO MCULE-3178999726 [1,1,0,0,0,0|0,0,2]=4 3611 B8R1.1 O=C1CCC(O1)CO MCULE-4390773734 [1,1,0,0,0,0|0,0,2]=4 3612 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-1532290348 [1,1,0,0,0,0|0,0,2]=4 3613 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-3600746831 [1,1,0,0,0,0|0,0,2]=4 3614 B8R1.1 O=C1CC[C@H](O1)CO MCULE-1675076625 [1,1,0,0,0,0|0,0,2]=4 3615 B8R1.1 O=C1CC[C@H](O1)CO MCULE-6265569115 [1,1,0,0,0,0|0,0,2]=4 3616 B8R1.1 O=C[C@@H]1CC(CN1)F MCULE-5331901113 [1,1,0,0,0,0|1,0,0]=3 3617 B8R1.1 O=C[C@@H]1CC(CN1)F MCULE-6102557843 [1,1,0,0,0,0|1,0,0]=3 3618 B8R1.1 OC1COC(C1)CI MCULE-9241971646 [1,1,0,0,0,0|1,0,1]=4 3619 B8R1.1 OCC1CC(CN1)F MCULE-6111724005 [1,1,0,0,0,0|1,0,1]=4 3620 B8R1.1 OCC1CC(CN1)F MCULE-9466287708 [1,1,0,0,0,0|1,0,1]=4 3621 B8R1.1 OCC1CC(CN1)O MCULE-1017614151 [1,1,0,0,0,0|1,0,1]=4 3622 B8R1.1 OCC1CC(CN1)O MCULE-5049675085 [1,1,0,0,0,0|1,0,1]=4 3623 B8R1.1 OCC1CC(CO1)O MCULE-4648895678 [1,1,0,0,0,0|0,0,1]=3 3624 B8R1.1 OCC1CCC(C1)F MCULE-4786923020 [1,1,0,0,0,0|1,0,1]=4 3625 B8R1.1 OCC1CCC(C1)O MCULE-5225292788 [1,1,0,0,0,0|1,0,1]=4 3626 B8R1.1 OC[C@@H]1CC[C@@H](C1)O MCULE-7117159358 [1,1,0,0,0,0|1,0,1]=4 3627 B8R1.1 OC[C@@H]1CC[C@H](C1)F MCULE-4252726732 [1,1,0,0,0,0|1,0,1]=4 3628 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-2619594606 [1,1,0,0,0,0|1,0,1]=4 3629 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-3940168858 [1,1,0,0,0,0|1,0,1]=4 3630 B8R1.1 OC[C@@H]1C[C@@H](CN1)F MCULE-6567372757 [1,1,0,0,0,0|1,0,1]=4 3631 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-2521610955 [1,1,0,0,0,0|1,0,1]=4 3632 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-3659134136 [1,1,0,0,0,0|1,0,1]=4 3633 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-8149895498 [1,1,0,0,0,0|1,0,1]=4 3634 B8R1.1 OC[C@@H]1C[C@@H](CN1)O MCULE-9582350102 [1,1,0,0,0,0|1,0,1]=4 3635 B8R1.1 OC[C@@H]1C[C@@H](CO1)O MCULE-7875239623 [1,1,0,0,0,0|0,0,1]=3 3636 B8R1.1 OC[C@@H]1C[C@H](CN1)F MCULE-4754863670 [1,1,0,0,0,0|1,0,1]=4 3637 B8R1.1 OC[C@@H]1C[C@H](CN1)F MCULE-4823692987 [1,1,0,0,0,0|1,0,1]=4 3638 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-4908761192 [1,1,0,0,0,0|1,0,1]=4 3639 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-5510339033 [1,1,0,0,0,0|1,0,1]=4 3640 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-7612890329 [1,1,0,0,0,0|1,0,1]=4 3641 B8R1.1 OC[C@@H]1C[C@H](CN1)O MCULE-8424913442 [1,1,0,0,0,0|1,0,1]=4 3642 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-7760122854 [1,1,0,0,0,0|1,0,1]=4 3643 B8R1.1 OC[C@H]1CC[C@@H](C1)O MCULE-9132554470 [1,1,0,0,0,0|1,0,1]=4 3644 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-2106727383 [1,1,0,0,0,0|1,0,1]=4 3645 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-3167425320 [1,1,0,0,0,0|1,0,1]=4 3646 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-5656834651 [1,1,0,0,0,0|1,0,1]=4 3647 B8R1.1 OC[C@H]1C[C@@H](CN1)F MCULE-9413584553 [1,1,0,0,0,0|1,0,1]=4 3648 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-2855908983 [1,1,0,0,0,0|1,0,1]=4 3649 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-5564885819 [1,1,0,0,0,0|1,0,1]=4 3650 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-9276468823 [1,1,0,0,0,0|1,0,1]=4 3651 B8R1.1 OC[C@H]1C[C@@H](CN1)O MCULE-9585503921 [1,1,0,0,0,0|1,0,1]=4 3652 B8R1.1 OC[C@H]1C[C@@H](CO1)O MCULE-5801561749 [1,1,0,0,0,0|0,0,1]=3 3653 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3583754715 [1,1,0,0,0,0|1,0,1]=4 3654 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3654392017 [1,1,0,0,0,0|1,0,1]=4 3655 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-3959005096 [1,1,0,0,0,0|1,0,1]=4 3656 B8R1.1 OC[C@H]1C[C@H](CN1)F MCULE-9542838904 [1,1,0,0,0,0|1,0,1]=4 3657 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-2099905531 [1,1,0,0,0,0|1,0,1]=4 3658 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-5693059049 [1,1,0,0,0,0|1,0,1]=4 3659 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-6004929736 [1,1,0,0,0,0|1,0,1]=4 3660 B8R1.1 OC[C@H]1C[C@H](CN1)O MCULE-8607282785 [1,1,0,0,0,0|1,0,1]=4 3661 B8R1.1 OC[C@H]1C[C@H](CO1)O MCULE-4197376814 [1,1,0,0,0,0|0,0,1]=3 3662 B8R1.1 OC[C@H]1C[C@H](CO1)O MCULE-4573543387 [1,1,0,0,0,0|0,0,1]=3 3663 B8R1.1 [C@H]1(CN[C@@H](C1)CO)C MCULE-1910074067 [1,1,0,0,0,0|1,0,1]=4 3664 B8R1.1 [C@H]1(CN[C@@H](C1)CO)C MCULE-9340203932 [1,1,0,0,0,0|1,0,1]=4 3665 B8R1.1 [C@H]1(CN[C@@H](C1)CO)F MCULE-7089143816 [1,1,0,0,0,0|1,0,1]=4 3666 B8R1.1 [C@H]1(C[C@H](CN1)F)CO MCULE-2231031404 [1,1,0,0,0,0|1,0,1]=4 3667 B8R1.1 [C@H]1(C[C@H](CN1)F)CO MCULE-6096542902 [1,1,0,0,0,0|1,0,1]=4 3668 B8R1.1 [C@H]1(C[C@H](CN1)N)CO MCULE-6496782896 [1,1,0,0,0,0|1,0,1]=4 3669 B8R1.1 [C@H]1(C[C@H](CN1)O)CO MCULE-4041584401 [1,1,0,0,0,0|1,0,1]=4 3670 B8R1.1 [C@H]1(C[C@H](CN1)O)CO MCULE-9607072956 [1,1,0,0,0,0|1,0,1]=4 3671 B8R1.8 BrCCC1CCCO1 MCULE-6674503285 [1,1,0,0,0,0|1,0,1]=4 3672 B8R1.8 C1(CCCN1)COC MCULE-7740200307 [1,1,0,0,0,0|1,0,1]=4 3673 B8R1.8 C=CCC1CCCC1 MCULE-6306576171 [1,1,0,0,0,0|2,0,0]=4 3674 B8R1.8 C=CCC1CCCN1 MCULE-2522287788 [1,1,0,0,0,0|2,0,0]=4 3675 B8R1.8 C=CCC1CCCN1 MCULE-9373442327 [1,1,0,0,0,0|2,0,0]=4 3676 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-1619177702 [1,1,0,0,0,0|2,0,0]=4 3677 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-1817861281 [1,1,0,0,0,0|2,0,0]=4 3678 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-4058658588 [1,1,0,0,0,0|2,0,0]=4 3679 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-5972924318 [1,1,0,0,0,0|2,0,0]=4 3680 B8R1.8 C=CC[C@H]1CCCN1 MCULE-4617277800 [1,1,0,0,0,0|2,0,0]=4 3681 B8R1.8 C=CC[C@H]1CCCN1 MCULE-6182243336 [1,1,0,0,0,0|2,0,0]=4 3682 B8R1.8 CCOC1CCCO1 MCULE-8408094445 [1,1,0,0,0,0|1,0,1]=4 3683 B8R1.8 CNCC1CCCO1 MCULE-9343447516 [1,1,0,0,0,0|1,0,1]=4 3684 B8R1.8 CNC[C@H]1CCCO1 MCULE-4511797485 [1,1,0,0,0,0|1,0,1]=4 3685 B8R1.8 COCC1CCCN1 MCULE-3490399589 [1,1,0,0,0,0|1,0,1]=4 3686 B8R1.8 COCC1CCCN1 MCULE-7671263939 [1,1,0,0,0,0|1,0,1]=4 3687 B8R1.8 COC[C@@H]1CCCN1 MCULE-2033169765 [1,1,0,0,0,0|1,0,1]=4 3688 B8R1.8 COC[C@@H]1CCCN1 MCULE-2588521588 [1,1,0,0,0,0|1,0,1]=4 3689 B8R1.8 COC[C@@H]1CCCN1 MCULE-9107605896 [1,1,0,0,0,0|1,0,1]=4 3690 B8R1.8 COC[C@@H]1CCCN1 MCULE-9163912821 [1,1,0,0,0,0|1,0,1]=4 3691 B8R1.8 COC[C@H]1CCCN1 MCULE-4066409185 [1,1,0,0,0,0|1,0,1]=4 3692 B8R1.8 COC[C@H]1CCCN1 MCULE-4591980137 [1,1,0,0,0,0|1,0,1]=4 3693 B8R1.8 COC[C@H]1CCCN1 MCULE-4935200138 [1,1,0,0,0,0|1,0,1]=4 3694 B8R1.8 COC[C@H]1CCCN1 MCULE-7300265857 [1,1,0,0,0,0|1,0,1]=4 3695 B8R1.8 CONC1CCCC1 MCULE-2334525824 [1,1,0,0,0,0|2,0,0]=4 3696 B8R1.8 CONC1CCCC1 MCULE-8234744945 [1,1,0,0,0,0|2,0,0]=4 3697 B8R1.8 ClCCC1CCCO1 MCULE-5564811515 [1,1,0,0,0,0|1,0,1]=4 3698 B8R1.8 N#CCC1CCCO1 MCULE-4086843466 [1,1,0,0,0,0|1,0,1]=4 3699 B8R1.8 NCCC1CCCO1 MCULE-3914619069 [1,1,0,0,0,0|1,0,1]=4 3700 B8R1.8 NCC[C@H]1CCCO1 MCULE-2485674670 [1,1,0,0,0,0|1,0,1]=4 3701 B8R1.8 NCC[C@H]1CCCO1 MCULE-3778854223 [1,1,0,0,0,0|1,0,1]=4 3702 B8R1.8 NNCC1CCCO1 MCULE-1236160453 [1,1,0,0,0,0|1,0,1]=4 3703 B8R1.8 NNCC1CCCO1 MCULE-3775714919 [1,1,0,0,0,0|1,0,1]=4 3704 B8R1.8 NOCC1CCCC1 MCULE-4591181284 [1,1,0,0,0,0|1,0,1]=4 3705 B8R1.8 NOCC1CCCC1 MCULE-5675248010 [1,1,0,0,0,0|1,0,1]=4 3706 B8R1.8 O=C=NC1CCCC1 MCULE-6237253816 [1,1,0,0,0,0|1,0,1]=4 3707 B8R1.8 O=CCC1CCCC1 MCULE-1337960294 [1,1,0,0,0,0|1,0,0]=3 3708 B8R1.8 O=CCC1CCOC1 MCULE-3891672561 [1,1,0,0,0,0|2,0,0]=4 3709 B8R1.8 O=CCC1OCCO1 MCULE-1412194468 [1,1,0,0,0,0|1,0,0]=3 3710 B8R1.8 O=CCN1CCCC1 MCULE-4391534239 [1,1,0,0,0,0|2,0,0]=4 3711 B8R1.8 O=CNC1CCCC1 MCULE-1453368274 [1,1,0,0,0,0|1,0,0]=3 3712 B8R1.8 OCCC1CCCC1 MCULE-3680571056 [1,1,0,0,0,0|1,0,1]=4 3713 B8R1.8 OCCC1CCCN1 MCULE-3516684599 [1,1,0,0,0,0|1,0,1]=4 3714 B8R1.8 OCCC1CCCN1 MCULE-7335032539 [1,1,0,0,0,0|1,0,1]=4 3715 B8R1.8 OCCC1CCCO1 MCULE-4437776676 [1,1,0,0,0,0|0,0,1]=3 3716 B8R1.8 OCCC1OCCO1 MCULE-8684226648 [1,1,0,0,0,0|1,0,1]=4 3717 B8R1.8 OCC[C@@H]1CCCN1 MCULE-5399846336 [1,1,0,0,0,0|1,0,1]=4 3718 B8R1.8 OCC[C@H]1CCCN1 MCULE-9442938016 [1,1,0,0,0,0|1,0,1]=4 3719 B8R1.11 C1(CCCN1C)CO MCULE-1790699840 [1,1,0,0,0,0|1,0,1]=4 3720 B8R1.11 CC1CCCC1CO MCULE-9356546543 [1,1,0,0,0,0|1,0,1]=4 3721 B8R1.11 CC1CCNC1CO MCULE-3727613396 [1,1,0,0,0,0|1,0,1]=4 3722 B8R1.11 CC1OCCC1C=O MCULE-5505705817 [1,1,0,0,0,0|2,0,0]=4 3723 B8R1.11 CC[C@@H]1OCC[C@H]1N MCULE-6631183888 [1,1,0,0,0,0|1,0,1]=4 3724 B8R1.11 CN1CCCC1CO MCULE-9904095173 [1,1,0,0,0,0|1,0,1]=4 3725 B8R1.11 CN1CCC[C@@H]1CO MCULE-1873370971 [1,1,0,0,0,0|1,0,1]=4 3726 B8R1.11 CN1CCC[C@@H]1CO MCULE-5652991406 [1,1,0,0,0,0|1,0,1]=4 3727 B8R1.11 CN1CCC[C@H]1C=O MCULE-5852490757 [1,1,0,0,0,0|1,0,0]=3 3728 B8R1.11 CN1CCC[C@H]1CO MCULE-4291089054 [1,1,0,0,0,0|1,0,1]=4 3729 B8R1.11 CN1CCC[C@H]1CO MCULE-8245872227 [1,1,0,0,0,0|1,0,1]=4 3730 B8R1.11 C[C@@H]1CCN[C@@H]1CO MCULE-7458696223 [1,1,0,0,0,0|1,0,1]=4 3731 B8R1.11 C[C@@H]1CCN[C@H]1CO MCULE-7407237429 [1,1,0,0,0,0|1,0,1]=4 3732 B8R1.11 C[C@H]1CCN[C@@H]1CO MCULE-9913318158 [1,1,0,0,0,0|1,0,1]=4 3733 B8R1.11 C[C@H]1CCN[C@H]1CO MCULE-4322110368 [1,1,0,0,0,0|1,0,1]=4 3734 B8R1.11 NC1CCCC1CO MCULE-9652022908 [1,1,0,0,0,0|1,0,1]=4 3735 B8R1.11 NN1CCCC1CO MCULE-1842894120 [1,1,0,0,0,0|1,0,1]=4 3736 B8R1.11 NN1CCC[C@H]1CO MCULE-2058705707 [1,1,0,0,0,0|1,0,1]=4 3737 B8R1.11 N[C@@H]1CCC[C@H]1CO MCULE-7218353328 [1,1,0,0,0,0|1,0,1]=4 3738 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-3793323277 [1,1,0,0,0,0|1,0,1]=4 3739 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-5297422093 [1,1,0,0,0,0|1,0,1]=4 3740 B8R1.11 O=C1CCCC1CO MCULE-9171970685 [1,1,0,0,0,0|1,0,1]=4 3741 B8R1.11 O=CC1=C(CCC1)Cl MCULE-2468041387 [1,1,0,0,0,0|1,0,1]=4 3742 B8R1.11 O=CC1CCOC1=O MCULE-6358043470 [1,1,0,0,0,0|2,0,0]=4 3743 B8R1.11 O=CN1CCCC1=O MCULE-1097328464 [1,1,0,0,0,0|2,0,0]=4 3744 B8R1.11 OCC1CCCC1O MCULE-7244611817 [1,1,0,0,0,0|1,0,1]=4 3745 B8R1.11 OCC1NCCC1O MCULE-6288507636 [1,1,0,0,0,0|1,0,1]=4 3746 B8R1.11 OCC1NCCC1O MCULE-6806405470 [1,1,0,0,0,0|1,0,1]=4 3747 B8R1.11 OCC1OCCC1O MCULE-2601628372 [1,1,0,0,0,0|0,0,1]=3 3748 B8R1.11 OC[C@@H]1NCC[C@@H]1O MCULE-8384230507 [1,1,0,0,0,0|1,0,1]=4 3749 B8R1.11 OC[C@@H]1NCC[C@H]1O MCULE-3549294738 [1,1,0,0,0,0|1,0,1]=4 3750 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-3020492285 [1,1,0,0,0,0|1,0,1]=4 3751 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-4180813715 [1,1,0,0,0,0|1,0,1]=4 3752 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-8831128340 [1,1,0,0,0,0|1,0,1]=4 3753 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-9415023769 [1,1,0,0,0,0|1,0,1]=4 3754 B8R1.11 OC[C@H]1NCC[C@H]1O MCULE-9396804561 [1,1,0,0,0,0|1,0,1]=4 3755 B8R1.11 OC[C@H]1OCC[C@@H]1O MCULE-4089527318 [1,1,0,0,0,0|0,0,1]=3 3756 B8R1.11 OC[C@H]1OCC[C@@H]1O MCULE-9198335558 [1,1,0,0,0,0|0,0,1]=3 3757 B8R1.11 [C@H]1(CCC[C@H]1CO)N MCULE-8523302139 [1,1,0,0,0,0|1,0,1]=4 3758 B8R1.52 C#CC1(CCCO1)C MCULE-7216729961 [1,1,0,0,0,0|1,0,1]=4 3759 B8R1.52 CC1(CCCC1)C=O MCULE-2794420297 [1,1,0,0,0,0|1,0,0]=3 3760 B8R1.52 CC1(CCCC1)CO MCULE-5781311918 [1,1,0,0,0,0|1,0,1]=4 3761 B8R1.52 CC1(CCCN1)CO MCULE-6540579872 [1,1,0,0,0,0|1,0,1]=4 3762 B8R1.52 CC1(CCCN1)CO MCULE-8257131278 [1,1,0,0,0,0|1,0,1]=4 3763 B8R1.52 CC1(CCCN1)CO MCULE-8482084576 [1,1,0,0,0,0|1,0,1]=4 3764 B8R1.52 CC1(CCCN1)CO MCULE-8834174428 [1,1,0,0,0,0|1,0,1]=4 3765 B8R1.52 CC1(CCCO1)C#N MCULE-1273023182 [1,1,0,0,0,0|1,0,1]=4 3766 B8R1.52 CC1(CCCO1)C=O MCULE-4619641299 [1,1,0,0,0,0|0,0,0]=2 3767 B8R1.52 CC1(CCCO1)CN MCULE-2071513677 [1,1,0,0,0,0|1,0,1]=4 3768 B8R1.52 CC1(CCCO1)CN MCULE-4256725320 [1,1,0,0,0,0|1,0,1]=4 3769 B8R1.52 CC1(CCCO1)CO MCULE-9259109857 [1,1,0,0,0,0|0,0,1]=3 3770 B8R1.52 CC1(CCCS1)C=O MCULE-9560124012 [1,1,0,0,0,0|0,1,0]=3 3771 B8R1.52 CC1(OCCO1)CO MCULE-7424031624 [1,1,0,0,0,0|1,0,1]=4 3772 B8R1.52 C[C@@]1(CCCN1)CO MCULE-1770277535 [1,1,0,0,0,0|1,0,1]=4 3773 B8R1.52 C[C@@]1(CCCN1)CO MCULE-2540626362 [1,1,0,0,0,0|1,0,1]=4 3774 B8R1.52 C[C@@]1(CCCN1)CO MCULE-4264108295 [1,1,0,0,0,0|1,0,1]=4 3775 B8R1.52 C[C@@]1(CCCN1)CO MCULE-8418846570 [1,1,0,0,0,0|1,0,1]=4 3776 B8R1.52 C[C@@]1(CCCO1)CN MCULE-1372081592 [1,1,0,0,0,0|1,0,1]=4 3777 B8R1.52 C[C@@]1(CCCO1)CN MCULE-6512781753 [1,1,0,0,0,0|1,0,1]=4 3778 B8R1.52 C[C@]1(CCCN1)CO MCULE-2761771924 [1,1,0,0,0,0|1,0,1]=4 3779 B8R1.52 C[C@]1(CCCN1)CO MCULE-4095594473 [1,1,0,0,0,0|1,0,1]=4 3780 B8R1.52 C[C@]1(CCCN1)CO MCULE-7014210855 [1,1,0,0,0,0|1,0,1]=4 3781 B8R1.52 C[C@]1(CCCN1)CO MCULE-9276164161 [1,1,0,0,0,0|1,0,1]=4 3782 B8R1.52 NC1(CCCC1)CO MCULE-6075612462 [1,1,0,0,0,0|1,0,1]=4 3783 B8R1.52 NC1(CCCC1)CO MCULE-6080383421 [1,1,0,0,0,0|1,0,1]=4 3784 B8R1.52 NC1(CCCC1)CO MCULE-9669923041 [1,1,0,0,0,0|1,0,1]=4 3785 B8R1.52 O=CC1(CCCC1)F MCULE-6748021302 [1,1,0,0,0,0|1,0,0]=3 3786 B8R1.52 OCC1(CCCC1)F MCULE-3500711576 [1,1,0,0,0,0|1,0,1]=4 3787 B8R1.52 OCC1(CCCC1)O MCULE-2433996412 [1,1,0,0,0,0|1,0,1]=4 3788 B8R1.23 C1(CC(=O)N1)C(=O)O MCULE-3416083471 [0,1,0,0,1,0|1,0,1]=4 3789 B8R1.23 C=C1CC(C1)C(=O)C MCULE-4738657819 [0,1,0,0,1,0|1,0,1]=4 3790 B8R1.23 C=C1CC(C1)C(=O)Cl MCULE-2176633503 [0,1,0,0,1,0|1,0,1]=4 3791 B8R1.23 C=C1CC(C1)C(=O)N MCULE-9592937262 [0,1,0,0,1,0|1,0,1]=4 3792 B8R1.23 C=C1CC(C1)C(=O)O MCULE-6435857280 [0,1,0,0,1,0|0,0,1]=3 3793 B8R1.23 CC(=O)C1CC(C1)O MCULE-1249992642 [0,1,0,0,1,0|1,0,0]=3 3794 B8R1.23 CC(=O)N1CC(C1)N MCULE-2365148708 [0,1,0,0,1,0|2,0,0]=4 3795 B8R1.23 CC(=O)N1CC(C1)N MCULE-7213807824 [0,1,0,0,1,0|2,0,0]=4 3796 B8R1.23 CC(=O)N1CC(C1)N MCULE-9513131334 [0,1,0,0,1,0|2,0,0]=4 3797 B8R1.23 CC(=O)N1CC(C1)O MCULE-5379013327 [0,1,0,0,1,0|2,0,0]=4 3798 B8R1.23 CC1CC(C1)C(=O)O MCULE-2185016477 [0,1,0,0,1,0|0,0,0]=2 3799 B8R1.23 CC1CC(N1)C(=O)O MCULE-2803934033 [0,1,0,0,1,0|1,0,0]=3 3800 B8R1.23 CN1CC(C1)C(=O)Cl MCULE-4240668885 [0,1,0,0,1,0|2,0,0]=4 3801 B8R1.23 CN1CC(C1)C(=O)Cl MCULE-8969093472 [0,1,0,0,1,0|2,0,0]=4 3802 B8R1.23 CN1CC(C1)C(=O)O MCULE-8825389553 [0,1,0,0,1,0|1,0,0]=3 3803 B8R1.23 C[C@@H]1C[C@H](N1)C(=O)O MCULE-6318758002 [0,1,0,0,1,0|1,0,0]=3 3804 B8R1.23 C[C@H]1C[C@@H](C1)C(=O)O MCULE-1777784731 [0,1,0,0,1,0|0,0,0]=2 3805 B8R1.23 C[C@H]1C[C@H](C1)C(=O)O MCULE-8951813405 [0,1,0,0,1,0|0,0,0]=2 3806 B8R1.23 C[C@H]1C[C@H](N1)C(=O)O MCULE-2969381793 [0,1,0,0,1,0|1,0,0]=3 3807 B8R1.23 NC(=O)C1CC(C1)N MCULE-5148844906 [0,1,0,0,1,0|1,0,0]=3 3808 B8R1.23 NC(=O)C1CC(C1)N MCULE-6769121107 [0,1,0,0,1,0|1,0,0]=3 3809 B8R1.23 NC(=O)C1CC(C1)O MCULE-5735068093 [0,1,0,0,1,0|1,0,0]=3 3810 B8R1.23 NC(=O)N1CC(C1)F MCULE-7038677987 [0,1,0,0,1,0|2,0,0]=4 3811 B8R1.23 NC(=O)N1CC(C1)O MCULE-8624777593 [0,1,0,0,1,0|2,0,0]=4 3812 B8R1.23 NC1CC(C1)C(=O)O MCULE-8750839632 [0,1,0,0,1,0|0,0,0]=2 3813 B8R1.23 NC1CC(C1)C(=O)O MCULE-9051964103 [0,1,0,0,1,0|0,0,0]=2 3814 B8R1.23 N[C@H]1C[C@@H](C1)C(=O)O MCULE-1844060803 [0,1,0,0,1,0|0,0,0]=2 3815 B8R1.23 N[C@H]1C[C@@H](C1)C(=O)O MCULE-2707924504 [0,1,0,0,1,0|0,0,0]=2 3816 B8R1.23 N[C@H]1C[C@H](C1)C(=O)O MCULE-3847725342 [0,1,0,0,1,0|0,0,0]=2 3817 B8R1.23 N[C@H]1C[C@H](C1)C(=O)O MCULE-4578532365 [0,1,0,0,1,0|0,0,0]=2 3818 B8R1.23 O=C(O)C1CC(C1)Br MCULE-8162503332 [0,1,0,0,1,0|0,0,0]=2 3819 B8R1.23 O=C(O)C1CC(C1)Cl MCULE-7489933597 [0,1,0,0,1,0|0,0,0]=2 3820 B8R1.23 O=C(O)C1CC(C1)F MCULE-7905028761 [0,1,0,0,1,0|0,0,0]=2 3821 B8R1.23 O=C(O)C1CC(C1)O MCULE-4341192467 [0,1,0,0,1,0|0,0,0]=2 3822 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)Br MCULE-1173253398 [0,1,0,0,1,0|0,0,0]=2 3823 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)F MCULE-4909435716 [0,1,0,0,1,0|0,0,0]=2 3824 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)O MCULE-9908072079 [0,1,0,0,1,0|0,0,0]=2 3825 B8R1.23 O=C(O)[C@H]1C[C@H](C1)Br MCULE-9142067708 [0,1,0,0,1,0|0,0,0]=2 3826 B8R1.23 O=C(O)[C@H]1C[C@H](C1)F MCULE-7816380416 [0,1,0,0,1,0|0,0,0]=2 3827 B8R1.23 O=C(O)[C@H]1C[C@H](C1)O MCULE-5181925767 [0,1,0,0,1,0|0,0,0]=2 3828 B8R1.23 O=C1CC(C1)C(=O)Cl MCULE-5261758509 [0,1,0,0,1,0|1,0,1]=4 3829 B8R1.23 O=C1CC(C1)C(=O)O MCULE-8672788982 [0,1,0,0,1,0|0,0,1]=3 3830 B8R1.23 O=C1CC(N1)C(=O)O MCULE-3167823583 [0,1,0,0,1,0|1,0,1]=4 3831 B8R1.23 O=C1CC(O1)C(=O)O MCULE-1791104685 [0,1,0,0,1,0|0,0,1]=3 3832 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-2118093307 [0,1,0,0,1,0|1,0,1]=4 3833 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-7784171286 [0,1,0,0,1,0|1,0,1]=4 3834 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-1255798587 [0,1,0,0,1,0|1,0,1]=4 3835 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-6947698869 [0,1,0,0,1,0|1,0,1]=4 3836 B8R1.23 [C@@H]1(C[C@@H](C1)C(=O)O)Cl MCULE-4605935494 [0,1,0,0,1,0|0,0,0]=2 3837 B8R1.31 C1(CCN1C)C(=O)O MCULE-3478640390 [0,1,0,0,1,0|1,0,0]=3 3838 B8R1.31 C=C1CCC1C(=O)O MCULE-7307560863 [0,1,0,0,1,0|0,0,1]=3 3839 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C MCULE-1543129128 [0,1,0,0,1,0|1,0,0]=3 3840 B8R1.31 CC(O)C1CCC1F MCULE-2872972823 [0,1,0,0,1,0|1,0,1]=4 3841 B8R1.31 CC1CCC1C(=O)O MCULE-2755332087 [0,1,0,0,1,0|0,0,0]=2 3842 B8R1.31 CC1CNC1C(=O)O MCULE-4084486339 [0,1,0,0,1,0|1,0,0]=3 3843 B8R1.31 CC1NCC1C(=O)O MCULE-3701314568 [0,1,0,0,1,0|1,0,0]=3 3844 B8R1.31 CN1CCC1C(=O)O MCULE-5037838055 [0,1,0,0,1,0|1,0,0]=3 3845 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-3293015609 [0,1,0,0,1,0|1,0,0]=3 3846 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-6726499104 [0,1,0,0,1,0|1,0,0]=3 3847 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-1519401164 [0,1,0,0,1,0|1,0,0]=3 3848 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-2682368839 [0,1,0,0,1,0|1,0,0]=3 3849 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-6870930523 [0,1,0,0,1,0|1,0,0]=3 3850 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-9495962068 [0,1,0,0,1,0|1,0,0]=3 3851 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-4996743185 [0,1,0,0,1,0|1,0,0]=3 3852 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-5548697786 [0,1,0,0,1,0|1,0,0]=3 3853 B8R1.31 NC1CCC1C(=O)O MCULE-1271890671 [0,1,0,0,1,0|0,0,0]=2 3854 B8R1.31 NC1CCC1C(=O)O MCULE-6203451123 [0,1,0,0,1,0|0,0,0]=2 3855 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O MCULE-7309195085 [0,1,0,0,1,0|0,0,0]=2 3856 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-1231832702 [0,1,0,0,1,0|0,0,0]=2 3857 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-4120413857 [0,1,0,0,1,0|0,0,0]=2 3858 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-7581321099 [0,1,0,0,1,0|0,0,0]=2 3859 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-8814127531 [0,1,0,0,1,0|0,0,0]=2 3860 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O MCULE-1877122488 [0,1,0,0,1,0|0,0,0]=2 3861 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-2323153571 [0,1,0,0,1,0|0,0,0]=2 3862 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3627026930 [0,1,0,0,1,0|0,0,0]=2 3863 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3814908416 [0,1,0,0,1,0|0,0,0]=2 3864 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-8552378194 [0,1,0,0,1,0|0,0,0]=2 3865 B8R1.31 O=C(O)C1CCC1F MCULE-6928594613 [0,1,0,0,1,0|0,0,0]=2 3866 B8R1.31 O=C(O)C1CCC1O MCULE-5612797663 [0,1,0,0,1,0|0,0,0]=2 3867 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O MCULE-4502275905 [0,1,0,0,1,0|0,0,0]=2 3868 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O MCULE-1446557503 [0,1,0,0,1,0|0,0,0]=2 3869 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-3693378535 [0,1,0,0,1,0|0,0,0]=2 3870 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-4998471402 [0,1,0,0,1,0|0,0,0]=2 3871 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-1179436878 [0,1,0,0,1,0|0,0,0]=2 3872 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-6666180327 [0,1,0,0,1,0|0,0,0]=2 3873 B8R1.31 [C@@H]1(NC[C@H]1C)C(=O)O MCULE-4107819391 [0,1,0,0,1,0|1,0,0]=3 3874 B8R1.38 C#CC(=O)C1CCC1 MCULE-7044839324 [0,1,0,0,1,0|1,0,0]=3 3875 B8R1.38 C1(CCN1)C(=O)OC MCULE-4001628620 [0,1,0,0,1,0|1,0,0]=3 3876 B8R1.38 C1(CCN1)C(=O)OC MCULE-6304194058 [0,1,0,0,1,0|1,0,0]=3 3877 B8R1.38 C=CC(=O)N1CCC1 MCULE-5467836720 [0,1,0,0,1,0|2,0,0]=4 3878 B8R1.38 CC(C=O)C1CCC1 MCULE-5860376202 [0,1,0,0,1,0|1,0,1]=4 3879 B8R1.38 CC(CO)C1CCC1 MCULE-1784327025 [0,1,0,0,1,0|1,0,1]=4 3880 B8R1.38 CC(CO)C1CCO1 MCULE-2444675648 [0,1,0,0,1,0|1,0,1]=4 3881 B8R1.38 CCC(=O)C1CCC1 MCULE-2054282062 [0,1,0,0,1,0|1,0,0]=3 3882 B8R1.38 CCC(=O)C1COC1 MCULE-2036532813 [0,1,0,0,1,0|2,0,0]=4 3883 B8R1.38 CCC(O)C1CCC1 MCULE-5180007399 [0,1,0,0,1,0|1,0,1]=4 3884 B8R1.38 CNC(=O)C1CCC1 MCULE-7934051142 [0,1,0,0,1,0|1,0,0]=3 3885 B8R1.38 CNC(=O)C1CNC1 MCULE-1757312789 [0,1,0,0,1,0|2,0,0]=4 3886 B8R1.38 CNC(=O)C1CNC1 MCULE-5774189315 [0,1,0,0,1,0|2,0,0]=4 3887 B8R1.38 CNC(=O)C1CNC1 MCULE-8342593933 [0,1,0,0,1,0|2,0,0]=4 3888 B8R1.38 COC(=O)C1=CCC1 MCULE-5016158090 [0,1,0,0,1,0|0,0,2]=4 3889 B8R1.38 COC(=O)C1CCC1 MCULE-2900002276 [0,1,0,0,1,0|0,0,0]=2 3890 B8R1.38 COC(=O)C1CCN1 MCULE-2766647683 [0,1,0,0,1,0|1,0,0]=3 3891 B8R1.38 COC(=O)C1CCN1 MCULE-6440918459 [0,1,0,0,1,0|1,0,0]=3 3892 B8R1.38 COC(=O)C1CCN1 MCULE-6964468849 [0,1,0,0,1,0|1,0,0]=3 3893 B8R1.38 COC(=O)C1CCO1 MCULE-7860079290 [0,1,0,0,1,0|0,0,0]=2 3894 B8R1.38 COC(=O)C1CNC1 MCULE-5731952071 [0,1,0,0,1,0|1,0,0]=3 3895 B8R1.38 COC(=O)C1CNC1 MCULE-9436948908 [0,1,0,0,1,0|1,0,0]=3 3896 B8R1.38 COC(=O)C1COC1 MCULE-8897565340 [0,1,0,0,1,0|1,0,0]=3 3897 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-4539844768 [0,1,0,0,1,0|1,0,0]=3 3898 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-5257592845 [0,1,0,0,1,0|1,0,0]=3 3899 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-7483834256 [0,1,0,0,1,0|1,0,0]=3 3900 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-7502882004 [0,1,0,0,1,0|1,0,0]=3 3901 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-1944761309 [0,1,0,0,1,0|1,0,0]=3 3902 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-2075005250 [0,1,0,0,1,0|1,0,0]=3 3903 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-5626630564 [0,1,0,0,1,0|1,0,0]=3 3904 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-8309542560 [0,1,0,0,1,0|1,0,0]=3 3905 B8R1.38 N=C(NO)C1CCC1 MCULE-4445464088 [0,1,0,0,1,0|1,0,0]=3 3906 B8R1.38 NC(CO)C1CCC1 MCULE-1060557753 [0,1,0,0,1,0|1,0,1]=4 3907 B8R1.38 NC(CO)C1CCC1 MCULE-4732995704 [0,1,0,0,1,0|1,0,1]=4 3908 B8R1.38 NCC(=O)C1CCC1 MCULE-2102604629 [0,1,0,0,1,0|1,0,0]=3 3909 B8R1.38 NCC(=O)C1CCC1 MCULE-5571071703 [0,1,0,0,1,0|1,0,0]=3 3910 B8R1.38 NCC(=O)N1CCC1 MCULE-3850014745 [0,1,0,0,1,0|2,0,0]=4 3911 B8R1.38 NCC(O)C1CCC1 MCULE-3437732656 [0,1,0,0,1,0|1,0,1]=4 3912 B8R1.38 NCC(O)C1CCC1 MCULE-3764801914 [0,1,0,0,1,0|1,0,1]=4 3913 B8R1.38 NNC(=O)C1CCC1 MCULE-3104625459 [0,1,0,0,1,0|1,0,0]=3 3914 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-1191204694 [0,1,0,0,1,0|1,0,1]=4 3915 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-4280800914 [0,1,0,0,1,0|1,0,1]=4 3916 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-4912879577 [0,1,0,0,1,0|1,0,1]=4 3917 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-8248389845 [0,1,0,0,1,0|1,0,1]=4 3918 B8R1.38 N[C@H](CO)C1CCC1 MCULE-2165772919 [0,1,0,0,1,0|1,0,1]=4 3919 B8R1.38 N[C@H](CO)C1CCC1 MCULE-5153627963 [0,1,0,0,1,0|1,0,1]=4 3920 B8R1.38 N[C@H](CO)C1CCC1 MCULE-5389043091 [0,1,0,0,1,0|1,0,1]=4 3921 B8R1.38 N[C@H](CO)C1CCC1 MCULE-7675577168 [0,1,0,0,1,0|1,0,1]=4 3922 B8R1.38 O=C(CBr)C1CCC1 MCULE-7056136632 [0,1,0,0,1,0|1,0,0]=3 3923 B8R1.38 O=C(CBr)N1CCC1 MCULE-2341003437 [0,1,0,0,1,0|2,0,0]=4 3924 B8R1.38 O=C(CCl)C1CCC1 MCULE-9286559827 [0,1,0,0,1,0|1,0,0]=3 3925 B8R1.38 O=C(CCl)N1CCC1 MCULE-1485330958 [0,1,0,0,1,0|2,0,0]=4 3926 B8R1.38 O=C(NO)C1CCC1 MCULE-5722727330 [0,1,0,0,1,0|0,0,0]=2 3927 B8R1.38 OCC(O)C1CCC1 MCULE-5695655912 [0,1,0,0,1,0|0,0,2]=4 3928 B8R1.55 CC(C)(O)C1CCC1 MCULE-5652058826 [0,1,0,0,1,0|1,0,1]=4 3929 B8R1.55 NS(=O)(=O)C1CCC1 MCULE-9450864636 [0,1,0,0,1,0|1,0,1]=4 3930 B8R1.55 O=S(=O)(Cl)C1CCC1 MCULE-8518894397 [0,1,0,0,1,0|1,0,1]=4 3931 B8R1.78 CC(=O)C1(CCC1)C MCULE-7668067765 [0,1,0,0,1,0|1,0,0]=3 3932 B8R1.78 CC(=O)C1(CCC1)O MCULE-9112690180 [0,1,0,0,1,0|1,0,0]=3 3933 B8R1.78 CC(=O)C1(CNC1)F MCULE-3665722852 [0,1,0,0,1,0|2,0,0]=4 3934 B8R1.78 CC(=O)C1(CNC1)F MCULE-6096163194 [0,1,0,0,1,0|2,0,0]=4 3935 B8R1.78 CC(=O)C1(COC1)C MCULE-3650835000 [0,1,0,0,1,0|2,0,0]=4 3936 B8R1.78 CC1(CCC1)C(=O)Cl MCULE-4438397604 [0,1,0,0,1,0|1,0,0]=3 3937 B8R1.78 CC1(CCC1)C(=O)O MCULE-8539228760 [0,1,0,0,1,0|0,0,0]=2 3938 B8R1.78 CC1(CCO1)C(=O)O MCULE-3206195959 [0,1,0,0,1,0|0,0,0]=2 3939 B8R1.78 CC1(CNC1)C(=O)N MCULE-5961415095 [0,1,0,0,1,0|2,0,0]=4 3940 B8R1.78 CC1(CNC1)C(=O)N MCULE-6950504484 [0,1,0,0,1,0|2,0,0]=4 3941 B8R1.78 CC1(CNC1)C(=O)O MCULE-3626067455 [0,1,0,0,1,0|1,0,0]=3 3942 B8R1.78 CC1(CNC1)C(=O)O MCULE-7316902394 [0,1,0,0,1,0|1,0,0]=3 3943 B8R1.78 CC1(COC1)C(=O)O MCULE-6360656030 [0,1,0,0,1,0|1,0,0]=3 3944 B8R1.78 C[C@@]1(CCO1)C(=O)O MCULE-1153504060 [0,1,0,0,1,0|0,0,0]=2 3945 B8R1.78 NC(=O)C1(CCC1)Br MCULE-3386940591 [0,1,0,0,1,0|1,0,0]=3 3946 B8R1.78 NC(=O)C1(CCC1)N MCULE-1043802844 [0,1,0,0,1,0|1,0,0]=3 3947 B8R1.78 NC(=O)C1(CCC1)N MCULE-8757108427 [0,1,0,0,1,0|1,0,0]=3 3948 B8R1.78 NC(=O)C1(CCC1)O MCULE-9017924933 [0,1,0,0,1,0|1,0,0]=3 3949 B8R1.78 NC(=O)C1(CNC1)O MCULE-4705401931 [0,1,0,0,1,0|2,0,0]=4 3950 B8R1.78 NC(=O)C1(CNC1)O MCULE-6961987506 [0,1,0,0,1,0|2,0,0]=4 3951 B8R1.78 NC(=O)C1(COC1)N MCULE-1019126091 [0,1,0,0,1,0|2,0,0]=4 3952 B8R1.78 NC1(CCC1)C(=O)Cl MCULE-4330568570 [0,1,0,0,1,0|1,0,0]=3 3953 B8R1.78 NC1(CCC1)C(=O)Cl MCULE-9506658674 [0,1,0,0,1,0|1,0,0]=3 3954 B8R1.78 NC1(CCC1)C(=O)O MCULE-7741753062 [0,1,0,0,1,0|0,0,0]=2 3955 B8R1.78 NC1(CCC1)C(=O)O MCULE-8986168461 [0,1,0,0,1,0|0,0,0]=2 3956 B8R1.78 NC1(CNC1)C(=O)O MCULE-1078717796 [0,1,0,0,1,0|1,0,0]=3 3957 B8R1.78 NC1(CNC1)C(=O)O MCULE-1597584418 [0,1,0,0,1,0|1,0,0]=3 3958 B8R1.78 NC1(COC1)C(=O)O MCULE-2048452241 [0,1,0,0,1,0|1,0,0]=3 3959 B8R1.78 NC1(CSC1)C(=O)O MCULE-3865165435 [0,1,0,0,1,0|1,0,0]=3 3960 B8R1.78 NC1(CSC1)C(=O)O MCULE-7335919130 [0,1,0,0,1,0|1,0,0]=3 3961 B8R1.78 O=C(O)C1(CCC1)Br MCULE-2468093858 [0,1,0,0,1,0|0,0,0]=2 3962 B8R1.78 O=C(O)C1(CCC1)F MCULE-5784376163 [0,1,0,0,1,0|0,0,0]=2 3963 B8R1.78 O=C(O)C1(CCC1)O MCULE-3418659917 [0,1,0,0,1,0|0,0,0]=2 3964 B8R1.78 O=C(O)C1(CNC1)F MCULE-7253312158 [0,1,0,0,1,0|1,0,0]=3 3965 B8R1.78 O=C(O)C1(CNC1)O MCULE-3436636334 [0,1,0,0,1,0|1,0,0]=3 3966 B8R1.78 O=C(O)C1(CNC1)O MCULE-4261639250 [0,1,0,0,1,0|1,0,0]=3 3967 B8R1.78 O=C(O)C1(COC1)O MCULE-7009915692 [0,1,0,0,1,0|1,0,0]=3 3968 B8R1.78 O=N(=O)C1(CCC1)Br MCULE-5339530869 [0,1,0,0,1,0|1,0,1]=4 3969 B10R1.13 C=C1CCC(CC1)C(=O)O MCULE-9520777832 [0,1,0,0,0,1|1,0,0]=3 3970 B10R1.13 CC(=O)C1CCC(CC1)C MCULE-6102529388 [0,1,0,0,0,1|2,0,0]=4 3971 B10R1.13 CC(=O)C1CCC(CC1)N MCULE-1009720315 [0,1,0,0,0,1|2,0,0]=4 3972 B10R1.13 CC(=O)C1CCC(CC1)N MCULE-5617448654 [0,1,0,0,0,1|2,0,0]=4 3973 B10R1.13 CC(=O)C1CCC(CC1)O MCULE-8384212790 [0,1,0,0,0,1|2,0,0]=4 3974 B10R1.13 CC(=O)C1CCN(CC1)C MCULE-8004082884 [0,1,0,0,0,1|2,0,0]=4 3975 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)C MCULE-1016150505 [0,1,0,0,0,1|2,0,0]=4 3976 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)N MCULE-6674769937 [0,1,0,0,0,1|2,0,0]=4 3977 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)N MCULE-7289775544 [0,1,0,0,0,1|2,0,0]=4 3978 B10R1.13 CC1=CCC(CC1)C(=O)O MCULE-8997751425 [0,1,0,0,0,1|1,0,1]=4 3979 B10R1.13 CC1CC=C(CC1)C(=O)O MCULE-7341526311 [0,1,0,0,0,1|1,0,1]=4 3980 B10R1.13 CC1CCC(CC1)C(=O)Cl MCULE-4812590612 [0,1,0,0,0,1|2,0,0]=4 3981 B10R1.13 CC1CCC(CC1)C(=O)O MCULE-3225182334 [0,1,0,0,0,1|1,0,0]=3 3982 B10R1.13 CC1CCC(CN1)C(=O)N MCULE-7780455991 [0,1,0,0,0,1|2,0,0]=4 3983 B10R1.13 CC1CCC(CN1)C(=O)O MCULE-3840727873 [0,1,0,0,0,1|1,0,0]=3 3984 B10R1.13 CC1CCC(CN1)C(=O)O MCULE-5946890830 [0,1,0,0,0,1|1,0,0]=3 3985 B10R1.13 CC1CCC(CO1)C(=O)O MCULE-6526905782 [0,1,0,0,0,1|0,0,0]=2 3986 B10R1.13 CC1CCC(NC1)C(=O)O MCULE-2912599846 [0,1,0,0,0,1|1,0,0]=3 3987 B10R1.13 CC1CCC(NC1)C(=O)O MCULE-3297162881 [0,1,0,0,0,1|1,0,0]=3 3988 B10R1.13 CC1COC(CN1)C(=O)O MCULE-7809709557 [0,1,0,0,0,1|0,0,0]=2 3989 B10R1.13 CN1CCC(CC1)C(=O)Cl MCULE-5321418776 [0,1,0,0,0,1|2,0,0]=4 3990 B10R1.13 CN1CCC(CC1)C(=O)Cl MCULE-7254009533 [0,1,0,0,0,1|2,0,0]=4 3991 B10R1.13 CN1CCC(CC1)C(=O)N MCULE-2029707277 [0,1,0,0,0,1|2,0,0]=4 3992 B10R1.13 CN1CCC(CC1)C(=O)O MCULE-1330176845 [0,1,0,0,0,1|1,0,0]=3 3993 B10R1.13 CN1CCC(CC1)C(=O)O MCULE-2860414660 [0,1,0,0,0,1|1,0,0]=3 3994 B10R1.13 CN1CCN(CC1)C(=O)O MCULE-3645740759 [0,1,0,0,0,1|2,0,0]=4 3995 B10R1.13 CN1CCN(CC1)C(=O)O MCULE-3916839663 [0,1,0,0,0,1|2,0,0]=4 3996 B10R1.13 C[C@@H]1CC[C@@H](CN1)C(=O)O MCULE-8843664488 [0,1,0,0,0,1|1,0,0]=3 3997 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-2204464981 [0,1,0,0,0,1|1,0,0]=3 3998 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-2225073323 [0,1,0,0,0,1|1,0,0]=3 3999 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-3036379148 [0,1,0,0,0,1|1,0,0]=3 4000 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-9649426657 [0,1,0,0,0,1|1,0,0]=3 4001 B10R1.13 C[C@@H]1CN[C@H](CO1)C(=O)O MCULE-8093925660 [0,1,0,0,0,1|1,0,0]=3 4002 B10R1.13 C[C@@H]1CN[C@H](CO1)C(=O)O MCULE-9603514021 [0,1,0,0,0,1|1,0,0]=3 4003 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)Cl MCULE-2231388476 [0,1,0,0,0,1|2,0,0]=4 4004 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)N MCULE-9668889856 [0,1,0,0,0,1|2,0,0]=4 4005 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)O MCULE-3272652270 [0,1,0,0,0,1|1,0,0]=3 4006 B10R1.13 C[C@H]1CC[C@@H](CN1)C(=O)O MCULE-6340569413 [0,1,0,0,0,1|1,0,0]=3 4007 B10R1.13 C[C@H]1CC[C@H](CC1)C(=O)O MCULE-7434442752 [0,1,0,0,0,1|1,0,0]=3 4008 B10R1.13 C[C@H]1CC[C@H](CN1)C(=O)O MCULE-3955685184 [0,1,0,0,0,1|1,0,0]=3 4009 B10R1.13 C[C@H]1CN[C@@H](CO1)C(=O)O MCULE-4706739993 [0,1,0,0,0,1|1,0,0]=3 4010 B10R1.13 C[C@H]1CN[C@@H](CO1)C(=O)O MCULE-9210189761 [0,1,0,0,0,1|1,0,0]=3 4011 B10R1.13 NC(=O)C1CCC(=O)CC1 MCULE-8335948190 [0,1,0,0,0,1|2,0,0]=4 4012 B10R1.13 NC(=O)C1CCC(CC1)N MCULE-4469475065 [0,1,0,0,0,1|2,0,0]=4 4013 B10R1.13 NC(=O)C1CCC(CC1)N MCULE-4892039405 [0,1,0,0,0,1|2,0,0]=4 4014 B10R1.13 NC(=O)C1CCC(CC1)O MCULE-9699134683 [0,1,0,0,0,1|2,0,0]=4 4015 B10R1.13 NC(=O)C1CCC(CO1)N MCULE-1702911232 [0,1,0,0,0,1|1,0,0]=3 4016 B10R1.13 NC(=O)C1CCC(CO1)N MCULE-9609134356 [0,1,0,0,0,1|1,0,0]=3 4017 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-1123100792 [0,1,0,0,0,1|1,0,0]=3 4018 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-1890273222 [0,1,0,0,0,1|1,0,0]=3 4019 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-3122399272 [0,1,0,0,0,1|1,0,0]=3 4020 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-5583780093 [0,1,0,0,0,1|1,0,0]=3 4021 B10R1.13 NC(=O)[C@H]1CC[C@@H](CC1)O MCULE-6564995524 [0,1,0,0,0,1|2,0,0]=4 4022 B10R1.13 NC(=O)[C@H]1CC[C@H](CC1)N MCULE-1727204707 [0,1,0,0,0,1|2,0,0]=4 4023 B10R1.13 NC(=O)[C@H]1CC[C@H](CC1)N MCULE-4007102653 [0,1,0,0,0,1|2,0,0]=4 4024 B10R1.13 NC1CC=C(CC1)C(=O)O MCULE-8027933659 [0,1,0,0,0,1|1,0,1]=4 4025 B10R1.13 NC1CCC(CC1)C(=O)Cl MCULE-4909714198 [0,1,0,0,0,1|2,0,0]=4 4026 B10R1.13 NC1CCC(CC1)C(=O)O MCULE-6722954971 [0,1,0,0,0,1|1,0,0]=3 4027 B10R1.13 NC1CCC(CC1)C(=O)O MCULE-9273524734 [0,1,0,0,0,1|1,0,0]=3 4028 B10R1.13 N[C@H]1CC[C@@H](CC1)C(=O)O MCULE-5282665037 [0,1,0,0,0,1|1,0,0]=3 4029 B10R1.13 N[C@H]1CC[C@@H](CC1)C(=O)O MCULE-8647828626 [0,1,0,0,0,1|1,0,0]=3 4030 B10R1.13 N[C@H]1CC[C@H](CC1)C(=O)O MCULE-1388612667 [0,1,0,0,0,1|1,0,0]=3 4031 B10R1.13 N[C@H]1CC[C@H](CC1)C(=O)O MCULE-8724032546 [0,1,0,0,0,1|1,0,0]=3 4032 B10R1.13 O=C(Cl)C1CCC(CC1)O MCULE-9104583730 [0,1,0,0,0,1|2,0,0]=4 4033 B10R1.13 O=C(O)C1CC=C(CC1)Br MCULE-3957085478 [0,1,0,0,0,1|1,0,1]=4 4034 B10R1.13 O=C(O)C1CC=C(CC1)F MCULE-5924974191 [0,1,0,0,0,1|1,0,1]=4 4035 B10R1.13 O=C(O)C1CCC(CC1)Br MCULE-4952970959 [0,1,0,0,0,1|1,0,0]=3 4036 B10R1.13 O=C(O)C1CCC(CC1)Cl MCULE-9596975674 [0,1,0,0,0,1|1,0,0]=3 4037 B10R1.13 O=C(O)C1CCC(CC1)F MCULE-8237318279 [0,1,0,0,0,1|1,0,0]=3 4038 B10R1.13 O=C(O)C1CCC(CC1)O MCULE-2480420127 [0,1,0,0,0,1|1,0,0]=3 4039 B10R1.13 O=C(O)C1CCC(CN1)O MCULE-3204705068 [0,1,0,0,0,1|1,0,0]=3 4040 B10R1.13 O=C(O)C1CCC(CN1)O MCULE-7178398033 [0,1,0,0,0,1|1,0,0]=3 4041 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-1384355113 [0,1,0,0,0,1|1,0,0]=3 4042 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-1678351091 [0,1,0,0,0,1|1,0,0]=3 4043 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-5287470680 [0,1,0,0,0,1|1,0,0]=3 4044 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-7907264464 [0,1,0,0,0,1|1,0,0]=3 4045 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-2425882122 [0,1,0,0,0,1|1,0,0]=3 4046 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-3071319870 [0,1,0,0,0,1|1,0,0]=3 4047 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-3130571634 [0,1,0,0,0,1|1,0,0]=3 4048 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-4156067811 [0,1,0,0,0,1|1,0,0]=3 4049 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-6185299507 [0,1,0,0,0,1|1,0,0]=3 4050 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-8875046289 [0,1,0,0,0,1|1,0,0]=3 4051 B10R1.13 O=C(O)[C@H]1CC[C@@H](CC1)F MCULE-9036564869 [0,1,0,0,0,1|1,0,0]=3 4052 B10R1.13 O=C(O)[C@H]1CC[C@@H](CC1)O MCULE-6625595981 [0,1,0,0,0,1|1,0,0]=3 4053 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-2267551829 [0,1,0,0,0,1|1,0,0]=3 4054 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-7339394632 [0,1,0,0,0,1|1,0,0]=3 4055 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-7777420620 [0,1,0,0,0,1|1,0,0]=3 4056 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-9629486094 [0,1,0,0,0,1|1,0,0]=3 4057 B10R1.13 O=C(O)[C@H]1CC[C@H](CC1)F MCULE-1112147502 [0,1,0,0,0,1|1,0,0]=3 4058 B10R1.13 O=C(O)[C@H]1CC[C@H](CC1)O MCULE-5519058025 [0,1,0,0,0,1|1,0,0]=3 4059 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-3991583469 [0,1,0,0,0,1|1,0,0]=3 4060 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-8329848691 [0,1,0,0,0,1|1,0,0]=3 4061 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-8730600296 [0,1,0,0,0,1|1,0,0]=3 4062 B10R1.13 O=C1CCC(CC1)C(=O)Cl MCULE-9307268152 [0,1,0,0,0,1|2,0,0]=4 4063 B10R1.13 O=C1CCC(CC1)C(=O)O MCULE-3268045048 [0,1,0,0,0,1|1,0,0]=3 4064 B10R1.13 O=C1CCC(CN1)C(=O)O MCULE-9788917215 [0,1,0,0,0,1|1,0,1]=4 4065 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-4067834062 [0,1,0,0,0,1|1,0,0]=3 4066 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-8147757527 [0,1,0,0,0,1|1,0,0]=3 4067 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-3191286949 [0,1,0,0,0,1|1,0,1]=4 4068 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-9692186311 [0,1,0,0,0,1|1,0,1]=4 4069 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-4350301488 [0,1,0,0,0,1|1,0,0]=3 4070 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-6122427477 [0,1,0,0,0,1|1,0,0]=3 4071 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-7864506900 [0,1,0,0,0,1|1,0,0]=3 4072 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-8690683788 [0,1,0,0,0,1|1,0,0]=3 4073 B10R1.13 O=C1CC[C@H](CN1)C(=O)O MCULE-6590332785 [0,1,0,0,0,1|1,0,1]=4 4074 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-2845724258 [0,1,0,0,0,1|1,0,0]=3 4075 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-4534690891 [0,1,0,0,0,1|1,0,0]=3 4076 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-5755683417 [0,1,0,0,0,1|1,0,0]=3 4077 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-6015971784 [0,1,0,0,0,1|1,0,0]=3 4078 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-1011618274 [0,1,0,0,0,1|1,0,1]=4 4079 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-9345081526 [0,1,0,0,0,1|1,0,1]=4 4080 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-1270509503 [0,1,0,0,0,1|1,0,1]=4 4081 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-5912128916 [0,1,0,0,0,1|1,0,1]=4 4082 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-6974754540 [0,1,0,0,0,1|1,0,1]=4 4083 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-9137341829 [0,1,0,0,0,1|1,0,1]=4 4084 B10R1.13 O=C1CN[C@H](CN1)C(=O)O MCULE-8928326150 [0,1,0,0,0,1|1,0,1]=4 4085 B10R1.13 [C@@H]1(CC[C@H](NC1)C(=O)O)O MCULE-1423621462 [0,1,0,0,0,1|1,0,0]=3 4086 B10R1.13 [C@@H]1(CC[C@H](NC1)C(=O)O)O MCULE-1814136074 [0,1,0,0,0,1|1,0,0]=3 4087 B10R1.15 C1(CCCCN1)C(=O)OC MCULE-3306037072 [0,1,0,0,0,1|1,0,0]=3 4088 B10R1.15 C1(CCCCN1)C(=O)OC MCULE-9288344897 [0,1,0,0,0,1|1,0,0]=3 4089 B10R1.15 C1(CCCNC1)C(=O)OC MCULE-4117287216 [0,1,0,0,0,1|1,0,0]=3 4090 B10R1.15 C1(CCCNC1)C(=O)OC MCULE-8091301795 [0,1,0,0,0,1|1,0,0]=3 4091 B10R1.15 C1(CNCCN1)C(=O)OC MCULE-2958013355 [0,1,0,0,0,1|1,0,0]=3 4092 B10R1.15 C1(CNCCN1)C(=O)OC MCULE-6072954554 [0,1,0,0,0,1|1,0,0]=3 4093 B10R1.15 C1(COCCN1)C(=O)OC MCULE-1359060783 [0,1,0,0,0,1|1,0,0]=3 4094 B10R1.15 C1(COCCN1)C(=O)OC MCULE-5136187934 [0,1,0,0,0,1|1,0,0]=3 4095 B10R1.15 C=C(CO)C1CCNCC1 MCULE-2096772328 [0,1,0,0,0,1|2,0,0]=4 4096 B10R1.15 C=CC(=O)C1CCCCC1 MCULE-2668727628 [0,1,0,0,0,1|2,0,0]=4 4097 B10R1.15 CC(=NO)C1CCCCC1 MCULE-1684283685 [0,1,0,0,0,1|2,0,0]=4 4098 B10R1.15 CC(CO)C1CCCCO1 MCULE-4150266717 [0,1,0,0,0,1|1,0,1]=4 4099 B10R1.15 CCC(=O)C1CCCCC1 MCULE-8203276385 [0,1,0,0,0,1|2,0,0]=4 4100 B10R1.15 CCC(=O)C1CCCCN1 MCULE-6703727171 [0,1,0,0,0,1|2,0,0]=4 4101 B10R1.15 CCC(=O)C1CCCCN1 MCULE-7018103553 [0,1,0,0,0,1|2,0,0]=4 4102 B10R1.15 CCC(=O)C1CCCNC1 MCULE-3629175971 [0,1,0,0,0,1|2,0,0]=4 4103 B10R1.15 CCC(=O)C1CCCOC1 MCULE-5033322176 [0,1,0,0,0,1|1,0,0]=3 4104 B10R1.15 CCC(=O)C1CCNCC1 MCULE-3461762998 [0,1,0,0,0,1|2,0,0]=4 4105 B10R1.15 CCC(=O)C1CCNCC1 MCULE-9712207477 [0,1,0,0,0,1|2,0,0]=4 4106 B10R1.15 CCC(=O)C1CCOCC1 MCULE-4852927980 [0,1,0,0,0,1|2,0,0]=4 4107 B10R1.15 CNC(=O)C1CCCCC1 MCULE-4980742243 [0,1,0,0,0,1|2,0,0]=4 4108 B10R1.15 CNC(=O)C1CCCCN1 MCULE-2059398226 [0,1,0,0,0,1|2,0,0]=4 4109 B10R1.15 CNC(=O)C1CCCCN1 MCULE-6797335969 [0,1,0,0,0,1|2,0,0]=4 4110 B10R1.15 CNC(=O)C1CCCNC1 MCULE-2978981353 [0,1,0,0,0,1|2,0,0]=4 4111 B10R1.15 CNC(=O)C1CCCNC1 MCULE-6838149669 [0,1,0,0,0,1|2,0,0]=4 4112 B10R1.15 CNC(=O)C1CCCNC1 MCULE-7320118999 [0,1,0,0,0,1|2,0,0]=4 4113 B10R1.15 CNC(=O)C1CCNCC1 MCULE-4891387097 [0,1,0,0,0,1|2,0,0]=4 4114 B10R1.15 CNC(=O)C1CCNCC1 MCULE-7627125289 [0,1,0,0,0,1|2,0,0]=4 4115 B10R1.15 CNC(=O)C1CCOCC1 MCULE-3532223730 [0,1,0,0,0,1|2,0,0]=4 4116 B10R1.15 CNC(=O)C1CNCCO1 MCULE-3207028564 [0,1,0,0,0,1|1,0,0]=3 4117 B10R1.15 CNC(=O)C1CNCCO1 MCULE-6268130075 [0,1,0,0,0,1|1,0,0]=3 4118 B10R1.15 CNC(=O)C1COCCN1 MCULE-9896951123 [0,1,0,0,0,1|2,0,0]=4 4119 B10R1.15 CNC(=O)[C@@H]1CCCCN1 MCULE-3578222481 [0,1,0,0,0,1|2,0,0]=4 4120 B10R1.15 CNC(=O)[C@@H]1CCCCN1 MCULE-5767177119 [0,1,0,0,0,1|2,0,0]=4 4121 B10R1.15 CNC(=O)[C@@H]1CCCNC1 MCULE-4458584627 [0,1,0,0,0,1|2,0,0]=4 4122 B10R1.15 CNC(=O)[C@@H]1CCCNC1 MCULE-7833506495 [0,1,0,0,0,1|2,0,0]=4 4123 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-1484363402 [0,1,0,0,0,1|2,0,0]=4 4124 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-2898288746 [0,1,0,0,0,1|2,0,0]=4 4125 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-8199763754 [0,1,0,0,0,1|2,0,0]=4 4126 B10R1.15 CNC(=O)[C@H]1CCCNC1 MCULE-4306456945 [0,1,0,0,0,1|2,0,0]=4 4127 B10R1.15 CNC(=O)[C@H]1CCCNC1 MCULE-6354630655 [0,1,0,0,0,1|2,0,0]=4 4128 B10R1.15 CNC(=O)[C@H]1CCCNC1 MCULE-9283058450 [0,1,0,0,0,1|2,0,0]=4 4129 B10R1.15 COC(=O)C1=CCCCC1 MCULE-3153400458 [0,1,0,0,0,1|1,0,1]=4 4130 B10R1.15 COC(=O)C1=CCCCO1 MCULE-3379510205 [0,1,0,0,0,1|0,0,1]=3 4131 B10R1.15 COC(=O)C1=CCCNC1 MCULE-4220762988 [0,1,0,0,0,1|1,0,1]=4 4132 B10R1.15 COC(=O)C1=CCCNC1 MCULE-8178236584 [0,1,0,0,0,1|1,0,1]=4 4133 B10R1.15 COC(=O)C1=CCCNC1 MCULE-9139351406 [0,1,0,0,0,1|1,0,1]=4 4134 B10R1.15 COC(=O)C1=CCNCC1 MCULE-3308640134 [0,1,0,0,0,1|1,0,1]=4 4135 B10R1.15 COC(=O)C1=CCNCC1 MCULE-5623631465 [0,1,0,0,0,1|1,0,1]=4 4136 B10R1.15 COC(=O)C1=CCOCC1 MCULE-5794532366 [0,1,0,0,0,1|1,0,1]=4 4137 B10R1.15 COC(=O)C1=CNCCC1 MCULE-5565494663 [0,1,0,0,0,1|1,0,1]=4 4138 B10R1.15 COC(=O)C1=COCCC1 MCULE-2654885308 [0,1,0,0,0,1|0,0,1]=3 4139 B10R1.15 COC(=O)C1CC=CCC1 MCULE-8019345323 [0,1,0,0,0,1|1,0,1]=4 4140 B10R1.15 COC(=O)C1CC=CCN1 MCULE-5717808763 [0,1,0,0,0,1|1,0,1]=4 4141 B10R1.15 COC(=O)C1CCCCC1 MCULE-6850082589 [0,1,0,0,0,1|1,0,0]=3 4142 B10R1.15 COC(=O)C1CCCCN1 MCULE-1345527122 [0,1,0,0,0,1|1,0,0]=3 4143 B10R1.15 COC(=O)C1CCCCN1 MCULE-3343413800 [0,1,0,0,0,1|1,0,0]=3 4144 B10R1.15 COC(=O)C1CCCCO1 MCULE-4699637806 [0,1,0,0,0,1|0,0,0]=2 4145 B10R1.15 COC(=O)C1CCCCS1 MCULE-5621167539 [0,1,0,0,0,1|0,1,0]=3 4146 B10R1.15 COC(=O)C1CCCNC1 MCULE-5215588899 [0,1,0,0,0,1|1,0,0]=3 4147 B10R1.15 COC(=O)C1CCCNC1 MCULE-8977979820 [0,1,0,0,0,1|1,0,0]=3 4148 B10R1.15 COC(=O)C1CCCNN1 MCULE-3033001919 [0,1,0,0,0,1|1,0,0]=3 4149 B10R1.15 COC(=O)C1CCCNN1 MCULE-3440886963 [0,1,0,0,0,1|1,0,0]=3 4150 B10R1.15 COC(=O)C1CCCOC1 MCULE-8852064521 [0,1,0,0,0,1|0,0,0]=2 4151 B10R1.15 COC(=O)C1CCNCC1 MCULE-5613020223 [0,1,0,0,0,1|1,0,0]=3 4152 B10R1.15 COC(=O)C1CCNCC1 MCULE-9635570834 [0,1,0,0,0,1|1,0,0]=3 4153 B10R1.15 COC(=O)C1CCOCC1 MCULE-9277091866 [0,1,0,0,0,1|1,0,0]=3 4154 B10R1.15 COC(=O)C1CCSCC1 MCULE-2533530421 [0,1,0,0,0,1|1,0,0]=3 4155 B10R1.15 COC(=O)C1CNCCN1 MCULE-5461430924 [0,1,0,0,0,1|1,0,0]=3 4156 B10R1.15 COC(=O)C1CNCCN1 MCULE-5985522017 [0,1,0,0,0,1|1,0,0]=3 4157 B10R1.15 COC(=O)C1CNCCO1 MCULE-2698329193 [0,1,0,0,0,1|0,0,0]=2 4158 B10R1.15 COC(=O)C1CNCCO1 MCULE-4908930366 [0,1,0,0,0,1|0,0,0]=2 4159 B10R1.15 COC(=O)C1CNCCO1 MCULE-5645711588 [0,1,0,0,0,1|0,0,0]=2 4160 B10R1.15 COC(=O)C1CNCCO1 MCULE-6370167621 [0,1,0,0,0,1|0,0,0]=2 4161 B10R1.15 COC(=O)C1CNCCO1 MCULE-8941359764 [0,1,0,0,0,1|0,0,0]=2 4162 B10R1.15 COC(=O)C1COCCN1 MCULE-3550093500 [0,1,0,0,0,1|1,0,0]=3 4163 B10R1.15 COC(=O)C1COCCN1 MCULE-6551273056 [0,1,0,0,0,1|1,0,0]=3 4164 B10R1.15 COC(=O)C1COCCN1 MCULE-6840431140 [0,1,0,0,0,1|1,0,0]=3 4165 B10R1.15 COC(=O)C1CSCCN1 MCULE-3631055578 [0,1,0,0,0,1|1,0,0]=3 4166 B10R1.15 COC(=O)C1CSCCN1 MCULE-7757706847 [0,1,0,0,0,1|1,0,0]=3 4167 B10R1.15 COC(=O)C1SCCCS1 MCULE-8385963909 [0,1,0,0,0,1|0,1,0]=3 4168 B10R1.15 COC(=O)N1CCCCC1 MCULE-4843476028 [0,1,0,0,0,1|2,0,0]=4 4169 B10R1.15 COC(=O)N1CCCCC1 MCULE-8096578349 [0,1,0,0,0,1|2,0,0]=4 4170 B10R1.15 COC(=O)N1CCNCC1 MCULE-1605451144 [0,1,0,0,0,1|2,0,0]=4 4171 B10R1.15 COC(=O)N1CCNCC1 MCULE-1876224214 [0,1,0,0,0,1|2,0,0]=4 4172 B10R1.15 COC(=O)N1CCOCC1 MCULE-1622827053 [0,1,0,0,0,1|2,0,0]=4 4173 B10R1.15 COC(=O)[C@@H]1CC=CCC1 MCULE-5205723165 [0,1,0,0,0,1|1,0,1]=4 4174 B10R1.15 COC(=O)[C@@H]1CC=CCC1 MCULE-8305397953 [0,1,0,0,0,1|1,0,1]=4 4175 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-4659733955 [0,1,0,0,0,1|1,0,0]=3 4176 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-6675153946 [0,1,0,0,0,1|1,0,0]=3 4177 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-7164905117 [0,1,0,0,0,1|1,0,0]=3 4178 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-8391987811 [0,1,0,0,0,1|1,0,0]=3 4179 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-1357072117 [0,1,0,0,0,1|1,0,0]=3 4180 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-6685948915 [0,1,0,0,0,1|1,0,0]=3 4181 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-7943195603 [0,1,0,0,0,1|1,0,0]=3 4182 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-8245028670 [0,1,0,0,0,1|1,0,0]=3 4183 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-4492703729 [0,1,0,0,0,1|1,0,0]=3 4184 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-4789174904 [0,1,0,0,0,1|1,0,0]=3 4185 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-6004868841 [0,1,0,0,0,1|1,0,0]=3 4186 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-8447894362 [0,1,0,0,0,1|1,0,0]=3 4187 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-8973989363 [0,1,0,0,0,1|1,0,0]=3 4188 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-5551273180 [0,1,0,0,0,1|1,0,0]=3 4189 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-5976690411 [0,1,0,0,0,1|1,0,0]=3 4190 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-7451026930 [0,1,0,0,0,1|1,0,0]=3 4191 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-8752855910 [0,1,0,0,0,1|1,0,0]=3 4192 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-1095109510 [0,1,0,0,0,1|0,0,0]=2 4193 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-4732803083 [0,1,0,0,0,1|0,0,0]=2 4194 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-5642785598 [0,1,0,0,0,1|0,0,0]=2 4195 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-5749221307 [0,1,0,0,0,1|0,0,0]=2 4196 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-5162429786 [0,1,0,0,0,1|1,0,0]=3 4197 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-7239532241 [0,1,0,0,0,1|1,0,0]=3 4198 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-7684323850 [0,1,0,0,0,1|1,0,0]=3 4199 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-8072335300 [0,1,0,0,0,1|1,0,0]=3 4200 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-8375175370 [0,1,0,0,0,1|1,0,0]=3 4201 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-9876388752 [0,1,0,0,0,1|1,0,0]=3 4202 B10R1.15 COC(=O)[C@@H]1CSCCN1 MCULE-2644672819 [0,1,0,0,0,1|1,0,0]=3 4203 B10R1.15 COC(=O)[C@@H]1CSCCN1 MCULE-8721567121 [0,1,0,0,0,1|1,0,0]=3 4204 B10R1.15 COC(=O)[C@H]1CC=CCC1 MCULE-1381229233 [0,1,0,0,0,1|1,0,1]=4 4205 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-5042289968 [0,1,0,0,0,1|1,0,0]=3 4206 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-5552610931 [0,1,0,0,0,1|1,0,0]=3 4207 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-6096933206 [0,1,0,0,0,1|1,0,0]=3 4208 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-6748268572 [0,1,0,0,0,1|1,0,0]=3 4209 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-1258591863 [0,1,0,0,0,1|1,0,0]=3 4210 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-2913297882 [0,1,0,0,0,1|1,0,0]=3 4211 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-7994934831 [0,1,0,0,0,1|1,0,0]=3 4212 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-9664872744 [0,1,0,0,0,1|1,0,0]=3 4213 B10R1.15 COC(=O)[C@H]1CCCOC1 MCULE-3895837022 [0,1,0,0,0,1|0,0,0]=2 4214 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-1502399125 [0,1,0,0,0,1|1,0,0]=3 4215 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-4305901126 [0,1,0,0,0,1|1,0,0]=3 4216 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-4581702554 [0,1,0,0,0,1|1,0,0]=3 4217 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-5249386287 [0,1,0,0,0,1|1,0,0]=3 4218 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-1713285364 [0,1,0,0,0,1|0,0,0]=2 4219 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-2717742188 [0,1,0,0,0,1|0,0,0]=2 4220 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-3191998281 [0,1,0,0,0,1|0,0,0]=2 4221 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-4522663718 [0,1,0,0,0,1|0,0,0]=2 4222 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-2095296947 [0,1,0,0,0,1|1,0,0]=3 4223 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-4051082225 [0,1,0,0,0,1|1,0,0]=3 4224 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-5485853687 [0,1,0,0,0,1|1,0,0]=3 4225 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-8734141342 [0,1,0,0,0,1|1,0,0]=3 4226 B10R1.15 COC(=O)[C@H]1CSCCN1 MCULE-6859763829 [0,1,0,0,0,1|1,0,0]=3 4227 B10R1.15 N/C(=N/O)/C1CCCCC1 MCULE-7400174450 [0,1,0,0,0,1|2,0,0]=4 4228 B10R1.15 N/C(=N\O)/C1CCCNC1 MCULE-7748729178 [0,1,0,0,0,1|2,0,0]=4 4229 B10R1.15 N/C(=N\O)/C1CCCNC1 MCULE-9028349942 [0,1,0,0,0,1|2,0,0]=4 4230 B10R1.15 N/C(=N\O)/C1CCNCC1 MCULE-8372901738 [0,1,0,0,0,1|2,0,0]=4 4231 B10R1.15 N/C(=N\O)/C1CCOCC1 MCULE-6781639672 [0,1,0,0,0,1|2,0,0]=4 4232 B10R1.15 NC(CO)C1CCCOC1 MCULE-4152145176 [0,1,0,0,0,1|1,0,1]=4 4233 B10R1.15 NC(CO)C1CCCOC1 MCULE-7286913939 [0,1,0,0,0,1|1,0,1]=4 4234 B10R1.15 NCC(=O)C1CCCCC1 MCULE-5312619543 [0,1,0,0,0,1|2,0,0]=4 4235 B10R1.15 NCC(=O)C1CCCCC1 MCULE-8215004471 [0,1,0,0,0,1|2,0,0]=4 4236 B10R1.15 NNC(=O)C1CCCCC1 MCULE-3486870731 [0,1,0,0,0,1|2,0,0]=4 4237 B10R1.15 NNC(=O)C1CCCCO1 MCULE-7036120684 [0,1,0,0,0,1|1,0,0]=3 4238 B10R1.15 NNC(=O)C1CCCNC1 MCULE-6747055430 [0,1,0,0,0,1|2,0,0]=4 4239 B10R1.15 NNC(=O)C1CCCOC1 MCULE-6809433075 [0,1,0,0,0,1|1,0,0]=3 4240 B10R1.15 NNC(=O)C1CCNCC1 MCULE-8248667450 [0,1,0,0,0,1|2,0,0]=4 4241 B10R1.15 NNC(=O)C1CCOCC1 MCULE-9421182063 [0,1,0,0,0,1|2,0,0]=4 4242 B10R1.15 NNC(=O)C1COCCO1 MCULE-5807277104 [0,1,0,0,0,1|1,0,0]=3 4243 B10R1.15 NNC(=O)[C@H]1CCCOC1 MCULE-9808551984 [0,1,0,0,0,1|1,0,0]=3 4244 B10R1.15 O/N=C(\Cl)/C1CCCCC1 MCULE-3114876572 [0,1,0,0,0,1|2,0,0]=4 4245 B10R1.15 O/N=C(\Cl)/C1CCOCC1 MCULE-2836387970 [0,1,0,0,0,1|2,0,0]=4 4246 B10R1.15 O=C(CBr)C1CCCCC1 MCULE-1828005520 [0,1,0,0,0,1|2,0,0]=4 4247 B10R1.15 O=C(CBr)C1CCCOC1 MCULE-9091642966 [0,1,0,0,0,1|1,0,0]=3 4248 B10R1.15 O=C(CBr)C1CCOCC1 MCULE-2334595244 [0,1,0,0,0,1|2,0,0]=4 4249 B10R1.15 O=C(CCl)C1CCCCC1 MCULE-1798641564 [0,1,0,0,0,1|2,0,0]=4 4250 B10R1.15 O=C(CCl)C1CCCCO1 MCULE-3635601081 [0,1,0,0,0,1|1,0,0]=3 4251 B10R1.15 O=C(CCl)C1CCOCC1 MCULE-3211197448 [0,1,0,0,0,1|2,0,0]=4 4252 B10R1.15 O=C(CO)C1CCCCC1 MCULE-7711081081 [0,1,0,0,0,1|1,0,0]=3 4253 B10R1.15 O=C(CO)N1CCCCC1 MCULE-2972774035 [0,1,0,0,0,1|2,0,0]=4 4254 B10R1.15 O=C(CO)N1CCNCC1 MCULE-6053259606 [0,1,0,0,0,1|2,0,0]=4 4255 B10R1.15 O=C(CO)N1CCOCC1 MCULE-9777246982 [0,1,0,0,0,1|2,0,0]=4 4256 B10R1.15 O=C(NO)C1CCCCC1 MCULE-4311817351 [0,1,0,0,0,1|1,0,0]=3 4257 B10R1.15 O=C(NO)C1CCNCC1 MCULE-3667251310 [0,1,0,0,0,1|1,0,0]=3 4258 B10R1.15 OCC(O)C1CCCCO1 MCULE-2204525592 [0,1,0,0,0,1|0,0,2]=4 4259 B10R1.28 CC(C)(O)C1CNCCO1 MCULE-6011091311 [0,1,0,0,0,1|1,0,1]=4 4260 B10R1.28 CC(C)(O)C1CNCCO1 MCULE-8361145061 [0,1,0,0,0,1|1,0,1]=4 4261 B10R1.28 CC(C)(O)[C@@H]1CNCCO1 MCULE-8065175270 [0,1,0,0,0,1|1,0,1]=4 4262 B10R1.28 NS(=O)(=O)C1CCCOC1 MCULE-4083499383 [0,1,0,0,0,1|1,0,1]=4 4263 B10R1.28 O=P(O)(O)C1CCCCC1 MCULE-5721503179 [0,1,0,0,0,1|2,0,0]=4 4264 B10R1.28 O=S(=O)(O)C1CCCNC1 MCULE-3529161221 [0,1,0,0,0,1|2,0,0]=4 4265 B10R1.28 O=S(=O)(O)C1CCNCC1 MCULE-8375087442 [0,1,0,0,0,1|2,0,0]=4 4266 B10R1.61 CC(=O)C1CCCCC1=O MCULE-4487262627 [0,1,0,0,0,1|2,0,0]=4 4267 B10R1.61 CC(=O)C1CCCCC1C MCULE-9283684652 [0,1,0,0,0,1|2,0,0]=4 4268 B10R1.61 CC(=O)C1CCCCC1F MCULE-4625331195 [0,1,0,0,0,1|2,0,0]=4 4269 B10R1.61 CC(=O)C1CCCCC1N MCULE-2419182932 [0,1,0,0,0,1|2,0,0]=4 4270 B10R1.61 CC(=O)C1CCCCC1N MCULE-6311029678 [0,1,0,0,0,1|2,0,0]=4 4271 B10R1.61 CC(=O)C1NCCCC1C MCULE-2230049407 [0,1,0,0,0,1|2,0,0]=4 4272 B10R1.61 CC(=O)C1NCCCC1C MCULE-8677498528 [0,1,0,0,0,1|2,0,0]=4 4273 B10R1.61 CC1=C(CCCC1)C(=O)O MCULE-2899177590 [0,1,0,0,0,1|1,0,1]=4 4274 B10R1.61 CC1=C(CCCO1)C(=O)O MCULE-1778977864 [0,1,0,0,0,1|0,0,1]=3 4275 B10R1.61 CC1=C(OCCO1)C(=O)O MCULE-1214060885 [0,1,0,0,0,1|0,0,2]=4 4276 B10R1.61 CC1=C(SCCO1)C(=O)O MCULE-2576357484 [0,1,0,0,0,1|1,0,1]=4 4277 B10R1.61 CC1CC=CCC1C(=O)O MCULE-9141456284 [0,1,0,0,0,1|1,0,1]=4 4278 B10R1.61 CC1CCCC=C1C(=O)O MCULE-2002913109 [0,1,0,0,0,1|1,0,1]=4 4279 B10R1.61 CC1CCCCC1C(=O)Cl MCULE-7597713129 [0,1,0,0,0,1|2,0,0]=4 4280 B10R1.61 CC1CCCCC1C(=O)O MCULE-3305682191 [0,1,0,0,0,1|1,0,0]=3 4281 B10R1.61 CC1CCCNC1C(=O)N MCULE-8821146640 [0,1,0,0,0,1|2,0,0]=4 4282 B10R1.61 CC1CCNCC1C(=O)O MCULE-8748624987 [0,1,0,0,0,1|1,0,0]=3 4283 B10R1.61 CC1CCNCC1C(=O)O MCULE-9934986088 [0,1,0,0,0,1|1,0,0]=3 4284 B10R1.61 CC1CNCCC1C(=O)O MCULE-4662714630 [0,1,0,0,0,1|1,0,0]=3 4285 B10R1.61 CC1CNCCC1C(=O)O MCULE-7019458300 [0,1,0,0,0,1|1,0,0]=3 4286 B10R1.61 CC1COCCC1C(=O)O MCULE-3541844170 [0,1,0,0,0,1|1,0,0]=3 4287 B10R1.61 CC1NCCCC1C(=O)O MCULE-1657397096 [0,1,0,0,0,1|1,0,0]=3 4288 B10R1.61 CC1NCCCC1C(=O)O MCULE-3297923255 [0,1,0,0,0,1|1,0,0]=3 4289 B10R1.61 CC1OCCCC1C(=O)O MCULE-1412449239 [0,1,0,0,0,1|0,0,0]=2 4290 B10R1.61 CC1OCCNC1C(=O)O MCULE-7650728786 [0,1,0,0,0,1|1,0,0]=3 4291 B10R1.61 CC1OCCNC1C(=O)O MCULE-7980002158 [0,1,0,0,0,1|1,0,0]=3 4292 B10R1.61 CN1CCCCC1C(=O)O MCULE-3456275150 [0,1,0,0,0,1|1,0,0]=3 4293 B10R1.61 CN1CCCCC1C(=O)O MCULE-6372652181 [0,1,0,0,0,1|1,0,0]=3 4294 B10R1.61 CN1CCCCC1C(=O)O MCULE-7834522939 [0,1,0,0,0,1|1,0,0]=3 4295 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2245294368 [0,1,0,0,0,1|1,0,0]=3 4296 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2258119449 [0,1,0,0,0,1|1,0,0]=3 4297 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-4757725445 [0,1,0,0,0,1|1,0,0]=3 4298 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-9648696079 [0,1,0,0,0,1|1,0,0]=3 4299 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5396822712 [0,1,0,0,0,1|1,0,0]=3 4300 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5529863786 [0,1,0,0,0,1|1,0,0]=3 4301 B10R1.61 CN1CCNCC1C(=O)N MCULE-5869045526 [0,1,0,0,0,1|2,0,0]=4 4302 B10R1.61 CN1CCNCC1C(=O)N MCULE-6913155408 [0,1,0,0,0,1|2,0,0]=4 4303 B10R1.61 CN1CCNCC1C(=O)O MCULE-1461373192 [0,1,0,0,0,1|1,0,0]=3 4304 B10R1.61 CN1CCNCC1C(=O)O MCULE-2314108697 [0,1,0,0,0,1|1,0,0]=3 4305 B10R1.61 CN1CCNCC1C(=O)O MCULE-6876364616 [0,1,0,0,0,1|1,0,0]=3 4306 B10R1.61 CN1CCNC[C@@H]1C(=O)O MCULE-6844980804 [0,1,0,0,0,1|1,0,0]=3 4307 B10R1.61 CN1CCNC[C@@H]1C(=O)O MCULE-9108769184 [0,1,0,0,0,1|1,0,0]=3 4308 B10R1.61 CN1CCNC[C@H]1C(=O)O MCULE-5706230528 [0,1,0,0,0,1|1,0,0]=3 4309 B10R1.61 CN1CCNC[C@H]1C(=O)O MCULE-6493932779 [0,1,0,0,0,1|1,0,0]=3 4310 B10R1.61 CN1CCOCC1C(=O)O MCULE-3133710690 [0,1,0,0,0,1|1,0,0]=3 4311 B10R1.61 CN1CCOCC1C(=O)O MCULE-3290676693 [0,1,0,0,0,1|1,0,0]=3 4312 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-1062473078 [0,1,0,0,0,1|1,0,0]=3 4313 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-1353468073 [0,1,0,0,0,1|1,0,0]=3 4314 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-2754171059 [0,1,0,0,0,1|1,0,0]=3 4315 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-8165717473 [0,1,0,0,0,1|1,0,0]=3 4316 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-4042448961 [0,1,0,0,0,1|1,0,0]=3 4317 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-4563667791 [0,1,0,0,0,1|1,0,0]=3 4318 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-6824999437 [0,1,0,0,0,1|1,0,0]=3 4319 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-9114074540 [0,1,0,0,0,1|1,0,0]=3 4320 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-1327276849 [0,1,0,0,0,1|2,0,0]=4 4321 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-3578282795 [0,1,0,0,0,1|2,0,0]=4 4322 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-5453839569 [0,1,0,0,0,1|1,0,0]=3 4323 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-8712948607 [0,1,0,0,0,1|1,0,0]=3 4324 B10R1.61 C[C@@H]1NCCC[C@H]1C(=O)O MCULE-4097586923 [0,1,0,0,0,1|1,0,0]=3 4325 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-5754974970 [0,1,0,0,0,1|1,0,0]=3 4326 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-9389286375 [0,1,0,0,0,1|1,0,0]=3 4327 B10R1.61 C[C@H]1NCCC[C@@H]1C(=O)O MCULE-1705027594 [0,1,0,0,0,1|1,0,0]=3 4328 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8221283836 [0,1,0,0,0,1|1,0,0]=3 4329 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8542699735 [0,1,0,0,0,1|1,0,0]=3 4330 B10R1.61 C[C@H]1OCCC[C@H]1C(=O)O MCULE-9860065784 [0,1,0,0,0,1|0,0,0]=2 4331 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-1879170734 [0,1,0,0,0,1|1,0,0]=3 4332 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4061314927 [0,1,0,0,0,1|1,0,0]=3 4333 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4489336660 [0,1,0,0,0,1|1,0,0]=3 4334 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4667134552 [0,1,0,0,0,1|1,0,0]=3 4335 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-5449945964 [0,1,0,0,0,1|1,0,0]=3 4336 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-7387257453 [0,1,0,0,0,1|1,0,0]=3 4337 B10R1.61 NC(=O)C1CCCCC1=O MCULE-4980594289 [0,1,0,0,0,1|2,0,0]=4 4338 B10R1.61 NC(=O)C1CCCCC1N MCULE-2662216069 [0,1,0,0,0,1|2,0,0]=4 4339 B10R1.61 NC(=O)C1CCCCC1N MCULE-7467804033 [0,1,0,0,0,1|2,0,0]=4 4340 B10R1.61 NC(=O)C1CCCNC1=O MCULE-9308439620 [0,1,0,0,0,1|2,0,0]=4 4341 B10R1.61 NC(=O)C1CNCCC1=O MCULE-5445807694 [0,1,0,0,0,1|2,0,0]=4 4342 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-2263565157 [0,1,0,0,0,1|2,0,0]=4 4343 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-4928808183 [0,1,0,0,0,1|2,0,0]=4 4344 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-3135295628 [0,1,0,0,0,1|2,0,0]=4 4345 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-6221057684 [0,1,0,0,0,1|2,0,0]=4 4346 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-8654148060 [0,1,0,0,0,1|2,0,0]=4 4347 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-9581516213 [0,1,0,0,0,1|2,0,0]=4 4348 B10R1.61 NC1=C(CCCC1)C(=O)O MCULE-4360190675 [0,1,0,0,0,1|1,0,1]=4 4349 B10R1.61 NC1C=CCCC1C(=O)O MCULE-4465863020 [0,1,0,0,0,1|1,0,1]=4 4350 B10R1.61 NC1C=CCCC1C(=O)O MCULE-7419185648 [0,1,0,0,0,1|1,0,1]=4 4351 B10R1.61 NC1CC=CCC1C(=O)O MCULE-1611474561 [0,1,0,0,0,1|1,0,1]=4 4352 B10R1.61 NC1CC=CCC1C(=O)O MCULE-7218542670 [0,1,0,0,0,1|1,0,1]=4 4353 B10R1.61 NC1CCCCC1C(=O)O MCULE-4736252154 [0,1,0,0,0,1|1,0,0]=3 4354 B10R1.61 NC1CCCCC1C(=O)O MCULE-6203238767 [0,1,0,0,0,1|1,0,0]=3 4355 B10R1.61 NC1COCCC1C(=O)O MCULE-3475622537 [0,1,0,0,0,1|1,0,0]=3 4356 B10R1.61 N[C@@H]1C=CCC[C@@H]1C(=O)O MCULE-5919685636 [0,1,0,0,0,1|1,0,1]=4 4357 B10R1.61 N[C@@H]1C=CCC[C@@H]1C(=O)O MCULE-7012622007 [0,1,0,0,0,1|1,0,1]=4 4358 B10R1.61 N[C@@H]1C=CCC[C@@H]1C(=O)O MCULE-7228704167 [0,1,0,0,0,1|1,0,1]=4 4359 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-2340179433 [0,1,0,0,0,1|1,0,1]=4 4360 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-5382709957 [0,1,0,0,0,1|1,0,1]=4 4361 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-5760660665 [0,1,0,0,0,1|1,0,1]=4 4362 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-7312327841 [0,1,0,0,0,1|1,0,1]=4 4363 B10R1.61 N[C@@H]1CC=CC[C@H]1C(=O)O MCULE-6730051789 [0,1,0,0,0,1|1,0,1]=4 4364 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-1790728170 [0,1,0,0,0,1|1,0,0]=3 4365 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-3150171920 [0,1,0,0,0,1|1,0,0]=3 4366 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-4600025587 [0,1,0,0,0,1|1,0,0]=3 4367 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-9708582870 [0,1,0,0,0,1|1,0,0]=3 4368 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-3088249896 [0,1,0,0,0,1|1,0,0]=3 4369 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-4663931442 [0,1,0,0,0,1|1,0,0]=3 4370 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-6017464144 [0,1,0,0,0,1|1,0,0]=3 4371 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-9507759371 [0,1,0,0,0,1|1,0,0]=3 4372 B10R1.61 N[C@H]1C=CCC[C@H]1C(=O)O MCULE-1084812750 [0,1,0,0,0,1|1,0,1]=4 4373 B10R1.61 N[C@H]1C=CCC[C@H]1C(=O)O MCULE-7223852983 [0,1,0,0,0,1|1,0,1]=4 4374 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-2088008231 [0,1,0,0,0,1|1,0,1]=4 4375 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-2783014205 [0,1,0,0,0,1|1,0,1]=4 4376 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-4211428411 [0,1,0,0,0,1|1,0,1]=4 4377 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-6091505598 [0,1,0,0,0,1|1,0,1]=4 4378 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-2040720562 [0,1,0,0,0,1|1,0,0]=3 4379 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-5411687824 [0,1,0,0,0,1|1,0,0]=3 4380 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-6353451287 [0,1,0,0,0,1|1,0,0]=3 4381 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-9744443114 [0,1,0,0,0,1|1,0,0]=3 4382 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-1070315128 [0,1,0,0,0,1|1,0,0]=3 4383 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-2665445473 [0,1,0,0,0,1|1,0,0]=3 4384 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-5776301031 [0,1,0,0,0,1|1,0,0]=3 4385 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-7183400727 [0,1,0,0,0,1|1,0,0]=3 4386 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-4608934385 [0,1,0,0,0,1|1,0,0]=3 4387 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-7590284479 [0,1,0,0,0,1|1,0,0]=3 4388 B10R1.61 O=C(O)C1=C(CCCC1)Br MCULE-4432967237 [0,1,0,0,0,1|1,0,1]=4 4389 B10R1.61 O=C(O)C1=C(CCCC1)Cl MCULE-4191246644 [0,1,0,0,0,1|1,0,1]=4 4390 B10R1.61 O=C(O)C1=C(CCNC1)F MCULE-5950030289 [0,1,0,0,0,1|1,0,1]=4 4391 B10R1.61 O=C(O)C1=C(CCNC1)F MCULE-7466992226 [0,1,0,0,0,1|1,0,1]=4 4392 B10R1.61 O=C(O)C1=C(CCOC1)Cl MCULE-8616332165 [0,1,0,0,0,1|0,0,2]=4 4393 B10R1.61 O=C(O)C1CCCCC1=O MCULE-1684765148 [0,1,0,0,0,1|1,0,0]=3 4394 B10R1.61 O=C(O)C1CCCCC1F MCULE-9495362772 [0,1,0,0,0,1|1,0,0]=3 4395 B10R1.61 O=C(O)C1CCCCC1O MCULE-4502285714 [0,1,0,0,0,1|1,0,0]=3 4396 B10R1.61 O=C(O)C1CCCCN1O MCULE-1338694603 [0,1,0,0,0,1|1,0,0]=3 4397 B10R1.61 O=C(O)C1CCCNC1=O MCULE-5733950200 [0,1,0,0,0,1|1,0,0]=3 4398 B10R1.61 O=C(O)C1CCNCC1F MCULE-5749357486 [0,1,0,0,0,1|1,0,0]=3 4399 B10R1.61 O=C(O)C1CCNCC1F MCULE-7431262807 [0,1,0,0,0,1|1,0,0]=3 4400 B10R1.61 O=C(O)C1CNCCC1=O MCULE-3624462455 [0,1,0,0,0,1|1,0,0]=3 4401 B10R1.61 O=C(O)C1NCCCC1O MCULE-2981139992 [0,1,0,0,0,1|1,0,0]=3 4402 B10R1.61 O=C(O)C1NCCNC1=O MCULE-5861499693 [0,1,0,0,0,1|1,0,1]=4 4403 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-2224593354 [0,1,0,0,0,1|1,0,0]=3 4404 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-3743184576 [0,1,0,0,0,1|1,0,0]=3 4405 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-2137327596 [0,1,0,0,0,1|1,0,0]=3 4406 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3028221093 [0,1,0,0,0,1|1,0,0]=3 4407 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3468221525 [0,1,0,0,0,1|1,0,0]=3 4408 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-5449397815 [0,1,0,0,0,1|1,0,0]=3 4409 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-2786788134 [0,1,0,0,0,1|1,0,0]=3 4410 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-3262303247 [0,1,0,0,0,1|1,0,0]=3 4411 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4026886814 [0,1,0,0,0,1|1,0,0]=3 4412 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4165843552 [0,1,0,0,0,1|1,0,0]=3 4413 B10R1.61 O=C([O-])C1CCCCC1=O MCULE-2483955816 [0,1,0,0,0,1|1,0,1]=4 4414 B10R1.61 O=C([O-])C1CCCCN1O MCULE-1323846734 [0,1,0,0,0,1|1,0,1]=4 4415 B10R1.113 CC(=O)C1CCCN(C1)C MCULE-4171786992 [0,1,0,0,0,1|2,0,0]=4 4416 B10R1.113 CC(=O)C1CCCN(C1)C MCULE-6409364695 [0,1,0,0,0,1|2,0,0]=4 4417 B10R1.113 CC1=CCCC(C1)C(=O)O MCULE-1528958679 [0,1,0,0,0,1|1,0,1]=4 4418 B10R1.113 CC1=NCCC(N1)C(=O)O MCULE-8417553503 [0,1,0,0,0,1|1,0,1]=4 4419 B10R1.113 CC1=N[C@@H](CCN1)C(=O)O MCULE-2656568536 [0,1,0,0,0,1|1,0,1]=4 4420 B10R1.113 CC1=N[C@@H](CCN1)C(=O)O MCULE-4918579312 [0,1,0,0,0,1|1,0,1]=4 4421 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-7720743223 [0,1,0,0,0,1|1,0,0]=3 4422 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-8584436669 [0,1,0,0,0,1|1,0,0]=3 4423 B10R1.113 CC1CC(CCO1)C(=O)O MCULE-8051149188 [0,1,0,0,0,1|1,0,0]=3 4424 B10R1.113 CC1CCCC(C1)C(=O)O MCULE-1709216331 [0,1,0,0,0,1|1,0,0]=3 4425 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-2752928027 [0,1,0,0,0,1|1,0,0]=3 4426 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7361502591 [0,1,0,0,0,1|1,0,0]=3 4427 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7906995060 [0,1,0,0,0,1|1,0,0]=3 4428 B10R1.113 CC1CCCC(O1)C(=O)O MCULE-2545962496 [0,1,0,0,0,1|0,0,0]=2 4429 B10R1.113 CC1CCNC(C1)C(=O)N MCULE-8372541866 [0,1,0,0,0,1|2,0,0]=4 4430 B10R1.113 CC1CCNC(C1)C(=O)O MCULE-7170086856 [0,1,0,0,0,1|1,0,0]=3 4431 B10R1.113 CC1CNCC(C1)C(=O)O MCULE-6208683659 [0,1,0,0,0,1|1,0,0]=3 4432 B10R1.113 CC1CNCC(O1)C(=O)N MCULE-4373996098 [0,1,0,0,0,1|1,0,0]=3 4433 B10R1.113 CC1CNCC(O1)C(=O)O MCULE-4851002529 [0,1,0,0,0,1|0,0,0]=2 4434 B10R1.113 CC1COCC(N1)C(=O)N MCULE-4300959650 [0,1,0,0,0,1|2,0,0]=4 4435 B10R1.113 CC1COCC(N1)C(=O)O MCULE-6739051094 [0,1,0,0,0,1|1,0,0]=3 4436 B10R1.113 CN1CCC=C(C1)C(=O)O MCULE-5778457701 [0,1,0,0,0,1|1,0,1]=4 4437 B10R1.113 CN1CCCC(C1)C(=O)Cl MCULE-2256974113 [0,1,0,0,0,1|2,0,0]=4 4438 B10R1.113 CN1CCCC(C1)C(=O)Cl MCULE-6072454792 [0,1,0,0,0,1|2,0,0]=4 4439 B10R1.113 CN1CCCC(C1)C(=O)N MCULE-2482020070 [0,1,0,0,0,1|2,0,0]=4 4440 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-2577677138 [0,1,0,0,0,1|1,0,0]=3 4441 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-9093982856 [0,1,0,0,0,1|1,0,0]=3 4442 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3472059995 [0,1,0,0,0,1|1,0,0]=3 4443 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3661518240 [0,1,0,0,0,1|1,0,0]=3 4444 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-4244061094 [0,1,0,0,0,1|1,0,0]=3 4445 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-1368409828 [0,1,0,0,0,1|1,0,0]=3 4446 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-2079226353 [0,1,0,0,0,1|1,0,0]=3 4447 B10R1.113 CN1CCNC(C1)C(=O)N MCULE-3257789162 [0,1,0,0,0,1|2,0,0]=4 4448 B10R1.113 CN1CCNC(C1)C(=O)N MCULE-6597619500 [0,1,0,0,0,1|2,0,0]=4 4449 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-2247528725 [0,1,0,0,0,1|1,0,0]=3 4450 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-9094338983 [0,1,0,0,0,1|1,0,0]=3 4451 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-5238925665 [0,1,0,0,0,1|1,0,0]=3 4452 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-6341643779 [0,1,0,0,0,1|1,0,0]=3 4453 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-1518073789 [0,1,0,0,0,1|1,0,0]=3 4454 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-8312508233 [0,1,0,0,0,1|1,0,0]=3 4455 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-5046751827 [0,1,0,0,0,1|0,0,0]=2 4456 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-8819512874 [0,1,0,0,0,1|0,0,0]=2 4457 B10R1.113 CN1CCOC(C1)C(=S)N MCULE-1304435248 [0,1,0,0,0,1|1,1,0]=4 4458 B10R1.113 C[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-4534640450 [0,1,0,0,0,1|1,0,0]=3 4459 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6827473516 [0,1,0,0,0,1|1,0,0]=3 4460 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6916060172 [0,1,0,0,0,1|1,0,0]=3 4461 B10R1.113 C[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2658835025 [0,1,0,0,0,1|1,0,0]=3 4462 B10R1.113 C[C@@H]1CCN[C@@H](C1)C(=O)O MCULE-6382189211 [0,1,0,0,0,1|1,0,0]=3 4463 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-3220705725 [0,1,0,0,0,1|1,0,0]=3 4464 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-4368703620 [0,1,0,0,0,1|1,0,0]=3 4465 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-5852226290 [0,1,0,0,0,1|1,0,0]=3 4466 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-8448888283 [0,1,0,0,0,1|1,0,0]=3 4467 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-6787897599 [0,1,0,0,0,1|1,0,0]=3 4468 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-7011808441 [0,1,0,0,0,1|1,0,0]=3 4469 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-1640808929 [0,1,0,0,0,1|0,0,0]=2 4470 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-5152957457 [0,1,0,0,0,1|0,0,0]=2 4471 B10R1.113 C[C@@H]1CNC[C@H](C1)C(=O)O MCULE-8762702780 [0,1,0,0,0,1|1,0,0]=3 4472 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-6500795104 [0,1,0,0,0,1|1,0,0]=3 4473 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-9135304432 [0,1,0,0,0,1|1,0,0]=3 4474 B10R1.113 C[C@H]1CCC[C@@H](C1)C(=O)O MCULE-2151963828 [0,1,0,0,0,1|1,0,0]=3 4475 B10R1.113 C[C@H]1CCC[C@H](C1)C(=O)O MCULE-9191189376 [0,1,0,0,0,1|1,0,0]=3 4476 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3797871093 [0,1,0,0,0,1|1,0,0]=3 4477 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3813657182 [0,1,0,0,0,1|1,0,0]=3 4478 B10R1.113 C[C@H]1CCN[C@H](C1)C(=O)O MCULE-8048617173 [0,1,0,0,0,1|1,0,0]=3 4479 B10R1.113 C[C@H]1CNC[C@@H](C1)C(=O)O MCULE-9182357479 [0,1,0,0,0,1|1,0,0]=3 4480 B10R1.113 C[C@H]1CNC[C@H](C1)C(=O)O MCULE-7208949681 [0,1,0,0,0,1|1,0,0]=3 4481 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-3777490064 [0,1,0,0,0,1|1,0,0]=3 4482 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-7587755997 [0,1,0,0,0,1|1,0,0]=3 4483 B10R1.113 C[NH+]1CCC=C(C1)C(=O)O MCULE-8096594321 [0,1,0,0,0,1|1,0,1]=4 4484 B10R1.113 NC(=O)C1CCCC(=O)C1 MCULE-3502536681 [0,1,0,0,0,1|2,0,0]=4 4485 B10R1.113 NC(=O)C1CCCC(C1)N MCULE-5887465193 [0,1,0,0,0,1|2,0,0]=4 4486 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-1352569589 [0,1,0,0,0,1|2,0,0]=4 4487 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3084012877 [0,1,0,0,0,1|2,0,0]=4 4488 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3571668618 [0,1,0,0,0,1|2,0,0]=4 4489 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3930179934 [0,1,0,0,0,1|2,0,0]=4 4490 B10R1.113 NC1C=CCC(C1)C(=O)O MCULE-4308750395 [0,1,0,0,0,1|1,0,1]=4 4491 B10R1.113 NC1C=CCC(C1)C(=O)O MCULE-5984594154 [0,1,0,0,0,1|1,0,1]=4 4492 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-1721377644 [0,1,0,0,0,1|1,0,0]=3 4493 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-3598251126 [0,1,0,0,0,1|1,0,0]=3 4494 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7071803947 [0,1,0,0,0,1|0,0,0]=2 4495 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7129710557 [0,1,0,0,0,1|0,0,0]=2 4496 B10R1.113 N[C@@H]1C=CCC(C1)C(=O)O MCULE-5349723370 [0,1,0,0,0,1|1,0,1]=4 4497 B10R1.113 N[C@@H]1C=CCC(C1)C(=O)O MCULE-8912699325 [0,1,0,0,0,1|1,0,1]=4 4498 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5563204448 [0,1,0,0,0,1|1,0,0]=3 4499 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5798146682 [0,1,0,0,0,1|1,0,0]=3 4500 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-8105249419 [0,1,0,0,0,1|1,0,0]=3 4501 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-9161171059 [0,1,0,0,0,1|1,0,0]=3 4502 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2713838733 [0,1,0,0,0,1|1,0,0]=3 4503 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2810146308 [0,1,0,0,0,1|1,0,0]=3 4504 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-3141762073 [0,1,0,0,0,1|1,0,0]=3 4505 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-6970045085 [0,1,0,0,0,1|1,0,0]=3 4506 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-5264166397 [0,1,0,0,0,1|0,0,0]=2 4507 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-6153195788 [0,1,0,0,0,1|0,0,0]=2 4508 B10R1.113 N[C@H]1C=CCC(C1)C(=O)O MCULE-1166952810 [0,1,0,0,0,1|1,0,1]=4 4509 B10R1.113 N[C@H]1C=CCC(C1)C(=O)O MCULE-4761766781 [0,1,0,0,0,1|1,0,1]=4 4510 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-3283868687 [0,1,0,0,0,1|1,0,0]=3 4511 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-5009823003 [0,1,0,0,0,1|1,0,0]=3 4512 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-6716939610 [0,1,0,0,0,1|1,0,0]=3 4513 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-8264766500 [0,1,0,0,0,1|1,0,0]=3 4514 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-1016300044 [0,1,0,0,0,1|1,0,0]=3 4515 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-2730367375 [0,1,0,0,0,1|1,0,0]=3 4516 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3326410223 [0,1,0,0,0,1|1,0,0]=3 4517 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3370817462 [0,1,0,0,0,1|1,0,0]=3 4518 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3467671648 [0,1,0,0,0,1|1,0,0]=3 4519 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-7929171022 [0,1,0,0,0,1|1,0,0]=3 4520 B10R1.113 O=C(O)C1=CC(CCC1)O MCULE-3053514968 [0,1,0,0,0,1|1,0,1]=4 4521 B10R1.113 O=C(O)C1=CS(=O)CCC1 MCULE-4974730957 [0,1,0,0,0,1|0,1,1]=4 4522 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-2758341308 [0,1,0,0,0,1|1,0,0]=3 4523 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-7585455422 [0,1,0,0,0,1|1,0,0]=3 4524 B10R1.113 O=C(O)C1CCCC(C1)F MCULE-2589850350 [0,1,0,0,0,1|1,0,0]=3 4525 B10R1.113 O=C(O)C1CCCC(C1)O MCULE-9068909742 [0,1,0,0,0,1|1,0,0]=3 4526 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-1307689360 [0,1,0,0,0,1|1,0,0]=3 4527 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-6671293935 [0,1,0,0,0,1|1,0,0]=3 4528 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-2725116552 [0,1,0,0,0,1|1,0,0]=3 4529 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-7493333189 [0,1,0,0,0,1|1,0,0]=3 4530 B10R1.113 O=C(O)[C@@H]1CC=C[C@@H](C1)O MCULE-3205925226 [0,1,0,0,0,1|1,0,1]=4 4531 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-1509835362 [0,1,0,0,0,1|1,0,0]=3 4532 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-2282540668 [0,1,0,0,0,1|1,0,0]=3 4533 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-2678948022 [0,1,0,0,0,1|1,0,0]=3 4534 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-6048774329 [0,1,0,0,0,1|1,0,0]=3 4535 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-1390000123 [0,1,0,0,0,1|1,0,0]=3 4536 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-5873942206 [0,1,0,0,0,1|1,0,0]=3 4537 B10R1.113 O=C(O)[C@@H]1C[C@H](CCN1)O MCULE-5317131791 [0,1,0,0,0,1|1,0,0]=3 4538 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-1308626340 [0,1,0,0,0,1|1,0,0]=3 4539 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-5789638591 [0,1,0,0,0,1|1,0,0]=3 4540 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3370494896 [0,1,0,0,0,1|1,0,0]=3 4541 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3728932412 [0,1,0,0,0,1|1,0,0]=3 4542 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1474484031 [0,1,0,0,0,1|1,0,0]=3 4543 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1820373402 [0,1,0,0,0,1|1,0,0]=3 4544 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4771226737 [0,1,0,0,0,1|1,0,0]=3 4545 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4907773186 [0,1,0,0,0,1|1,0,0]=3 4546 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-8175624129 [0,1,0,0,0,1|1,0,0]=3 4547 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-4751772547 [0,1,0,0,0,1|1,0,0]=3 4548 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-6686826243 [0,1,0,0,0,1|1,0,0]=3 4549 B10R1.113 O=C1C=C(CCC1)C(=O)O MCULE-6477437107 [0,1,0,0,0,1|1,0,1]=4 4550 B10R1.113 O=C1CC(CCN1)C(=O)O MCULE-8037650535 [0,1,0,0,0,1|1,0,1]=4 4551 B10R1.113 O=C1CCCC(C1)C(=O)O MCULE-6286773194 [0,1,0,0,0,1|1,0,0]=3 4552 B10R1.113 O=C1CCCC(N1)C(=O)O MCULE-9444010827 [0,1,0,0,0,1|1,0,0]=3 4553 B10R1.113 O=C1CCCC(N1)C(=O)O MCULE-9607599809 [0,1,0,0,0,1|1,0,0]=3 4554 B10R1.113 O=C1CCC[C@@H](C1)C(=O)O MCULE-5396925186 [0,1,0,0,0,1|1,0,0]=3 4555 B10R1.113 O=C1CCC[C@@H](N1)C(=O)O MCULE-3091454903 [0,1,0,0,0,1|1,0,0]=3 4556 B10R1.113 O=C1CCC[C@@H](N1)C(=O)O MCULE-5853502175 [0,1,0,0,0,1|1,0,0]=3 4557 B10R1.113 O=C1CCC[C@H](C1)C(=O)O MCULE-8936667281 [0,1,0,0,0,1|1,0,0]=3 4558 B10R1.113 O=C1CCC[C@H](N1)C(=O)O MCULE-6509598163 [0,1,0,0,0,1|1,0,0]=3 4559 B10R1.113 O=C1CCC[C@H](N1)C(=O)O MCULE-7646943695 [0,1,0,0,0,1|1,0,0]=3 4560 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-6916176336 [0,1,0,0,0,1|1,0,0]=3 4561 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-9262761817 [0,1,0,0,0,1|1,0,0]=3 4562 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-1115212106 [0,1,0,0,0,1|1,0,0]=3 4563 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5896394571 [0,1,0,0,0,1|1,0,0]=3 4564 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5937606037 [0,1,0,0,0,1|1,0,0]=3 4565 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-7073629862 [0,1,0,0,0,1|1,0,0]=3 4566 B10R1.113 O=C1CNCC(N1)C(=O)O MCULE-4117148380 [0,1,0,0,0,1|1,0,1]=4 4567 B10R1.113 O=C1CNC[C@@H](N1)C(=O)O MCULE-3006600193 [0,1,0,0,0,1|1,0,1]=4 4568 B10R1.113 O=C1CNC[C@H](N1)C(=O)O MCULE-4345470043 [0,1,0,0,0,1|1,0,1]=4 4569 B10R1.113 O=C1CSCC(N1)C(=O)O MCULE-7630386798 [0,1,0,0,0,1|1,0,1]=4 4570 B10R1.113 O=C1CSC[C@H](N1)C(=O)O MCULE-1412113570 [0,1,0,0,0,1|1,0,1]=4 4571 B10R1.113 O=C1C[C@@H](CCN1)C(=O)O MCULE-5205458306 [0,1,0,0,0,1|1,0,1]=4 4572 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-6254957663 [0,1,0,0,0,1|1,0,1]=4 4573 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-9670666580 [0,1,0,0,0,1|1,0,1]=4 4574 B10R1.113 O=C1NC(CCO1)C(=O)O MCULE-4281750243 [0,1,0,0,0,1|1,0,1]=4 4575 B10R1.113 O=C1NCCC(N1)C(=O)O MCULE-6196729766 [0,1,0,0,0,1|1,0,1]=4 4576 B10R1.113 O=C1NCCC(O1)C(=O)O MCULE-1272116406 [0,1,0,0,0,1|0,0,1]=3 4577 B10R1.113 O=C1N[C@@H](CCO1)C(=O)O MCULE-7121690603 [0,1,0,0,0,1|1,0,1]=4 4578 B10R1.113 [C@@H]1(CCCC(N1)C)C(=O)O MCULE-7930307305 [0,1,0,0,0,1|1,0,0]=3 4579 B10R1.113 [C@H]1(CCCN(C1)C)C(=O)O MCULE-4364645223 [0,1,0,0,0,1|1,0,0]=3 4580 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-2539251802 [0,1,0,0,0,1|1,0,0]=3 4581 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-4407634771 [0,1,0,0,0,1|1,0,0]=3 4582 B10R1.363 CC(=O)C1(CCCCC1)Br MCULE-1087745376 [0,1,0,0,0,1|2,0,0]=4 4583 B10R1.363 CC(=O)C1(CCCCC1)C MCULE-2400194377 [0,1,0,0,0,1|2,0,0]=4 4584 B10R1.363 CC(=O)C1(CCCCC1)N MCULE-2403671270 [0,1,0,0,0,1|2,0,0]=4 4585 B10R1.363 CC(=O)C1(CCCCC1)N MCULE-8220968252 [0,1,0,0,0,1|2,0,0]=4 4586 B10R1.363 CC(=O)C1(CCCCC1)O MCULE-8708554984 [0,1,0,0,0,1|2,0,0]=4 4587 B10R1.363 CC(=O)C1(CCNCC1)C MCULE-2089718696 [0,1,0,0,0,1|2,0,0]=4 4588 B10R1.363 CC(=O)C1(CCNCC1)C MCULE-3448978894 [0,1,0,0,0,1|2,0,0]=4 4589 B10R1.363 CC(=O)C1(CCOCC1)C MCULE-6994899414 [0,1,0,0,0,1|2,0,0]=4 4590 B10R1.363 CC(=O)C1(CCOCC1)O MCULE-4174424855 [0,1,0,0,0,1|2,0,0]=4 4591 B10R1.363 CC(=O)C1(COCOC1)C MCULE-2297528523 [0,1,0,0,0,1|2,0,0]=4 4592 B10R1.363 CC1(C=CCCC1)C(=O)O MCULE-7610148262 [0,1,0,0,0,1|1,0,0]=3 4593 B10R1.363 CC1(CC=CCC1)C(=O)O MCULE-5814640957 [0,1,0,0,0,1|1,0,1]=4 4594 B10R1.363 CC1(CCCCC1)C(=O)Cl MCULE-2304699201 [0,1,0,0,0,1|2,0,0]=4 4595 B10R1.363 CC1(CCCCC1)C(=O)N MCULE-2748976288 [0,1,0,0,0,1|2,0,0]=4 4596 B10R1.363 CC1(CCCCC1)C(=O)O MCULE-8617368211 [0,1,0,0,0,1|1,0,0]=3 4597 B10R1.363 CC1(CCCCN1)C(=O)N MCULE-5510028076 [0,1,0,0,0,1|2,0,0]=4 4598 B10R1.363 CC1(CCCCN1)C(=O)N MCULE-9010382394 [0,1,0,0,0,1|2,0,0]=4 4599 B10R1.363 CC1(CCCCN1)C(=O)O MCULE-4353837718 [0,1,0,0,0,1|1,0,0]=3 4600 B10R1.363 CC1(CCCCN1)C(=O)O MCULE-5823768018 [0,1,0,0,0,1|1,0,0]=3 4601 B10R1.363 CC1(CCCCO1)C(=O)O MCULE-8167039984 [0,1,0,0,0,1|0,0,0]=2 4602 B10R1.363 CC1(CCCNC1)C(=O)N MCULE-6281064804 [0,1,0,0,0,1|2,0,0]=4 4603 B10R1.363 CC1(CCCNC1)C(=O)N MCULE-7011930506 [0,1,0,0,0,1|2,0,0]=4 4604 B10R1.363 CC1(CCCNC1)C(=O)O MCULE-1830247756 [0,1,0,0,0,1|1,0,0]=3 4605 B10R1.363 CC1(CCCNC1)C(=O)O MCULE-4554317503 [0,1,0,0,0,1|1,0,0]=3 4606 B10R1.363 CC1(CCCOC1)C(=O)O MCULE-3722771180 [0,1,0,0,0,1|0,0,0]=2 4607 B10R1.363 CC1(CCNCC1)C(=O)N MCULE-1830846193 [0,1,0,0,0,1|2,0,0]=4 4608 B10R1.363 CC1(CCNCC1)C(=O)N MCULE-7847544229 [0,1,0,0,0,1|2,0,0]=4 4609 B10R1.363 CC1(CCNCC1)C(=O)O MCULE-5925956345 [0,1,0,0,0,1|1,0,0]=3 4610 B10R1.363 CC1(CCNCC1)C(=O)O MCULE-9595642308 [0,1,0,0,0,1|1,0,0]=3 4611 B10R1.363 CC1(CCOCC1)C(=O)O MCULE-6824729734 [0,1,0,0,0,1|1,0,0]=3 4612 B10R1.363 CC1(CCSCC1)C(=O)O MCULE-4494370785 [0,1,0,0,0,1|1,0,0]=3 4613 B10R1.363 CC1(CNCCO1)C(=O)N MCULE-9521473906 [0,1,0,0,0,1|1,0,0]=3 4614 B10R1.363 CC1(CNCCO1)C(=O)O MCULE-6864976931 [0,1,0,0,0,1|0,0,0]=2 4615 B10R1.363 CC1(CNCCO1)C(=O)O MCULE-7815848744 [0,1,0,0,0,1|0,0,0]=2 4616 B10R1.363 CC1(COCCN1)C(=O)O MCULE-2577762263 [0,1,0,0,0,1|1,0,0]=3 4617 B10R1.363 CC1(COCCN1)C(=O)O MCULE-4596611063 [0,1,0,0,0,1|1,0,0]=3 4618 B10R1.363 CC1(COCCO1)C(=O)O MCULE-5074851185 [0,1,0,0,0,1|0,0,0]=2 4619 B10R1.363 CC1(COCOC1)C(=O)O MCULE-7267825356 [0,1,0,0,0,1|1,0,0]=3 4620 B10R1.363 C[C@@]1(CCCCN1)C(=O)O MCULE-2751244606 [0,1,0,0,0,1|1,0,0]=3 4621 B10R1.363 C[C@@]1(CCCCN1)C(=O)O MCULE-9588562839 [0,1,0,0,0,1|1,0,0]=3 4622 B10R1.363 C[C@@]1(CCCCO1)C(=O)O MCULE-8351337180 [0,1,0,0,0,1|0,0,0]=2 4623 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-2580172241 [0,1,0,0,0,1|1,0,0]=3 4624 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-5735574050 [0,1,0,0,0,1|1,0,0]=3 4625 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-6097682986 [0,1,0,0,0,1|1,0,0]=3 4626 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-8361078667 [0,1,0,0,0,1|1,0,0]=3 4627 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-2019738412 [0,1,0,0,0,1|1,0,0]=3 4628 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-5663835052 [0,1,0,0,0,1|1,0,0]=3 4629 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-8254704116 [0,1,0,0,0,1|1,0,0]=3 4630 B10R1.363 C[C@]1(CCCCO1)C(=O)O MCULE-1520204390 [0,1,0,0,0,1|0,0,0]=2 4631 B10R1.363 C[C@]1(CCCCO1)C(=O)O MCULE-5357080399 [0,1,0,0,0,1|0,0,0]=2 4632 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-4789999853 [0,1,0,0,0,1|1,0,0]=3 4633 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-5338426663 [0,1,0,0,0,1|1,0,0]=3 4634 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-6021049561 [0,1,0,0,0,1|1,0,0]=3 4635 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-7816386590 [0,1,0,0,0,1|1,0,0]=3 4636 B10R1.363 NC(=O)C1(CCCCC1)N MCULE-9213834644 [0,1,0,0,0,1|2,0,0]=4 4637 B10R1.363 NC(=O)C1(CCCCC1)O MCULE-9953817877 [0,1,0,0,0,1|2,0,0]=4 4638 B10R1.363 NC(=O)C1(CCCNC1)O MCULE-5624973083 [0,1,0,0,0,1|2,0,0]=4 4639 B10R1.363 NC(=O)C1(CCNCC1)O MCULE-1637528026 [0,1,0,0,0,1|2,0,0]=4 4640 B10R1.363 NC(=O)C1(CCNCC1)O MCULE-9426392755 [0,1,0,0,0,1|2,0,0]=4 4641 B10R1.363 NC(=O)C1(CCOCC1)N MCULE-2419590647 [0,1,0,0,0,1|2,0,0]=4 4642 B10R1.363 NC(=O)C1(CCOCC1)N MCULE-4475585786 [0,1,0,0,0,1|2,0,0]=4 4643 B10R1.363 NC(=O)C1(CCOCC1)O MCULE-6043002573 [0,1,0,0,0,1|2,0,0]=4 4644 B10R1.363 NC(=O)C1(CCSCC1)N MCULE-4385733187 [0,1,0,0,0,1|2,0,0]=4 4645 B10R1.363 NC(=O)C1(CCSCC1)O MCULE-5322321936 [0,1,0,0,0,1|2,0,0]=4 4646 B10R1.363 NC1(CCCCC1)C(=O)O MCULE-9219404299 [0,1,0,0,0,1|1,0,0]=3 4647 B10R1.363 NC1(CCCOC1)C(=O)O MCULE-7592747043 [0,1,0,0,0,1|0,0,0]=2 4648 B10R1.363 NC1(CCCSC1)C(=O)O MCULE-5875012341 [0,1,0,0,0,1|0,1,0]=3 4649 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-2468722313 [0,1,0,0,0,1|1,0,0]=3 4650 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-4525710147 [0,1,0,0,0,1|1,0,0]=3 4651 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-5856930946 [0,1,0,0,0,1|1,0,0]=3 4652 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-8458518802 [0,1,0,0,0,1|1,0,0]=3 4653 B10R1.363 NC1(CCOCC1)C(=O)O MCULE-8720926076 [0,1,0,0,0,1|1,0,0]=3 4654 B10R1.363 NC1(CCOCC1)C(=O)O MCULE-9032013861 [0,1,0,0,0,1|1,0,0]=3 4655 B10R1.363 NC1(CCSCC1)C(=O)O MCULE-3400288648 [0,1,0,0,0,1|1,0,0]=3 4656 B10R1.363 NC1(CCSCC1)C(=O)O MCULE-7826194478 [0,1,0,0,0,1|1,0,0]=3 4657 B10R1.363 O=C(Cl)C1(CCCCC1)Br MCULE-3943135228 [0,1,0,0,0,1|2,0,0]=4 4658 B10R1.363 O=C(Cl)C1(CCCCC1)Cl MCULE-5594029874 [0,1,0,0,0,1|2,0,0]=4 4659 B10R1.363 O=C(O)C1(CCCCC1)Br MCULE-4457572618 [0,1,0,0,0,1|1,0,0]=3 4660 B10R1.363 O=C(O)C1(CCCCC1)Cl MCULE-9172453010 [0,1,0,0,0,1|1,0,0]=3 4661 B10R1.363 O=C(O)C1(CCCCC1)F MCULE-6566089811 [0,1,0,0,0,1|1,0,0]=3 4662 B10R1.363 O=C(O)C1(CCCCC1)O MCULE-8504861268 [0,1,0,0,0,1|1,0,0]=3 4663 B10R1.363 O=C(O)C1(CCCNC1)O MCULE-4880129058 [0,1,0,0,0,1|1,0,0]=3 4664 B10R1.363 O=C(O)C1(CCCNC1)O MCULE-9960592206 [0,1,0,0,0,1|1,0,0]=3 4665 B10R1.363 O=C(O)C1(CCCOC1)F MCULE-8290066035 [0,1,0,0,0,1|0,0,0]=2 4666 B10R1.363 O=C(O)C1(CCNCC1)F MCULE-1312767997 [0,1,0,0,0,1|1,0,0]=3 4667 B10R1.363 O=C(O)C1(CCNCC1)F MCULE-5915477961 [0,1,0,0,0,1|1,0,0]=3 4668 B10R1.363 O=C(O)C1(CCNCC1)O MCULE-4619147711 [0,1,0,0,0,1|1,0,0]=3 4669 B10R1.363 O=C(O)C1(CCNCC1)O MCULE-6538244346 [0,1,0,0,0,1|1,0,0]=3 4670 B10R1.363 O=C(O)C1(CCOCC1)F MCULE-7783441156 [0,1,0,0,0,1|1,0,0]=3 4671 B10R1.363 O=C(O)C1(CCOCC1)O MCULE-4186201239 [0,1,0,0,0,1|1,0,0]=3 4672 B10R1.363 O=C(O)C1(CCSCC1)O MCULE-8230713014 [0,1,0,0,0,1|1,0,0]=3 4673 B10R1.363 [NH3+]C1(CCCCC1)C(=O)O MCULE-1248384499 [0,1,0,0,0,1|1,0,0]=3 4674 B10R1.23 CC(=C1CCCC1)C(=O)O MCULE-3562031446 [0,1,0,0,0,1|1,0,1]=4 4675 B10R1.23 CC(C(=O)O)C1CCCC1 MCULE-5802736245 [0,1,0,0,0,1|1,0,0]=3 4676 B10R1.23 CC(C(=O)O)C1CCCO1 MCULE-7845267101 [0,1,0,0,0,1|0,0,0]=2 4677 B10R1.23 CC(C(=O)O)C1CCOC1 MCULE-7866218529 [0,1,0,0,0,1|2,0,0]=4 4678 B10R1.23 CC(C(=O)O)N1CCCC1 MCULE-1089880160 [0,1,0,0,0,1|2,0,0]=4 4679 B10R1.23 CC(C(=O)O)N1CCCC1 MCULE-6643699902 [0,1,0,0,0,1|2,0,0]=4 4680 B10R1.23 CC(C(=O)O)N1CCCC1 MCULE-9316791928 [0,1,0,0,0,1|2,0,0]=4 4681 B10R1.23 CN(C(=O)Cl)C1CCCC1 MCULE-2941714047 [0,1,0,0,0,1|2,0,0]=4 4682 B10R1.23 C[C@@H](C(=O)O)N1CCCC1 MCULE-3614375066 [0,1,0,0,0,1|2,0,0]=4 4683 B10R1.23 C[C@@H](C(=O)O)N1CCCC1 MCULE-3855579270 [0,1,0,0,0,1|2,0,0]=4 4684 B10R1.23 C[C@H](C(=O)O)N1CCCC1 MCULE-8338161515 [0,1,0,0,0,1|2,0,0]=4 4685 B10R1.23 C[C@H](C(=O)O)N1CCCC1 MCULE-8839356147 [0,1,0,0,0,1|2,0,0]=4 4686 B10R1.23 NC(=O)C(F)C1CCCC1 MCULE-2132325699 [0,1,0,0,0,1|2,0,0]=4 4687 B10R1.23 NC(=O)C(N)C1CCCC1 MCULE-5304987336 [0,1,0,0,0,1|2,0,0]=4 4688 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-7146175523 [0,1,0,0,0,1|1,0,0]=3 4689 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-7746486136 [0,1,0,0,0,1|1,0,0]=3 4690 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-9888348666 [0,1,0,0,0,1|1,0,0]=3 4691 B10R1.23 NC(C(=O)O)C1CCCO1 MCULE-3670924700 [0,1,0,0,0,1|0,0,0]=2 4692 B10R1.23 NC(C(=O)O)C1CCNC1 MCULE-1642984994 [0,1,0,0,0,1|2,0,0]=4 4693 B10R1.23 NC(C(=O)O)C1CCNC1 MCULE-8012924580 [0,1,0,0,0,1|2,0,0]=4 4694 B10R1.23 NC(C(=O)O)C1CCOC1 MCULE-9063647673 [0,1,0,0,0,1|2,0,0]=4 4695 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 MCULE-2078695461 [0,1,0,0,0,1|1,0,0]=3 4696 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 MCULE-7548517913 [0,1,0,0,0,1|1,0,0]=3 4697 B10R1.23 N[C@H](C(=O)O)C1CCCC1 MCULE-1391706498 [0,1,0,0,0,1|1,0,0]=3 4698 B10R1.23 N[C@H](C(=O)O)C1CCCC1 MCULE-5447481000 [0,1,0,0,0,1|1,0,0]=3 4699 B10R1.23 O=C(O)C(=C1CCCC1)F MCULE-7724617873 [0,1,0,0,0,1|1,0,1]=4 4700 B10R1.23 O=C(O)C(=C1CCCC1)S MCULE-2991118664 [0,1,0,0,0,1|1,0,1]=4 4701 B10R1.23 O=C(O)C(=O)C1CCCC1 MCULE-3971745471 [0,1,0,0,0,1|1,0,0]=3 4702 B10R1.23 O=C(O)C(=O)C1CCOC1 MCULE-9419104810 [0,1,0,0,0,1|2,0,0]=4 4703 B10R1.23 O=C(O)C(=O)N1CCCC1 MCULE-9901176707 [0,1,0,0,0,1|2,0,0]=4 4704 B10R1.23 O=C(O)C(Br)C1CCCC1 MCULE-1051918450 [0,1,0,0,0,1|1,0,0]=3 4705 B10R1.23 O=C(O)C(F)C1CCCC1 MCULE-8637303916 [0,1,0,0,0,1|1,0,0]=3 4706 B10R1.23 O=C(O)C(F)C1CCOC1 MCULE-4380204267 [0,1,0,0,0,1|2,0,0]=4 4707 B10R1.23 O=C(O)C(O)C1CCCC1 MCULE-1471598195 [0,1,0,0,0,1|1,0,0]=3 4708 B10R1.23 O=C(O)C(O)C1CCNC1 MCULE-8304713060 [0,1,0,0,0,1|2,0,0]=4 4709 B10R1.23 O=C(O)[C@@H](Br)C1CCCC1 MCULE-6560406332 [0,1,0,0,0,1|1,0,0]=3 4710 B10R1.23 O=C(O)[C@H](O)C1CCCC1 MCULE-1883242923 [0,1,0,0,0,1|1,0,0]=3 4711 B10R1.23 O=C([O-])C(=O)C1CCCC1 MCULE-7060762433 [0,1,0,0,0,1|1,0,1]=4 4712 B10R1.27 C#CC(=O)NC1CCCC1 MCULE-2250062580 [0,1,0,0,0,1|2,0,0]=4 4713 B10R1.27 C=CC(=O)NC1CCCC1 MCULE-7763559152 [0,1,0,0,0,1|2,0,0]=4 4714 B10R1.27 CNC(=O)NC1CCCC1 MCULE-2695826124 [0,1,0,0,0,1|2,0,0]=4 4715 B10R1.27 COC(=O)/C=C/1\CCCN1 MCULE-9234856543 [0,1,0,0,0,1|1,0,1]=4 4716 B10R1.27 COC(=O)C=C1CCCC1 MCULE-7918747282 [0,1,0,0,0,1|1,0,1]=4 4717 B10R1.27 COC(=O)C=C1CCCN1 MCULE-8409180030 [0,1,0,0,0,1|1,0,1]=4 4718 B10R1.27 COC(=O)CC1=CCCC1 MCULE-8638739617 [0,1,0,0,0,1|1,0,1]=4 4719 B10R1.27 COC(=O)CC1CCCC1 MCULE-9342597891 [0,1,0,0,0,1|1,0,0]=3 4720 B10R1.27 COC(=O)CC1CCCN1 MCULE-5803935472 [0,1,0,0,0,1|1,0,0]=3 4721 B10R1.27 COC(=O)CC1CCCN1 MCULE-8428971594 [0,1,0,0,0,1|1,0,0]=3 4722 B10R1.27 COC(=O)CC1CCCN1 MCULE-8962564154 [0,1,0,0,0,1|1,0,0]=3 4723 B10R1.27 COC(=O)CC1CCCN1 MCULE-9463345165 [0,1,0,0,0,1|1,0,0]=3 4724 B10R1.27 COC(=O)CC1CCCO1 MCULE-5045576239 [0,1,0,0,0,1|0,0,0]=2 4725 B10R1.27 COC(=O)CC1CCNC1 MCULE-1335311848 [0,1,0,0,0,1|2,0,0]=4 4726 B10R1.27 COC(=O)CC1CCNC1 MCULE-1342941310 [0,1,0,0,0,1|2,0,0]=4 4727 B10R1.27 COC(=O)CC1CCOC1 MCULE-5503781159 [0,1,0,0,0,1|2,0,0]=4 4728 B10R1.27 COC(=O)CC1OCCO1 MCULE-1011128337 [0,1,0,0,0,1|1,0,0]=3 4729 B10R1.27 COC(=O)CN1CCCC1 MCULE-6435350712 [0,1,0,0,0,1|2,0,0]=4 4730 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-3432361428 [0,1,0,0,0,1|1,0,0]=3 4731 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-4923467879 [0,1,0,0,0,1|1,0,0]=3 4732 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-7489755473 [0,1,0,0,0,1|1,0,0]=3 4733 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-9818066506 [0,1,0,0,0,1|1,0,0]=3 4734 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-2278430991 [0,1,0,0,0,1|2,0,0]=4 4735 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-7607667453 [0,1,0,0,0,1|2,0,0]=4 4736 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-7633055222 [0,1,0,0,0,1|2,0,0]=4 4737 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-8491722899 [0,1,0,0,0,1|2,0,0]=4 4738 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-3400926095 [0,1,0,0,0,1|1,0,0]=3 4739 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-3995901791 [0,1,0,0,0,1|1,0,0]=3 4740 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-6386262688 [0,1,0,0,0,1|1,0,0]=3 4741 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-9243040577 [0,1,0,0,0,1|1,0,0]=3 4742 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-2917470545 [0,1,0,0,0,1|2,0,0]=4 4743 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-4018086942 [0,1,0,0,0,1|2,0,0]=4 4744 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-5775187737 [0,1,0,0,0,1|2,0,0]=4 4745 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-6881593954 [0,1,0,0,0,1|2,0,0]=4 4746 B10R1.27 COC(=O)NC1CCNC1 MCULE-6293446949 [0,1,0,0,0,1|2,0,0]=4 4747 B10R1.27 COC(=O)NC1CCNC1 MCULE-9989519789 [0,1,0,0,0,1|2,0,0]=4 4748 B10R1.27 COC(=O)N[C@H]1CCNC1 MCULE-1532656229 [0,1,0,0,0,1|2,0,0]=4 4749 B10R1.27 COC(=O)N[C@H]1CCNC1 MCULE-5746263150 [0,1,0,0,0,1|2,0,0]=4 4750 B10R1.27 CSC(=O)NC1CCCC1 MCULE-6446995725 [0,1,0,0,0,1|1,1,0]=4 4751 B10R1.27 N/C(=N/O)/CC1CCCC1 MCULE-5747462847 [0,1,0,0,0,1|2,0,0]=4 4752 B10R1.27 N/C(=N\O)/CC1CCCO1 MCULE-5663324435 [0,1,0,0,0,1|1,0,0]=3 4753 B10R1.27 N/C(=N\O)/NC1CCCC1 MCULE-6095099341 [0,1,0,0,0,1|2,0,0]=4 4754 B10R1.27 NC(CO)CC1CCCO1 MCULE-7544199811 [0,1,0,0,0,1|1,0,1]=4 4755 B10R1.27 NCC(=O)NC1CCCC1 MCULE-8019469442 [0,1,0,0,0,1|2,0,0]=4 4756 B10R1.27 NCC(=O)NC1CCCC1 MCULE-9069112041 [0,1,0,0,0,1|2,0,0]=4 4757 B10R1.27 NCC(=O)OC1CCCC1 MCULE-1154585388 [0,1,0,0,0,1|2,0,0]=4 4758 B10R1.27 NCC(=O)OC1CCCC1 MCULE-1593823295 [0,1,0,0,0,1|2,0,0]=4 4759 B10R1.27 NNC(=O)CC1CCCC1 MCULE-6266427637 [0,1,0,0,0,1|2,0,0]=4 4760 B10R1.27 NNC(=O)CC1CCCO1 MCULE-5795900293 [0,1,0,0,0,1|1,0,0]=3 4761 B10R1.27 NNC(=O)NC1CCCC1 MCULE-7539809331 [0,1,0,0,0,1|2,0,0]=4 4762 B10R1.27 O=C(CBr)NC1CCCC1 MCULE-2668842219 [0,1,0,0,0,1|2,0,0]=4 4763 B10R1.27 O=C(CBr)OC1CCCC1 MCULE-5564146232 [0,1,0,0,0,1|2,0,0]=4 4764 B10R1.27 O=C(CCl)NC1CCCC1 MCULE-9222556805 [0,1,0,0,0,1|2,0,0]=4 4765 B10R1.27 O=C(CCl)OC1CCCC1 MCULE-1042320720 [0,1,0,0,0,1|2,0,0]=4 4766 B10R1.27 O=C(CO)NC1CCCC1 MCULE-7488310244 [0,1,0,0,0,1|1,0,0]=3 4767 B10R1.27 O=C(CO)OC1CCOC1 MCULE-1321570069 [0,1,0,0,0,1|2,0,0]=4 4768 B10R1.27 O=C(NO)OC1CCCC1 MCULE-8628794772 [0,1,0,0,0,1|1,0,0]=3 4769 B10R1.54 CC1CCC(C1)CC(=O)O MCULE-2712956835 [0,1,0,0,0,1|1,0,0]=3 4770 B10R1.54 CC1CCC(O1)CC(=O)O MCULE-8857014749 [0,1,0,0,0,1|0,0,0]=2 4771 B10R1.54 CC1CCN(C1)CC(=O)O MCULE-1407049911 [0,1,0,0,0,1|2,0,0]=4 4772 B10R1.54 CC1CCN(C1)CC(=O)O MCULE-9097138381 [0,1,0,0,0,1|2,0,0]=4 4773 B10R1.54 CN1CCC(C1)CC(=O)O MCULE-6518175603 [0,1,0,0,0,1|2,0,0]=4 4774 B10R1.54 CN1CCC(C1)CC(=O)O MCULE-7858558191 [0,1,0,0,0,1|2,0,0]=4 4775 B10R1.54 NC1CCN(C1)CC(=O)O MCULE-5943171118 [0,1,0,0,0,1|2,0,0]=4 4776 B10R1.54 NC1CCN(C1)CC(=O)O MCULE-9229773679 [0,1,0,0,0,1|2,0,0]=4 4777 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-2161728364 [0,1,0,0,0,1|2,0,0]=4 4778 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-8593996404 [0,1,0,0,0,1|2,0,0]=4 4779 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-8985734275 [0,1,0,0,0,1|2,0,0]=4 4780 B10R1.54 N[C@H]1CCN(C1)CC(=O)O MCULE-1503909439 [0,1,0,0,0,1|2,0,0]=4 4781 B10R1.54 N[C@H]1CCN(C1)CC(=O)O MCULE-6977922157 [0,1,0,0,0,1|2,0,0]=4 4782 B10R1.54 O=C(O)CC1CC(CN1)O MCULE-7161298106 [0,1,0,0,0,1|1,0,0]=3 4783 B10R1.54 O=C(O)CC1CC(CN1)O MCULE-8476180516 [0,1,0,0,0,1|1,0,0]=3 4784 B10R1.54 O=C(O)CC1CCC(=O)C1 MCULE-8065311815 [0,1,0,0,0,1|1,0,1]=4 4785 B10R1.54 O=C(O)CC1CCC(=O)N1 MCULE-4378271581 [0,1,0,0,0,1|1,0,1]=4 4786 B10R1.54 O=C(O)CC1CCC(=O)O1 MCULE-3722776234 [0,1,0,0,0,1|0,0,1]=3 4787 B10R1.54 O=C(O)CC1CCC(C1)O MCULE-1306554926 [0,1,0,0,0,1|1,0,0]=3 4788 B10R1.54 O=C(O)CN1CCC(C1)Br MCULE-3288536521 [0,1,0,0,0,1|2,0,0]=4 4789 B10R1.54 O=C(O)CN1CCC(C1)Cl MCULE-1930405641 [0,1,0,0,0,1|2,0,0]=4 4790 B10R1.54 O=C(O)CN1CCC(C1)I MCULE-4537982496 [0,1,0,0,0,1|2,0,0]=4 4791 B10R1.54 O=C(O)CN1CCC(C1)O MCULE-7707471649 [0,1,0,0,0,1|2,0,0]=4 4792 B10R1.54 O=C(O)CN1CCC(C1)O MCULE-8936002282 [0,1,0,0,0,1|2,0,0]=4 4793 B10R1.54 O=C(O)CN1CC[C@@H](C1)O MCULE-1249814394 [0,1,0,0,0,1|2,0,0]=4 4794 B10R1.54 O=C(O)CN1CC[C@@H](C1)O MCULE-2140738871 [0,1,0,0,0,1|2,0,0]=4 4795 B10R1.54 O=C(O)CN1CC[C@H](C1)O MCULE-4416769889 [0,1,0,0,0,1|2,0,0]=4 4796 B10R1.54 O=C(O)CN1CC[C@H](C1)O MCULE-4926367147 [0,1,0,0,0,1|2,0,0]=4 4797 B10R1.54 O=C(O)C[C@@H]1CC(CN1)O MCULE-5520496479 [0,1,0,0,0,1|1,0,0]=3 4798 B10R1.54 O=C(O)C[C@@H]1CC(CN1)O MCULE-9606256613 [0,1,0,0,0,1|1,0,0]=3 4799 B10R1.54 O=C(O)C[C@@H]1CCC(=O)N1 MCULE-2294433482 [0,1,0,0,0,1|1,0,1]=4 4800 B10R1.54 O=C(O)C[C@@H]1CCC(=O)N1 MCULE-6637712682 [0,1,0,0,0,1|1,0,1]=4 4801 B10R1.54 O=C(O)C[C@@H]1CC[C@@H](C1)O MCULE-2394601749 [0,1,0,0,0,1|1,0,0]=3 4802 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-1516021519 [0,1,0,0,0,1|1,0,0]=3 4803 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-4246846585 [0,1,0,0,0,1|1,0,0]=3 4804 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-5090681884 [0,1,0,0,0,1|1,0,0]=3 4805 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-6554402545 [0,1,0,0,0,1|1,0,0]=3 4806 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-8720083389 [0,1,0,0,0,1|1,0,0]=3 4807 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-9359661762 [0,1,0,0,0,1|1,0,0]=3 4808 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 MCULE-1700675888 [0,1,0,0,0,1|1,0,1]=4 4809 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 MCULE-3179723751 [0,1,0,0,0,1|1,0,1]=4 4810 B10R1.54 O=C(O)C[C@H]1CCC(=O)N1 MCULE-1080082151 [0,1,0,0,0,1|1,0,1]=4 4811 B10R1.54 O=C(O)C[C@H]1CCC(=O)N1 MCULE-2947978966 [0,1,0,0,0,1|1,0,1]=4 4812 B10R1.64 CC(=O)N[C@@H]1CCC[C@H]1F MCULE-5761457763 [0,1,0,0,0,1|2,0,0]=4 4813 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O MCULE-6420976383 [0,1,0,0,0,1|2,0,0]=4 4814 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O MCULE-9888711851 [0,1,0,0,0,1|2,0,0]=4 4815 B10R1.64 CC(=O)O[C@@H]1CCC[C@H]1O MCULE-7895175018 [0,1,0,0,0,1|2,0,0]=4 4816 B10R1.64 CC1CCCC1CC(=O)O MCULE-1034129697 [0,1,0,0,0,1|1,0,0]=3 4817 B10R1.64 CC1CCCN1CC(=O)O MCULE-5477147476 [0,1,0,0,0,1|2,0,0]=4 4818 B10R1.64 CC1CCCN1CC(=O)O MCULE-7787437864 [0,1,0,0,0,1|2,0,0]=4 4819 B10R1.64 CC1OCCC1CC(=O)O MCULE-3630286814 [0,1,0,0,0,1|2,0,0]=4 4820 B10R1.64 CN1CCCC1CC(=O)O MCULE-1900515698 [0,1,0,0,0,1|1,0,0]=3 4821 B10R1.64 CN1CCCC1CC(=O)O MCULE-4392051296 [0,1,0,0,0,1|1,0,0]=3 4822 B10R1.64 CN1CCC[C@H]1CC(=O)O MCULE-2926738632 [0,1,0,0,0,1|1,0,0]=3 4823 B10R1.64 NC(=O)NC1CCCC1=O MCULE-8760589602 [0,1,0,0,0,1|2,0,0]=4 4824 B10R1.64 NC1CCCC1CC(=O)O MCULE-7275948763 [0,1,0,0,0,1|1,0,0]=3 4825 B10R1.64 NC1CCCC1CC(=O)O MCULE-7852876693 [0,1,0,0,0,1|1,0,0]=3 4826 B10R1.64 O=C(Cl)CC1CCCC1=O MCULE-7029776897 [0,1,0,0,0,1|2,0,0]=4 4827 B10R1.64 O=C(O)C=C1CCCC1=O MCULE-4459153895 [0,1,0,0,0,1|1,0,1]=4 4828 B10R1.64 O=C(O)CC1CCCC1=O MCULE-9371811615 [0,1,0,0,0,1|1,0,0]=3 4829 B10R1.64 O=C(O)CC1CCNC1=O MCULE-4096969007 [0,1,0,0,0,1|2,0,0]=4 4830 B10R1.64 O=C(O)CN1CCCC1=O MCULE-3122232316 [0,1,0,0,0,1|2,0,0]=4 4831 B10R1.281 NS(=O)(=O)CC1CCCO1 MCULE-1838141979 [0,1,0,0,0,1|1,0,1]=4 4832 B10R1.281 O=S(=O)(Cl)CC1CCCO1 MCULE-4744911575 [0,1,0,0,0,1|1,0,1]=4 4833 B10R1.370 CC(=O)CC1(OCCO1)C MCULE-7083031493 [0,1,0,0,0,1|2,0,0]=4 4834 B10R1.370 CC1(CCCC1)CC(=O)O MCULE-4967984413 [0,1,0,0,0,1|1,0,0]=3 4835 B10R1.370 CC1(CCCO1)NC(=S)N MCULE-9804632779 [0,1,0,0,0,1|1,1,0]=4 4836 B10R1.370 CC1(OCCO1)CC(=O)N MCULE-9299031360 [0,1,0,0,0,1|2,0,0]=4 4837 B10R1.370 CC1(OCCO1)CC(=O)O MCULE-8187059716 [0,1,0,0,0,1|1,0,0]=3 4838 B10R1.370 CC1(OCCO1)CC(=O)[O-] MCULE-9902021150 [0,1,0,0,0,1|1,0,1]=4 4839 B10R1.370 NC1(CCCC1)CC(=O)O MCULE-5280016961 [0,1,0,0,0,1|1,0,0]=3 4840 B10R1.370 NC1(CCCC1)CC(=O)O MCULE-8706705761 [0,1,0,0,0,1|1,0,0]=3 4841 B10R1.370 NC1(CCSC1)CC(=O)O MCULE-1913904908 [0,1,0,0,0,1|2,0,0]=4 4842 B10R1.370 O=C(O)CC1(CCCC1)O MCULE-7504539994 [0,1,0,0,0,1|1,0,0]=3 4843 B10R1.370 O=C(O)CC1(CCOC1)O MCULE-7553623965 [0,1,0,0,0,1|2,0,0]=4 4844 B10R1.6 CC(C)(CO)C1CCCO1 MCULE-1826139434 [0,2,0,0,0,0|1,0,1]=4 4845 B10R1.9 COC(C=O)C1CCCC1 MCULE-2957450469 [0,2,0,0,0,0|1,0,1]=4 4846 B10R1.9 COC(CN)C1CCCO1 MCULE-2792788133 [0,2,0,0,0,0|1,0,1]=4 4847 B10R1.11 CCCC(=O)C1CCCC1 MCULE-4828860258 [0,2,0,0,0,0|2,0,0]=4 4848 B10R1.11 CCNC(=O)C1CCCN1 MCULE-8506501038 [0,2,0,0,0,0|2,0,0]=4 4849 B10R1.11 CCNC(=O)C1CCCN1 MCULE-9698842836 [0,2,0,0,0,0|2,0,0]=4 4850 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-3926288586 [0,2,0,0,0,0|2,0,0]=4 4851 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-4770991359 [0,2,0,0,0,0|2,0,0]=4 4852 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-8041890978 [0,2,0,0,0,0|2,0,0]=4 4853 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-9049907771 [0,2,0,0,0,0|2,0,0]=4 4854 B10R1.11 CCOC(=O)C1=CCCC1 MCULE-9883764892 [0,2,0,0,0,0|1,0,1]=4 4855 B10R1.11 CCOC(=O)C1=CCCO1 MCULE-8425258509 [0,2,0,0,0,0|0,0,2]=4 4856 B10R1.11 CCOC(=O)C1=NCCO1 MCULE-5791120104 [0,2,0,0,0,0|1,0,1]=4 4857 B10R1.11 CCOC(=O)C1CCC=N1 MCULE-6045177128 [0,2,0,0,0,0|1,0,1]=4 4858 B10R1.11 CCOC(=O)C1CCCC1 MCULE-2663692680 [0,2,0,0,0,0|1,0,0]=3 4859 B10R1.11 CCOC(=O)C1CCCN1 MCULE-1775024232 [0,2,0,0,0,0|1,0,0]=3 4860 B10R1.11 CCOC(=O)C1CCCN1 MCULE-1903883256 [0,2,0,0,0,0|1,0,0]=3 4861 B10R1.11 CCOC(=O)C1CCCN1 MCULE-3451901294 [0,2,0,0,0,0|1,0,0]=3 4862 B10R1.11 CCOC(=O)C1CCCN1 MCULE-7141672180 [0,2,0,0,0,0|1,0,0]=3 4863 B10R1.11 CCOC(=O)C1CCCO1 MCULE-5716361491 [0,2,0,0,0,0|0,0,0]=2 4864 B10R1.11 CCOC(=O)C1CCNC1 MCULE-7115213916 [0,2,0,0,0,0|2,0,0]=4 4865 B10R1.11 CCOC(=O)C1CCNC1 MCULE-9152531741 [0,2,0,0,0,0|2,0,0]=4 4866 B10R1.11 CCOC(=O)C1CCNC1 MCULE-9679994536 [0,2,0,0,0,0|2,0,0]=4 4867 B10R1.11 CCOC(=O)C1CCNO1 MCULE-1209750622 [0,2,0,0,0,0|1,0,0]=3 4868 B10R1.11 CCOC(=O)C1CCNO1 MCULE-9991760871 [0,2,0,0,0,0|1,0,0]=3 4869 B10R1.11 CCOC(=O)C1CCOC1 MCULE-3052876388 [0,2,0,0,0,0|2,0,0]=4 4870 B10R1.11 CCOC(=O)C1CSCN1 MCULE-6252748544 [0,2,0,0,0,0|2,0,0]=4 4871 B10R1.11 CCOC(=O)C1CSCN1 MCULE-6823622066 [0,2,0,0,0,0|2,0,0]=4 4872 B10R1.11 CCOC(=O)C1CSCN1 MCULE-8253189538 [0,2,0,0,0,0|2,0,0]=4 4873 B10R1.11 CCOC(=O)C1CSCN1 MCULE-9110164814 [0,2,0,0,0,0|2,0,0]=4 4874 B10R1.11 CCOC(=O)C1SCCS1 MCULE-2057673965 [0,2,0,0,0,0|1,1,0]=4 4875 B10R1.11 CCOC(=O)N1CCCC1 MCULE-8096151948 [0,2,0,0,0,0|2,0,0]=4 4876 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-1006300490 [0,2,0,0,0,0|1,0,0]=3 4877 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-1035245823 [0,2,0,0,0,0|1,0,0]=3 4878 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-9416117855 [0,2,0,0,0,0|1,0,0]=3 4879 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-9593799755 [0,2,0,0,0,0|1,0,0]=3 4880 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-1030296291 [0,2,0,0,0,0|2,0,0]=4 4881 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-3397421108 [0,2,0,0,0,0|2,0,0]=4 4882 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-6990100207 [0,2,0,0,0,0|2,0,0]=4 4883 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-9366097368 [0,2,0,0,0,0|2,0,0]=4 4884 B10R1.11 CCOC(=O)[C@@H]1CCON1 MCULE-3729113893 [0,2,0,0,0,0|2,0,0]=4 4885 B10R1.11 CCOC(=O)[C@@H]1CCON1 MCULE-6736733188 [0,2,0,0,0,0|2,0,0]=4 4886 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-4756168618 [0,2,0,0,0,0|2,0,0]=4 4887 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-8756699166 [0,2,0,0,0,0|2,0,0]=4 4888 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-8987874947 [0,2,0,0,0,0|2,0,0]=4 4889 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-9514058691 [0,2,0,0,0,0|2,0,0]=4 4890 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-2328365610 [0,2,0,0,0,0|1,0,0]=3 4891 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-5190774028 [0,2,0,0,0,0|1,0,0]=3 4892 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-5314111018 [0,2,0,0,0,0|1,0,0]=3 4893 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-5778937284 [0,2,0,0,0,0|1,0,0]=3 4894 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-6332593882 [0,2,0,0,0,0|2,0,0]=4 4895 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-7146498882 [0,2,0,0,0,0|2,0,0]=4 4896 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-7300719682 [0,2,0,0,0,0|2,0,0]=4 4897 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-9965557527 [0,2,0,0,0,0|2,0,0]=4 4898 B10R1.11 CCOC(=O)[C@H]1CCON1 MCULE-2197016826 [0,2,0,0,0,0|2,0,0]=4 4899 B10R1.11 CCOC(=O)[C@H]1CCON1 MCULE-8879475586 [0,2,0,0,0,0|2,0,0]=4 4900 B10R1.11 COCC(=O)C1CCCC1 MCULE-3230477016 [0,2,0,0,0,0|1,0,0]=3 4901 B10R1.11 COCC(N)C1CCCO1 MCULE-3120077776 [0,2,0,0,0,0|1,0,1]=4 4902 B10R1.11 N#CCC(=O)C1CCCC1 MCULE-9734422429 [0,2,0,0,0,0|2,0,0]=4 4903 B10R1.11 N#CCC(=O)C1CCCO1 MCULE-5555613403 [0,2,0,0,0,0|1,0,0]=3 4904 B10R1.11 O=C(OCCl)C1CCCC1 MCULE-8357474598 [0,2,0,0,0,0|1,0,0]=3 4905 B10R1.11 O=C(OCCl)N1CCCC1 MCULE-8634733063 [0,2,0,0,0,0|2,0,0]=4 4906 B10R1.14 C1(CCC(=O)C1)C(=O)OC MCULE-8334918383 [0,2,0,0,0,0|1,0,1]=4 4907 B10R1.14 C1(CCC(=O)N1)C(=O)OC MCULE-5897242243 [0,2,0,0,0,0|1,0,1]=4 4908 B10R1.14 C=C1CNC(C1)C(=O)OC MCULE-4635683717 [0,2,0,0,0,0|1,0,1]=4 4909 B10R1.14 C=C1CNC(C1)C(=O)OC MCULE-9917502383 [0,2,0,0,0,0|1,0,1]=4 4910 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-2960661877 [0,2,0,0,0,0|1,0,1]=4 4911 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-3356870567 [0,2,0,0,0,0|1,0,1]=4 4912 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-5709460460 [0,2,0,0,0,0|1,0,1]=4 4913 B10R1.14 C=C1CN[C@@H](C1)C(=O)OC MCULE-5969395974 [0,2,0,0,0,0|1,0,1]=4 4914 B10R1.14 CNC(=O)[C@@H]1CC[C@@H](C1)N MCULE-2223613184 [0,2,0,0,0,0|2,0,0]=4 4915 B10R1.14 CNC(=O)[C@@H]1CC[C@@H](C1)N MCULE-6627777957 [0,2,0,0,0,0|2,0,0]=4 4916 B10R1.14 CNC(=O)[C@@H]1CC[C@H](C1)N MCULE-1661578120 [0,2,0,0,0,0|2,0,0]=4 4917 B10R1.14 CNC(=O)[C@@H]1CC[C@H](C1)N MCULE-3597072221 [0,2,0,0,0,0|2,0,0]=4 4918 B10R1.14 CNC(=O)[C@@H]1CC[C@H](C1)N MCULE-3658690331 [0,2,0,0,0,0|2,0,0]=4 4919 B10R1.14 CNC(=O)[C@@H]1CC[C@H](C1)N MCULE-3781359466 [0,2,0,0,0,0|2,0,0]=4 4920 B10R1.14 COC(=O)C1=CC(CC1)Br MCULE-1238300320 [0,2,0,0,0,0|1,0,1]=4 4921 B10R1.14 COC(=O)C1=CCC(C1)N MCULE-4586199794 [0,2,0,0,0,0|1,0,1]=4 4922 B10R1.14 COC(=O)C1=CCC(C1)N MCULE-7071775065 [0,2,0,0,0,0|1,0,1]=4 4923 B10R1.14 COC(=O)C1=NCC(O1)C MCULE-3600834352 [0,2,0,0,0,0|1,0,1]=4 4924 B10R1.14 COC(=O)C1C=CC(C1)N MCULE-8756402825 [0,2,0,0,0,0|1,0,1]=4 4925 B10R1.14 COC(=O)C1C=CC(C1)N MCULE-9562522468 [0,2,0,0,0,0|1,0,1]=4 4926 B10R1.14 COC(=O)C1CC(=NO1)C MCULE-8323085311 [0,2,0,0,0,0|1,0,1]=4 4927 B10R1.14 COC(=O)C1CC(=O)CO1 MCULE-2471814999 [0,2,0,0,0,0|0,0,1]=3 4928 B10R1.14 COC(=O)C1CC(CN1)F MCULE-4224631815 [0,2,0,0,0,0|1,0,0]=3 4929 B10R1.14 COC(=O)C1CC(CN1)F MCULE-4763890845 [0,2,0,0,0,0|1,0,0]=3 4930 B10R1.14 COC(=O)C1CC(CN1)O MCULE-7417308251 [0,2,0,0,0,0|1,0,0]=3 4931 B10R1.14 COC(=O)C1CC(CN1)O MCULE-8127150549 [0,2,0,0,0,0|1,0,0]=3 4932 B10R1.14 COC(=O)C1CC(CN1)S MCULE-6804443263 [0,2,0,0,0,0|1,0,0]=3 4933 B10R1.14 COC(=O)C1CC(CN1)S MCULE-7952444114 [0,2,0,0,0,0|1,0,0]=3 4934 B10R1.14 COC(=O)C1CCC(=O)C1 MCULE-5952382453 [0,2,0,0,0,0|1,0,1]=4 4935 B10R1.14 COC(=O)C1CCC(=O)N1 MCULE-2849406517 [0,2,0,0,0,0|1,0,1]=4 4936 B10R1.14 COC(=O)C1CCC(=O)O1 MCULE-7228187740 [0,2,0,0,0,0|0,0,1]=3 4937 B10R1.14 COC(=O)C1CCC(=S)N1 MCULE-8993064502 [0,2,0,0,0,0|1,0,1]=4 4938 B10R1.14 COC(=O)C1CCC(C1)Br MCULE-4292905898 [0,2,0,0,0,0|1,0,0]=3 4939 B10R1.14 COC(=O)C1CCC(C1)N MCULE-2002050883 [0,2,0,0,0,0|1,0,0]=3 4940 B10R1.14 COC(=O)C1CCC(C1)N MCULE-6014010462 [0,2,0,0,0,0|1,0,0]=3 4941 B10R1.14 COC(=O)C1CCC(C1)O MCULE-3475456621 [0,2,0,0,0,0|1,0,0]=3 4942 B10R1.14 COC(=O)C1CCN(C1)C MCULE-5692618208 [0,2,0,0,0,0|2,0,0]=4 4943 B10R1.14 COC(=O)C1CNC(=O)O1 MCULE-2096777093 [0,2,0,0,0,0|1,0,1]=4 4944 B10R1.14 COC(=O)N1CCC(C1)N MCULE-1748944608 [0,2,0,0,0,0|2,0,0]=4 4945 B10R1.14 COC(=O)N1CCC(C1)N MCULE-9370919534 [0,2,0,0,0,0|2,0,0]=4 4946 B10R1.14 COC(=O)N1CCC(C1)O MCULE-8351013000 [0,2,0,0,0,0|2,0,0]=4 4947 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-1557955760 [0,2,0,0,0,0|1,0,1]=4 4948 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-2633681768 [0,2,0,0,0,0|1,0,1]=4 4949 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-2703106736 [0,2,0,0,0,0|1,0,1]=4 4950 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-3357403391 [0,2,0,0,0,0|1,0,1]=4 4951 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-3901735991 [0,2,0,0,0,0|1,0,1]=4 4952 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-4745884762 [0,2,0,0,0,0|1,0,1]=4 4953 B10R1.14 COC(=O)[C@@H]1C=C[C@@H](C1)N MCULE-8470117371 [0,2,0,0,0,0|1,0,1]=4 4954 B10R1.14 COC(=O)[C@@H]1CC(CN1)O MCULE-1283857272 [0,2,0,0,0,0|1,0,0]=3 4955 B10R1.14 COC(=O)[C@@H]1CC(CN1)O MCULE-1946068889 [0,2,0,0,0,0|1,0,0]=3 4956 B10R1.14 COC(=O)[C@@H]1CCC(=N1)S MCULE-7178838444 [0,2,0,0,0,0|1,0,1]=4 4957 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 MCULE-7952909342 [0,2,0,0,0,0|1,0,1]=4 4958 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 MCULE-8638772412 [0,2,0,0,0,0|1,0,1]=4 4959 B10R1.14 COC(=O)[C@@H]1CCC(=O)N1 MCULE-6776274122 [0,2,0,0,0,0|1,0,1]=4 4960 B10R1.14 COC(=O)[C@@H]1CCC(=O)N1 MCULE-8837580582 [0,2,0,0,0,0|1,0,1]=4 4961 B10R1.14 COC(=O)[C@@H]1CCC(=O)O1 MCULE-7346796735 [0,2,0,0,0,0|0,0,1]=3 4962 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)N MCULE-5290595526 [0,2,0,0,0,0|1,0,0]=3 4963 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)N MCULE-5583492414 [0,2,0,0,0,0|1,0,0]=3 4964 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)N MCULE-7887655347 [0,2,0,0,0,0|1,0,0]=3 4965 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)N MCULE-8575060963 [0,2,0,0,0,0|1,0,0]=3 4966 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)O MCULE-2058582855 [0,2,0,0,0,0|1,0,0]=3 4967 B10R1.14 COC(=O)[C@@H]1CC[C@@H](C1)O MCULE-5432347510 [0,2,0,0,0,0|1,0,0]=3 4968 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)N MCULE-1643472314 [0,2,0,0,0,0|1,0,0]=3 4969 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)N MCULE-1990922940 [0,2,0,0,0,0|1,0,0]=3 4970 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)N MCULE-6782857130 [0,2,0,0,0,0|1,0,0]=3 4971 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)N MCULE-9884963881 [0,2,0,0,0,0|1,0,0]=3 4972 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)O MCULE-1118474224 [0,2,0,0,0,0|1,0,0]=3 4973 B10R1.14 COC(=O)[C@@H]1CC[C@H](C1)O MCULE-9373995272 [0,2,0,0,0,0|1,0,0]=3 4974 B10R1.14 COC(=O)[C@@H]1CNC(=O)O1 MCULE-1667021734 [0,2,0,0,0,0|1,0,1]=4 4975 B10R1.14 COC(=O)[C@@H]1CNC(=O)O1 MCULE-9531113453 [0,2,0,0,0,0|1,0,1]=4 4976 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)C MCULE-2144317031 [0,2,0,0,0,0|1,0,0]=3 4977 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)C MCULE-9538905492 [0,2,0,0,0,0|1,0,0]=3 4978 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)Cl MCULE-7224874385 [0,2,0,0,0,0|1,0,0]=3 4979 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)F MCULE-2546063017 [0,2,0,0,0,0|1,0,0]=3 4980 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)F MCULE-4253971232 [0,2,0,0,0,0|1,0,0]=3 4981 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)F MCULE-6284746395 [0,2,0,0,0,0|1,0,0]=3 4982 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)F MCULE-9565417654 [0,2,0,0,0,0|1,0,0]=3 4983 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-5518895757 [0,2,0,0,0,0|1,0,0]=3 4984 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-5601019886 [0,2,0,0,0,0|1,0,0]=3 4985 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-7806570596 [0,2,0,0,0,0|1,0,0]=3 4986 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)O MCULE-9487428732 [0,2,0,0,0,0|1,0,0]=3 4987 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)Cl MCULE-6914923278 [0,2,0,0,0,0|1,0,0]=3 4988 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)F MCULE-1505289566 [0,2,0,0,0,0|1,0,0]=3 4989 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)F MCULE-4321836109 [0,2,0,0,0,0|1,0,0]=3 4990 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)F MCULE-6390890167 [0,2,0,0,0,0|1,0,0]=3 4991 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)F MCULE-8073196756 [0,2,0,0,0,0|1,0,0]=3 4992 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)N MCULE-5029881504 [0,2,0,0,0,0|1,0,0]=3 4993 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-3617032083 [0,2,0,0,0,0|1,0,0]=3 4994 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-3763938961 [0,2,0,0,0,0|1,0,0]=3 4995 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-4682429159 [0,2,0,0,0,0|1,0,0]=3 4996 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)O MCULE-5777795887 [0,2,0,0,0,0|1,0,0]=3 4997 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)S MCULE-2723747894 [0,2,0,0,0,0|1,0,0]=3 4998 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)S MCULE-2949852995 [0,2,0,0,0,0|1,0,0]=3 4999 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)S MCULE-8089855245 [0,2,0,0,0,0|1,0,0]=3 5000 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)S MCULE-8209870736 [0,2,0,0,0,0|1,0,0]=3 5001 B10R1.14 COC(=O)[C@H]1C=C[C@H](C1)N MCULE-6742670187 [0,2,0,0,0,0|1,0,1]=4 5002 B10R1.14 COC(=O)[C@H]1C=C[C@H](C1)N MCULE-9489158988 [0,2,0,0,0,0|1,0,1]=4 5003 B10R1.14 COC(=O)[C@H]1C=C[C@H](C1)N MCULE-9823471100 [0,2,0,0,0,0|1,0,1]=4 5004 B10R1.14 COC(=O)[C@H]1C=C[C@H](C1)N MCULE-9880567301 [0,2,0,0,0,0|1,0,1]=4 5005 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 MCULE-6859943891 [0,2,0,0,0,0|1,0,1]=4 5006 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 MCULE-7172592478 [0,2,0,0,0,0|1,0,1]=4 5007 B10R1.14 COC(=O)[C@H]1CCC(=O)N1 MCULE-7163955131 [0,2,0,0,0,0|1,0,1]=4 5008 B10R1.14 COC(=O)[C@H]1CCC(=O)N1 MCULE-8190805012 [0,2,0,0,0,0|1,0,1]=4 5009 B10R1.14 COC(=O)[C@H]1CCC(=O)O1 MCULE-2949058133 [0,2,0,0,0,0|0,0,1]=3 5010 B10R1.14 COC(=O)[C@H]1CCC(=O)O1 MCULE-7663400355 [0,2,0,0,0,0|0,0,1]=3 5011 B10R1.14 COC(=O)[C@H]1CCC(=S)N1 MCULE-1412233687 [0,2,0,0,0,0|1,0,1]=4 5012 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)Br MCULE-4639654853 [0,2,0,0,0,0|1,0,0]=3 5013 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)Br MCULE-7552610243 [0,2,0,0,0,0|1,0,0]=3 5014 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)N MCULE-3698760557 [0,2,0,0,0,0|1,0,0]=3 5015 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)N MCULE-6035569341 [0,2,0,0,0,0|1,0,0]=3 5016 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)N MCULE-7728824085 [0,2,0,0,0,0|1,0,0]=3 5017 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)N MCULE-9095267083 [0,2,0,0,0,0|1,0,0]=3 5018 B10R1.14 COC(=O)[C@H]1CC[C@@H](C1)O MCULE-5555455830 [0,2,0,0,0,0|1,0,0]=3 5019 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-1428316255 [0,2,0,0,0,0|1,0,0]=3 5020 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-1825834657 [0,2,0,0,0,0|1,0,0]=3 5021 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-2834462513 [0,2,0,0,0,0|1,0,0]=3 5022 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-5809473178 [0,2,0,0,0,0|1,0,0]=3 5023 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-6051273141 [0,2,0,0,0,0|1,0,0]=3 5024 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)N MCULE-6835025811 [0,2,0,0,0,0|1,0,0]=3 5025 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)O MCULE-5194030962 [0,2,0,0,0,0|1,0,0]=3 5026 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)O MCULE-9211450556 [0,2,0,0,0,0|1,0,0]=3 5027 B10R1.14 COC(=O)[C@H]1CC[C@H](C1)O MCULE-9901379045 [0,2,0,0,0,0|1,0,0]=3 5028 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)F MCULE-1760326276 [0,2,0,0,0,0|1,0,0]=3 5029 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)F MCULE-5699214877 [0,2,0,0,0,0|1,0,0]=3 5030 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)F MCULE-8843462982 [0,2,0,0,0,0|1,0,0]=3 5031 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)F MCULE-8997204113 [0,2,0,0,0,0|1,0,0]=3 5032 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)N MCULE-2819941028 [0,2,0,0,0,0|1,0,0]=3 5033 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-1245408761 [0,2,0,0,0,0|1,0,0]=3 5034 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-3057383638 [0,2,0,0,0,0|1,0,0]=3 5035 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-4148644588 [0,2,0,0,0,0|1,0,0]=3 5036 B10R1.14 COC(=O)[C@H]1C[C@@H](CN1)O MCULE-9267825535 [0,2,0,0,0,0|1,0,0]=3 5037 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)F MCULE-3303214665 [0,2,0,0,0,0|1,0,0]=3 5038 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)F MCULE-3890802948 [0,2,0,0,0,0|1,0,0]=3 5039 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)F MCULE-6610054779 [0,2,0,0,0,0|1,0,0]=3 5040 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)F MCULE-7491439068 [0,2,0,0,0,0|1,0,0]=3 5041 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-1940578186 [0,2,0,0,0,0|1,0,0]=3 5042 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-2778952777 [0,2,0,0,0,0|1,0,0]=3 5043 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-5090473531 [0,2,0,0,0,0|1,0,0]=3 5044 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)O MCULE-6223710798 [0,2,0,0,0,0|1,0,0]=3 5045 B10R1.14 [C@@H]1(CN[C@H](C1)C(=O)OC)F MCULE-5638056091 [0,2,0,0,0,0|1,0,0]=3 5046 B10R1.14 [C@@H]1(CN[C@H](C1)C(=O)OC)F MCULE-9779401571 [0,2,0,0,0,0|1,0,0]=3 5047 B10R1.14 [C@@H]1(CN[C@H](C1)C(=O)OC)O MCULE-2597929891 [0,2,0,0,0,0|1,0,0]=3 5048 B10R1.14 [C@@H]1(CN[C@H](C1)C(=O)OC)O MCULE-4487472832 [0,2,0,0,0,0|1,0,0]=3 5049 B10R1.14 [C@H]1(CCC(=O)O1)C(=O)OC MCULE-8761301192 [0,2,0,0,0,0|0,0,1]=3 5050 B10R1.14 [C@H]1(CCC(=S)N1)C(=O)OC MCULE-6420555771 [0,2,0,0,0,0|1,0,1]=4 5051 B10R1.14 [C@H]1(CC[C@H](C1)C(=O)OC)Br MCULE-3396007386 [0,2,0,0,0,0|1,0,0]=3 5052 B10R1.14 [C@H]1(CC[C@H](C1)C(=O)OC)N MCULE-4947096311 [0,2,0,0,0,0|1,0,0]=3 5053 B10R1.14 [C@H]1(CC[C@H](C1)C(=O)OC)N MCULE-6857998793 [0,2,0,0,0,0|1,0,0]=3 5054 B10R1.14 [C@H]1(CC[C@H](C1)C(=O)OC)O MCULE-9908119773 [0,2,0,0,0,0|1,0,0]=3 5055 B10R1.149 COC(=O)C1=C(CCC1)N MCULE-9863493137 [0,2,0,0,0,0|1,0,1]=4 5056 B10R1.149 COC(=O)C1CCCC1=O MCULE-6028022990 [0,2,0,0,0,0|1,0,0]=3 5057 B10R1.149 COC(=O)C1CCCC1N MCULE-1292074679 [0,2,0,0,0,0|1,0,0]=3 5058 B10R1.149 COC(=O)C1CCCC1N MCULE-1475645605 [0,2,0,0,0,0|1,0,0]=3 5059 B10R1.149 COC(=O)C1CCCC1O MCULE-3674845958 [0,2,0,0,0,0|1,0,0]=3 5060 B10R1.149 COC(=O)C1CCCN1C MCULE-4362840235 [0,2,0,0,0,0|1,0,0]=3 5061 B10R1.149 COC(=O)C1CCCN1C MCULE-5596975421 [0,2,0,0,0,0|1,0,0]=3 5062 B10R1.149 COC(=O)C1CCNC1=O MCULE-5941876635 [0,2,0,0,0,0|2,0,0]=4 5063 B10R1.149 COC(=O)C1CCNC1=O MCULE-8768251531 [0,2,0,0,0,0|2,0,0]=4 5064 B10R1.149 COC(=O)C1CCNC1C MCULE-8241817730 [0,2,0,0,0,0|2,0,0]=4 5065 B10R1.149 COC(=O)C1CCNC1C MCULE-8840385748 [0,2,0,0,0,0|2,0,0]=4 5066 B10R1.149 COC(=O)C1CCOC1=O MCULE-7994291586 [0,2,0,0,0,0|2,0,0]=4 5067 B10R1.149 COC(=O)C1CCOC1C MCULE-1899362431 [0,2,0,0,0,0|2,0,0]=4 5068 B10R1.149 COC(=O)C1CNCC1C MCULE-7210179317 [0,2,0,0,0,0|2,0,0]=4 5069 B10R1.149 COC(=O)C1CNCC1C MCULE-8278654714 [0,2,0,0,0,0|2,0,0]=4 5070 B10R1.149 COC(=O)C1COCC1=O MCULE-6544197587 [0,2,0,0,0,0|2,0,0]=4 5071 B10R1.149 COC(=O)C1COCC1N MCULE-4643249679 [0,2,0,0,0,0|2,0,0]=4 5072 B10R1.149 COC(=O)C1COCC1N MCULE-5720773592 [0,2,0,0,0,0|2,0,0]=4 5073 B10R1.149 COC(=O)C1CSCC1=O MCULE-1977315680 [0,2,0,0,0,0|2,0,0]=4 5074 B10R1.149 COC(=O)C1NCCC1C MCULE-2145747628 [0,2,0,0,0,0|1,0,0]=3 5075 B10R1.149 COC(=O)C1NCCC1O MCULE-7668238984 [0,2,0,0,0,0|1,0,0]=3 5076 B10R1.149 COC(=O)C1NCCC1O MCULE-8444325552 [0,2,0,0,0,0|1,0,0]=3 5077 B10R1.149 COC(=O)C1OCCC1=O MCULE-7625568994 [0,2,0,0,0,0|0,0,1]=3 5078 B10R1.149 COC(=O)C1SCCC1=O MCULE-9345027413 [0,2,0,0,0,0|0,1,1]=4 5079 B10R1.149 COC(=O)N1CCCC1=S MCULE-8102273000 [0,2,0,0,0,0|2,0,0]=4 5080 B10R1.149 COC(=O)[C@@H]1CCCN1C MCULE-1885742091 [0,2,0,0,0,0|1,0,0]=3 5081 B10R1.149 COC(=O)[C@@H]1CCCN1C MCULE-9974114171 [0,2,0,0,0,0|1,0,0]=3 5082 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-2645143657 [0,2,0,0,0,0|1,0,0]=3 5083 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-7497757726 [0,2,0,0,0,0|1,0,0]=3 5084 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-8238495714 [0,2,0,0,0,0|1,0,0]=3 5085 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-9068401272 [0,2,0,0,0,0|1,0,0]=3 5086 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-9532295626 [0,2,0,0,0,0|1,0,0]=3 5087 B10R1.149 COC(=O)[C@@H]1CCC[C@H]1N MCULE-8649678944 [0,2,0,0,0,0|1,0,0]=3 5088 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1C MCULE-2548615141 [0,2,0,0,0,0|2,0,0]=4 5089 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1C MCULE-6985668415 [0,2,0,0,0,0|2,0,0]=4 5090 B10R1.149 COC(=O)[C@@H]1COC[C@@H]1N MCULE-2028778520 [0,2,0,0,0,0|2,0,0]=4 5091 B10R1.149 COC(=O)[C@@H]1COC[C@H]1N MCULE-2770189409 [0,2,0,0,0,0|2,0,0]=4 5092 B10R1.149 COC(=O)[C@@H]1COC[C@H]1N MCULE-9601097180 [0,2,0,0,0,0|2,0,0]=4 5093 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1C MCULE-6327833377 [0,2,0,0,0,0|1,0,0]=3 5094 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-3563774658 [0,2,0,0,0,0|1,0,0]=3 5095 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-4025671364 [0,2,0,0,0,0|1,0,0]=3 5096 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-4085872822 [0,2,0,0,0,0|1,0,0]=3 5097 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-5987049143 [0,2,0,0,0,0|1,0,0]=3 5098 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1C MCULE-8404202430 [0,2,0,0,0,0|1,0,0]=3 5099 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-7580132055 [0,2,0,0,0,0|1,0,0]=3 5100 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-8046366255 [0,2,0,0,0,0|1,0,0]=3 5101 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-8054998969 [0,2,0,0,0,0|1,0,0]=3 5102 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-9150462314 [0,2,0,0,0,0|1,0,0]=3 5103 B10R1.149 COC(=O)[C@H]1CCCN1C MCULE-4739167857 [0,2,0,0,0,0|1,0,0]=3 5104 B10R1.149 COC(=O)[C@H]1CCCN1C MCULE-5685325244 [0,2,0,0,0,0|1,0,0]=3 5105 B10R1.149 COC(=O)[C@H]1CCCN1N MCULE-2618575181 [0,2,0,0,0,0|1,0,0]=3 5106 B10R1.149 COC(=O)[C@H]1CCCN1N MCULE-6641562773 [0,2,0,0,0,0|1,0,0]=3 5107 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N MCULE-1925401143 [0,2,0,0,0,0|1,0,0]=3 5108 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N MCULE-3666883935 [0,2,0,0,0,0|1,0,0]=3 5109 B10R1.149 COC(=O)[C@H]1CCC[C@H]1N MCULE-2108800799 [0,2,0,0,0,0|1,0,0]=3 5110 B10R1.149 COC(=O)[C@H]1CCC[C@H]1N MCULE-9702061223 [0,2,0,0,0,0|1,0,0]=3 5111 B10R1.149 COC(=O)[C@H]1CCC[C@H]1O MCULE-9551218859 [0,2,0,0,0,0|1,0,0]=3 5112 B10R1.149 COC(=O)[C@H]1CCN[C@@H]1C MCULE-2992960189 [0,2,0,0,0,0|2,0,0]=4 5113 B10R1.149 COC(=O)[C@H]1CCN[C@@H]1C MCULE-9449255589 [0,2,0,0,0,0|2,0,0]=4 5114 B10R1.149 COC(=O)[C@H]1CCN[C@H]1C MCULE-1719318949 [0,2,0,0,0,0|2,0,0]=4 5115 B10R1.149 COC(=O)[C@H]1CCN[C@H]1C MCULE-7330244444 [0,2,0,0,0,0|2,0,0]=4 5116 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-1764804596 [0,2,0,0,0,0|2,0,0]=4 5117 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-2864244140 [0,2,0,0,0,0|2,0,0]=4 5118 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-5987586809 [0,2,0,0,0,0|2,0,0]=4 5119 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-8761929916 [0,2,0,0,0,0|2,0,0]=4 5120 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-8926066537 [0,2,0,0,0,0|2,0,0]=4 5121 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-9572268200 [0,2,0,0,0,0|2,0,0]=4 5122 B10R1.149 COC(=O)[C@H]1CNC[C@H]1O MCULE-3516416146 [0,2,0,0,0,0|2,0,0]=4 5123 B10R1.149 COC(=O)[C@H]1CNC[C@H]1O MCULE-5550156083 [0,2,0,0,0,0|2,0,0]=4 5124 B10R1.149 COC(=O)[C@H]1COC[C@@H]1N MCULE-3460136130 [0,2,0,0,0,0|2,0,0]=4 5125 B10R1.149 COC(=O)[C@H]1COC[C@@H]1N MCULE-9139612146 [0,2,0,0,0,0|2,0,0]=4 5126 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-5871041714 [0,2,0,0,0,0|2,0,0]=4 5127 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-6548766790 [0,2,0,0,0,0|2,0,0]=4 5128 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-7696136714 [0,2,0,0,0,0|2,0,0]=4 5129 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-8815307889 [0,2,0,0,0,0|2,0,0]=4 5130 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-9302309227 [0,2,0,0,0,0|2,0,0]=4 5131 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-9730204585 [0,2,0,0,0,0|2,0,0]=4 5132 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1C MCULE-6874278829 [0,2,0,0,0,0|1,0,0]=3 5133 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-1707749919 [0,2,0,0,0,0|1,0,0]=3 5134 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-2162736804 [0,2,0,0,0,0|1,0,0]=3 5135 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-2328775326 [0,2,0,0,0,0|1,0,0]=3 5136 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-6152782400 [0,2,0,0,0,0|1,0,0]=3 5137 B10R1.149 COC(=O)[C@H]1NCC[C@H]1C MCULE-1156779891 [0,2,0,0,0,0|1,0,0]=3 5138 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-3447587166 [0,2,0,0,0,0|1,0,0]=3 5139 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-5783585395 [0,2,0,0,0,0|1,0,0]=3 5140 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-7552928230 [0,2,0,0,0,0|1,0,0]=3 5141 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-8961364493 [0,2,0,0,0,0|1,0,0]=3 5142 B10R1.149 C[C@H]1CNC[C@@H]1C(=O)CO MCULE-2509682466 [0,2,0,0,0,0|2,0,0]=4 5143 B10R1.149 NNC(=O)C1CCCC1=O MCULE-9784363165 [0,2,0,0,0,0|2,0,0]=4 5144 B10R1.149 [C@@H]1(CCN[C@@H]1C(=O)OC)O MCULE-3575931306 [0,2,0,0,0,0|1,0,0]=3 5145 B10R1.149 [C@@H]1(CCN[C@@H]1C(=O)OC)O MCULE-5233829978 [0,2,0,0,0,0|1,0,0]=3 5146 B10R1.149 [C@@H]1(NCC[C@H]1O)C(=O)OC MCULE-4044407927 [0,2,0,0,0,0|1,0,0]=3 5147 B10R1.149 [C@@H]1(NCC[C@H]1O)C(=O)OC MCULE-7536456993 [0,2,0,0,0,0|1,0,0]=3 5148 B10R1.411 CC1(CCCC1)C(=O)CBr MCULE-6581201583 [0,2,0,0,0,0|2,0,0]=4 5149 B10R1.411 CC1(CCCC1)C(=O)CN MCULE-1948371564 [0,2,0,0,0,0|2,0,0]=4 5150 B10R1.411 CC1(CCCC1)C(=O)CN MCULE-2639621336 [0,2,0,0,0,0|2,0,0]=4 5151 B10R1.411 CC1(CCCO1)C(=O)NN MCULE-1504743816 [0,2,0,0,0,0|1,0,0]=3 5152 B10R1.411 CNC(=O)C1(CCCC1)N MCULE-2447147105 [0,2,0,0,0,0|2,0,0]=4 5153 B10R1.411 CNC(=O)C1(CCCC1)N MCULE-7652154694 [0,2,0,0,0,0|2,0,0]=4 5154 B10R1.411 CNC(=O)C1(CCCN1)C MCULE-3893347914 [0,2,0,0,0,0|2,0,0]=4 5155 B10R1.411 COC(=O)C1(CCCC1)Br MCULE-1802250593 [0,2,0,0,0,0|1,0,0]=3 5156 B10R1.411 COC(=O)C1(CCCC1)C MCULE-4994351302 [0,2,0,0,0,0|1,0,0]=3 5157 B10R1.411 COC(=O)C1(CCCC1)N MCULE-3993384521 [0,2,0,0,0,0|1,0,0]=3 5158 B10R1.411 COC(=O)C1(CCCC1)N MCULE-8708334020 [0,2,0,0,0,0|1,0,0]=3 5159 B10R1.411 COC(=O)C1(CCCC1)O MCULE-9522544954 [0,2,0,0,0,0|1,0,0]=3 5160 B10R1.411 COC(=O)C1(CCCN1)C MCULE-1235833333 [0,2,0,0,0,0|1,0,0]=3 5161 B10R1.411 COC(=O)C1(CCCN1)C MCULE-1917107448 [0,2,0,0,0,0|1,0,0]=3 5162 B10R1.411 COC(=O)C1(CCCN1)C MCULE-4824909317 [0,2,0,0,0,0|1,0,0]=3 5163 B10R1.411 COC(=O)C1(CCCN1)C MCULE-5407267062 [0,2,0,0,0,0|1,0,0]=3 5164 B10R1.411 COC(=O)C1(CCCO1)C MCULE-4521868101 [0,2,0,0,0,0|0,0,0]=2 5165 B10R1.411 COC(=O)C1(CCNC1)C MCULE-4105754219 [0,2,0,0,0,0|2,0,0]=4 5166 B10R1.411 COC(=O)C1(CCNC1)C MCULE-4306298231 [0,2,0,0,0,0|2,0,0]=4 5167 B10R1.411 COC(=O)C1(CCNC1)F MCULE-2229999079 [0,2,0,0,0,0|2,0,0]=4 5168 B10R1.411 COC(=O)C1(CCNC1)F MCULE-8737768541 [0,2,0,0,0,0|2,0,0]=4 5169 B10R1.411 COC(=O)C1(CCNC1)O MCULE-7160148932 [0,2,0,0,0,0|2,0,0]=4 5170 B10R1.411 COC(=O)C1(CCNC1)O MCULE-7492896118 [0,2,0,0,0,0|2,0,0]=4 5171 B10R1.411 COC(=O)C1(CCOC1)Br MCULE-4656799312 [0,2,0,0,0,0|2,0,0]=4 5172 B10R1.411 COC(=O)C1(CCOC1)C MCULE-7034406255 [0,2,0,0,0,0|2,0,0]=4 5173 B10R1.411 COC(=O)C1(CCOC1)N MCULE-4987068291 [0,2,0,0,0,0|2,0,0]=4 5174 B10R1.411 COC(=O)C1(CCOC1)N MCULE-5008801545 [0,2,0,0,0,0|2,0,0]=4 5175 B10R1.411 COC(=O)C1(CCOC1)O MCULE-7161317009 [0,2,0,0,0,0|2,0,0]=4 5176 B10R1.411 COC(=O)C1(CCSC1)N MCULE-8182082021 [0,2,0,0,0,0|2,0,0]=4 5177 B10R1.411 COC(=O)C1(CCSC1)O MCULE-5872955354 [0,2,0,0,0,0|2,0,0]=4 5178 B10R1.411 COC(=O)[C@@]1(CCCN1)C MCULE-1803197717 [0,2,0,0,0,0|1,0,0]=3 5179 B10R1.411 COC(=O)[C@@]1(CCCN1)C MCULE-1860856931 [0,2,0,0,0,0|1,0,0]=3 5180 B10R1.411 COC(=O)[C@@]1(CCCN1)C MCULE-4956112061 [0,2,0,0,0,0|1,0,0]=3 5181 B10R1.411 COC(=O)[C@@]1(CCCN1)C MCULE-7224480255 [0,2,0,0,0,0|1,0,0]=3 5182 B10R1.411 COC(=O)[C@@]1(CCCO1)C MCULE-2155246886 [0,2,0,0,0,0|0,0,0]=2 5183 B10R1.411 COC(=O)[C@@]1(CCNC1)O MCULE-7062603831 [0,2,0,0,0,0|2,0,0]=4 5184 B10R1.411 COC(=O)[C@@]1(CCNC1)O MCULE-8313559262 [0,2,0,0,0,0|2,0,0]=4 5185 B10R1.411 COC(=O)[C@@]1(CCOC1)N MCULE-4369170451 [0,2,0,0,0,0|2,0,0]=4 5186 B10R1.411 COC(=O)[C@@]1(CCOC1)N MCULE-8824303864 [0,2,0,0,0,0|2,0,0]=4 5187 B10R1.411 COC(=O)[C@]1(CCCN1)C MCULE-3726141389 [0,2,0,0,0,0|1,0,0]=3 5188 B10R1.411 COC(=O)[C@]1(CCCN1)C MCULE-4552843126 [0,2,0,0,0,0|1,0,0]=3 5189 B10R1.411 COC(=O)[C@]1(CCCN1)C MCULE-5808087302 [0,2,0,0,0,0|1,0,0]=3 5190 B10R1.411 COC(=O)[C@]1(CCCN1)C MCULE-8456176728 [0,2,0,0,0,0|1,0,0]=3 5191 B10R1.411 COC(=O)[C@]1(CCOC1)C MCULE-3065794713 [0,2,0,0,0,0|2,0,0]=4 5192 B10R1.31 C1(NC(CS1)C(=O)O)CC MCULE-6124427567 [0,2,0,0,0,0|2,0,0]=4 5193 B10R1.31 CCC1=NOC(C1)C(=O)O MCULE-6950175956 [0,2,0,0,0,0|1,0,1]=4 5194 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9089135115 [0,2,0,0,0,0|1,0,0]=3 5195 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9951781675 [0,2,0,0,0,0|1,0,0]=3 5196 B10R1.31 CCC1NC(CS1)C(=O)O MCULE-2037916598 [0,2,0,0,0,0|2,0,0]=4 5197 B10R1.31 CCN1CCC(C1)C(=O)O MCULE-6987605321 [0,2,0,0,0,0|2,0,0]=4 5198 B10R1.31 COC1CCC(C1)C(=O)O MCULE-5189432372 [0,2,0,0,0,0|1,0,0]=3 5199 B10R1.31 CO[C@@H]1CN[C@@H](C1)C(=O)O MCULE-2339543928 [0,2,0,0,0,0|1,0,0]=3 5200 B10R1.31 CO[C@H]1CC[C@@H](C1)C(=O)O MCULE-8255434197 [0,2,0,0,0,0|1,0,0]=3 5201 B10R1.31 CO[C@H]1CC[C@H](C1)C(=O)O MCULE-3942607370 [0,2,0,0,0,0|1,0,0]=3 5202 B10R1.31 CO[C@H]1CN[C@@H](C1)C(=O)O MCULE-2951589630 [0,2,0,0,0,0|1,0,0]=3 5203 B10R1.31 NC[C@@H]1CN[C@@H](C1)C(=O)O MCULE-2543185174 [0,2,0,0,0,0|1,0,0]=3 5204 B10R1.31 NC[C@@H]1CN[C@@H](C1)C(=O)O MCULE-5699643655 [0,2,0,0,0,0|1,0,0]=3 5205 B10R1.31 O=C(O)C1CCC(=NO)C1 MCULE-1447348290 [0,2,0,0,0,0|1,0,1]=4 5206 B10R1.58 CN1CC(OC1=O)C(=O)O MCULE-1158187923 [0,2,0,0,0,0|1,0,1]=4 5207 B10R1.58 N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O MCULE-2019095795 [0,2,0,0,0,0|1,0,0]=3 5208 B10R1.58 N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O MCULE-7012514700 [0,2,0,0,0,0|1,0,0]=3 5209 B10R1.58 O=C(O)C1CC(C(C1)Br)Br MCULE-6168529373 [0,2,0,0,0,0|1,0,0]=3 5210 B10R1.58 O=C(O)[C@@H]1C[C@H](C(=O)N1)F MCULE-3594620408 [0,2,0,0,0,0|1,0,1]=4 5211 B10R1.58 O=C(O)[C@@H]1C[C@H](C(=O)N1)F MCULE-7616817872 [0,2,0,0,0,0|1,0,1]=4 5212 B10R1.58 O=C1NC(CC1F)C(=O)O MCULE-5782471146 [0,2,0,0,0,0|1,0,1]=4 5213 B10R1.58 O=C1N[C@@H](C[C@@H]1F)C(=O)O MCULE-5667846232 [0,2,0,0,0,0|1,0,1]=4 5214 B10R1.58 O=C1N[C@@H](C[C@@H]1F)C(=O)O MCULE-8319847079 [0,2,0,0,0,0|1,0,1]=4 5215 B10R1.59 C=C1C[C@@H]([C@@H](C1)C(=O)O)N MCULE-9822470688 [0,2,0,0,0,0|1,0,1]=4 5216 B10R1.59 CC1CC(=O)NC1C(=O)O MCULE-1142843058 [0,2,0,0,0,0|1,0,1]=4 5217 B10R1.59 CC1CC(C(=O)O1)C(=O)O MCULE-5538965549 [0,2,0,0,0,0|2,0,0]=4 5218 B10R1.59 CC1CC(C(O1)C(=O)O)C MCULE-6609295709 [0,2,0,0,0,0|0,0,0]=2 5219 B10R1.59 CC1CC(C(O1)C)C(=O)O MCULE-4495071251 [0,2,0,0,0,0|2,0,0]=4 5220 B10R1.59 CC1CC(N(C1)C)C(=O)O MCULE-1544526499 [0,2,0,0,0,0|1,0,0]=3 5221 B10R1.59 CC1CC(N(C1)C)C(=O)O MCULE-4035906246 [0,2,0,0,0,0|1,0,0]=3 5222 B10R1.59 CN1CC(CC1C(=O)O)N MCULE-7362090633 [0,2,0,0,0,0|1,0,0]=3 5223 B10R1.59 CN1CC(CC1C(=O)O)O MCULE-6963505872 [0,2,0,0,0,0|1,0,0]=3 5224 B10R1.59 CN1C[C@@H](C[C@@H]1C(=O)O)O MCULE-7645006550 [0,2,0,0,0,0|1,0,0]=3 5225 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)F MCULE-1701571164 [0,2,0,0,0,0|1,0,0]=3 5226 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)F MCULE-3801669792 [0,2,0,0,0,0|1,0,0]=3 5227 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)O MCULE-4289101461 [0,2,0,0,0,0|1,0,0]=3 5228 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)O MCULE-5652344615 [0,2,0,0,0,0|1,0,0]=3 5229 B10R1.59 CN1C[C@H](C[C@@H]1C(=O)O)O MCULE-4231676044 [0,2,0,0,0,0|1,0,0]=3 5230 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)N MCULE-7565756526 [0,2,0,0,0,0|1,0,0]=3 5231 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)N MCULE-8931908939 [0,2,0,0,0,0|1,0,0]=3 5232 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)O MCULE-2551559641 [0,2,0,0,0,0|1,0,0]=3 5233 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)O MCULE-4981449681 [0,2,0,0,0,0|1,0,0]=3 5234 B10R1.59 C[C@@H]1CC(=O)N[C@@H]1C(=O)O MCULE-5687745727 [0,2,0,0,0,0|1,0,1]=4 5235 B10R1.59 C[C@@H]1CC(=O)N[C@H]1C(=O)O MCULE-3978079245 [0,2,0,0,0,0|1,0,1]=4 5236 B10R1.59 C[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-3249388528 [0,2,0,0,0,0|1,0,0]=3 5237 B10R1.59 C[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-5892295670 [0,2,0,0,0,0|1,0,0]=3 5238 B10R1.59 C[C@H]1CC(=O)N[C@@H]1C(=O)O MCULE-1352855018 [0,2,0,0,0,0|1,0,1]=4 5239 B10R1.59 C[C@H]1CC(=O)N[C@H]1C(=O)O MCULE-6205979547 [0,2,0,0,0,0|1,0,1]=4 5240 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1379494499 [0,2,0,0,0,0|1,0,0]=3 5241 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1502363575 [0,2,0,0,0,0|1,0,0]=3 5242 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1565262465 [0,2,0,0,0,0|1,0,0]=3 5243 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-4515635703 [0,2,0,0,0,0|1,0,0]=3 5244 B10R1.59 O=C(O)N1CC(CC1=O)O MCULE-8810484712 [0,2,0,0,0,0|2,0,0]=4 5245 B10R1.59 [C@H]1(C[C@H](CN1C)C)C(=O)O MCULE-6457651208 [0,2,0,0,0,0|1,0,0]=3 5246 B10R1.194 CC1C(CCN1C)C(=O)O MCULE-3080880087 [0,2,0,0,0,0|2,0,0]=4 5247 B10R1.194 CC1C(CCN1C)C(=O)O MCULE-8463571511 [0,2,0,0,0,0|2,0,0]=4 5248 B10R1.194 CC1CCC(N1C)C(=O)O MCULE-1631473352 [0,2,0,0,0,0|1,0,0]=3 5249 B10R1.194 CN1C(=O)CCC1C(=O)O MCULE-1836057812 [0,2,0,0,0,0|1,0,1]=4 5250 B10R1.194 CN1C(=O)CCC1C(=O)O MCULE-7449426037 [0,2,0,0,0,0|1,0,1]=4 5251 B10R1.194 CN1C(=O)CC[C@@H]1C(=O)O MCULE-5515047051 [0,2,0,0,0,0|1,0,1]=4 5252 B10R1.194 CN1C(=O)CC[C@@H]1C(=O)O MCULE-6485454128 [0,2,0,0,0,0|1,0,1]=4 5253 B10R1.194 CN1C(=O)CC[C@H]1C(=O)O MCULE-7960298498 [0,2,0,0,0,0|1,0,1]=4 5254 B10R1.194 CN1C(=O)CC[C@H]1C(=O)O MCULE-9649189424 [0,2,0,0,0,0|1,0,1]=4 5255 B10R1.194 CN1CCC(C1=O)C(=O)O MCULE-9291039298 [0,2,0,0,0,0|2,0,0]=4 5256 B10R1.194 C[C@@H]1CC[C@H](N1C)C(=O)O MCULE-5064787674 [0,2,0,0,0,0|1,0,0]=3 5257 B10R1.194 C[C@@H]1CC[C@H](N1C)C(=O)O MCULE-5375480697 [0,2,0,0,0,0|1,0,0]=3 5258 B10R1.194 C[C@@H]1[C@@H](CCN1C)C(=O)O MCULE-1037781010 [0,2,0,0,0,0|2,0,0]=4 5259 B10R1.194 C[C@@H]1[C@@H](CCN1C)C(=O)O MCULE-5608694177 [0,2,0,0,0,0|2,0,0]=4 5260 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-2143702379 [0,2,0,0,0,0|1,0,0]=3 5261 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-3730566868 [0,2,0,0,0,0|1,0,0]=3 5262 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-7974927719 [0,2,0,0,0,0|1,0,0]=3 5263 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-9806319171 [0,2,0,0,0,0|1,0,0]=3 5264 B10R1.359 C1(CC(CN1)(F)F)C(=O)N MCULE-3572063756 [0,2,0,0,0,0|2,0,0]=4 5265 B10R1.359 C1(CC(CN1)(F)F)C(=O)N MCULE-9418751339 [0,2,0,0,0,0|2,0,0]=4 5266 B10R1.359 C1(CC(CN1)(F)F)C(=O)O MCULE-2953204230 [0,2,0,0,0,0|1,0,0]=3 5267 B10R1.359 C1(CC(CN1)(F)F)C(=O)O MCULE-4110303624 [0,2,0,0,0,0|1,0,0]=3 5268 B10R1.359 CC(=O)C1CCC(C1)(F)F MCULE-5021812467 [0,2,0,0,0,0|2,0,0]=4 5269 B10R1.359 CC(=O)[C@H]1CCC(C1)(F)F MCULE-6481522414 [0,2,0,0,0,0|2,0,0]=4 5270 B10R1.359 CC(=O)[C@H]1COC(O1)(C)C MCULE-3614383372 [0,2,0,0,0,0|2,0,0]=4 5271 B10R1.359 CC1(CC(CO1)C(=O)O)C MCULE-2939144976 [0,2,0,0,0,0|2,0,0]=4 5272 B10R1.359 CC1(CCC(C1)C(=O)O)C MCULE-9978136872 [0,2,0,0,0,0|1,0,0]=3 5273 B10R1.359 CC1(CCC(N1)C(=O)O)C MCULE-5310172848 [0,2,0,0,0,0|1,0,0]=3 5274 B10R1.359 CC1(CCC(N1)C(=O)O)C MCULE-5921965282 [0,2,0,0,0,0|1,0,0]=3 5275 B10R1.359 CC1(CCC(O1)C(=O)O)C MCULE-6347581531 [0,2,0,0,0,0|0,0,0]=2 5276 B10R1.359 CC1(CNC(C1)C(=O)O)C MCULE-3559457457 [0,2,0,0,0,0|1,0,0]=3 5277 B10R1.359 CC1(CNC(C1)C(=O)O)C MCULE-4286050645 [0,2,0,0,0,0|1,0,0]=3 5278 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-2704032687 [0,2,0,0,0,0|1,0,0]=3 5279 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-3701263335 [0,2,0,0,0,0|1,0,0]=3 5280 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-5777695775 [0,2,0,0,0,0|1,0,0]=3 5281 B10R1.359 CC1(CN[C@@H](C1)C(=O)O)C MCULE-7930268339 [0,2,0,0,0,0|1,0,0]=3 5282 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-5601172836 [0,2,0,0,0,0|1,0,0]=3 5283 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-5795533452 [0,2,0,0,0,0|1,0,0]=3 5284 B10R1.359 CC1(CN[C@H](C1)C(=O)O)C MCULE-6871769907 [0,2,0,0,0,0|1,0,0]=3 5285 B10R1.359 CC1(COC(C1)C(=O)O)C MCULE-3465757314 [0,2,0,0,0,0|0,0,0]=2 5286 B10R1.359 CC1(NC(CS1)C(=O)O)C MCULE-3628976485 [0,2,0,0,0,0|2,0,0]=4 5287 B10R1.359 CC1(NC(CS1)C(=O)O)C MCULE-9763318604 [0,2,0,0,0,0|2,0,0]=4 5288 B10R1.359 CC1(N[C@@H](CS1)C(=O)O)C MCULE-5428000366 [0,2,0,0,0,0|2,0,0]=4 5289 B10R1.359 CC1(N[C@@H](CS1)C(=O)O)C MCULE-6914291473 [0,2,0,0,0,0|2,0,0]=4 5290 B10R1.359 CC1(N[C@@H](CS1)C(=O)O)C MCULE-8499487712 [0,2,0,0,0,0|2,0,0]=4 5291 B10R1.359 CC1(N[C@@H](CS1)C(=O)O)C MCULE-9591174443 [0,2,0,0,0,0|2,0,0]=4 5292 B10R1.359 CC1(N[C@H](CS1)C(=O)O)C MCULE-1864127233 [0,2,0,0,0,0|2,0,0]=4 5293 B10R1.359 CC1(OCC(O1)C(=O)O)C MCULE-8459041221 [0,2,0,0,0,0|1,0,0]=3 5294 B10R1.359 CC1(OCC(O1)C(=O)[O-])C MCULE-4000004744 [0,2,0,0,0,0|1,0,1]=4 5295 B10R1.359 CC1(OC[C@@H](O1)C(=O)O)C MCULE-4620241254 [0,2,0,0,0,0|1,0,0]=3 5296 B10R1.359 CC1(OC[C@@H](O1)C(=O)O)C MCULE-7602075849 [0,2,0,0,0,0|1,0,0]=3 5297 B10R1.359 CC1(OC[C@H](O1)C(=O)O)C MCULE-6422447541 [0,2,0,0,0,0|1,0,0]=3 5298 B10R1.359 CC1(OC[C@H](O1)C(=O)O)C MCULE-7066406161 [0,2,0,0,0,0|1,0,0]=3 5299 B10R1.359 CC1(OC[C@H](O1)C(=O)[O-])C MCULE-7365914999 [0,2,0,0,0,0|1,0,1]=4 5300 B10R1.359 CC1(OC[C@H](O1)C(=O)[O-])C MCULE-8613095772 [0,2,0,0,0,0|1,0,1]=4 5301 B10R1.359 NC(=O)C1CC(CN1)(F)F MCULE-3386184862 [0,2,0,0,0,0|2,0,0]=4 5302 B10R1.359 NC(=O)C1CC(CN1)(F)F MCULE-7587095498 [0,2,0,0,0,0|2,0,0]=4 5303 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-5347034095 [0,2,0,0,0,0|2,0,0]=4 5304 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-5765717202 [0,2,0,0,0,0|2,0,0]=4 5305 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-5955733071 [0,2,0,0,0,0|2,0,0]=4 5306 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-6363195996 [0,2,0,0,0,0|2,0,0]=4 5307 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-6591467450 [0,2,0,0,0,0|2,0,0]=4 5308 B10R1.359 NC(=O)[C@@H]1CC(CN1)(F)F MCULE-6778984360 [0,2,0,0,0,0|2,0,0]=4 5309 B10R1.359 NC(=O)[C@H]1CC(CN1)(F)F MCULE-1821278703 [0,2,0,0,0,0|2,0,0]=4 5310 B10R1.359 NC(=O)[C@H]1CC(CN1)(F)F MCULE-5924357750 [0,2,0,0,0,0|2,0,0]=4 5311 B10R1.359 NC(=O)[C@H]1CC(CN1)(F)F MCULE-6367192550 [0,2,0,0,0,0|2,0,0]=4 5312 B10R1.359 NC(=O)[C@H]1CC(CN1)(F)F MCULE-9121304614 [0,2,0,0,0,0|2,0,0]=4 5313 B10R1.359 O=C(O)C1CC(CN1)(F)F MCULE-2199319897 [0,2,0,0,0,0|1,0,0]=3 5314 B10R1.359 O=C(O)C1CC(CN1)(F)F MCULE-2586326597 [0,2,0,0,0,0|1,0,0]=3 5315 B10R1.359 O=C(O)C1CC(CN1)(F)F MCULE-3828268777 [0,2,0,0,0,0|1,0,0]=3 5316 B10R1.359 O=C(O)C1CCC(C1)(F)F MCULE-3866141496 [0,2,0,0,0,0|1,0,0]=3 5317 B10R1.359 O=C(O)C1CCC(C1)(F)F MCULE-9447411120 [0,2,0,0,0,0|1,0,0]=3 5318 B10R1.359 O=C(O)C1CCS(=O)(=O)C1 MCULE-3551776261 [0,2,0,0,0,0|2,0,0]=4 5319 B10R1.359 O=C(O)C1CCS(=O)(=O)N1 MCULE-5768819085 [0,2,0,0,0,0|2,0,0]=4 5320 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-2937959665 [0,2,0,0,0,0|1,0,0]=3 5321 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-3681935460 [0,2,0,0,0,0|1,0,0]=3 5322 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-4375321400 [0,2,0,0,0,0|1,0,0]=3 5323 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-5689630052 [0,2,0,0,0,0|1,0,0]=3 5324 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-6005973714 [0,2,0,0,0,0|1,0,0]=3 5325 B10R1.359 O=C(O)[C@@H]1CC(CN1)(F)F MCULE-6623135745 [0,2,0,0,0,0|1,0,0]=3 5326 B10R1.359 O=C(O)[C@@H]1CCC(C1)(F)F MCULE-1982062527 [0,2,0,0,0,0|1,0,0]=3 5327 B10R1.359 O=C(O)[C@@H]1CCC(C1)(F)F MCULE-8436417104 [0,2,0,0,0,0|1,0,0]=3 5328 B10R1.359 O=C(O)[C@H]1CC(CN1)(F)F MCULE-1798729548 [0,2,0,0,0,0|1,0,0]=3 5329 B10R1.359 O=C(O)[C@H]1CC(CN1)(F)F MCULE-3144994706 [0,2,0,0,0,0|1,0,0]=3 5330 B10R1.359 O=C(O)[C@H]1CC(CN1)(F)F MCULE-5393615017 [0,2,0,0,0,0|1,0,0]=3 5331 B10R1.359 O=C(O)[C@H]1CC(CN1)(F)F MCULE-9844310114 [0,2,0,0,0,0|1,0,0]=3 5332 B10R1.359 O=C(O)[C@H]1CCC(C1)(F)F MCULE-1884661502 [0,2,0,0,0,0|1,0,0]=3 5333 B10R1.359 O=C(O)[C@H]1CCC(C1)(F)F MCULE-4373169739 [0,2,0,0,0,0|1,0,0]=3 5334 B10R1.470 CC1(CC(CN1)O)C(=O)O MCULE-1962390815 [0,2,0,0,0,0|1,0,0]=3 5335 B10R1.470 CC1(CC(CN1)O)C(=O)O MCULE-3381499671 [0,2,0,0,0,0|1,0,0]=3 5336 B10R1.470 CC1(CCC(=O)C1)C(=O)O MCULE-8301527257 [0,2,0,0,0,0|1,0,1]=4 5337 B10R1.470 CC1(CCC(=O)N1)C(=O)O MCULE-6271364258 [0,2,0,0,0,0|1,0,1]=4 5338 B10R1.470 CC1(CCC(=O)O1)C(=O)O MCULE-2009596037 [0,2,0,0,0,0|0,0,1]=3 5339 B10R1.470 CC1(CCC(C1)N)C(=O)O MCULE-5009717504 [0,2,0,0,0,0|1,0,0]=3 5340 B10R1.470 CC1(CCC(C1)N)C(=O)O MCULE-6646895058 [0,2,0,0,0,0|1,0,0]=3 5341 B10R1.470 CC1=NOC(C1)(C)C(=O)O MCULE-3285798426 [0,2,0,0,0,0|1,0,1]=4 5342 B10R1.470 CC1CCC(C1)(C)C(=O)O MCULE-3638409630 [0,2,0,0,0,0|1,0,0]=3 5343 B10R1.470 CN1CCC(C1)(C)C(=O)O MCULE-3111826192 [0,2,0,0,0,0|2,0,0]=4 5344 B10R1.470 CN1CCC(C1)(F)C(=O)O MCULE-3877912842 [0,2,0,0,0,0|2,0,0]=4 5345 B10R1.470 C[C@@]1(CCC(=O)N1)C(=O)O MCULE-6399167225 [0,2,0,0,0,0|1,0,1]=4 5346 B10R1.470 C[C@@]1(CCC(=O)N1)C(=O)O MCULE-7144294782 [0,2,0,0,0,0|1,0,1]=4 5347 B10R1.470 C[C@]1(CCC(=O)N1)C(=O)O MCULE-6153592913 [0,2,0,0,0,0|1,0,1]=4 5348 B10R1.470 C[C@]1(CCC(=O)N1)C(=O)O MCULE-6971506580 [0,2,0,0,0,0|1,0,1]=4 5349 B10R1.470 NC1CCC(C1)(F)C(=O)O MCULE-1564321784 [0,2,0,0,0,0|1,0,0]=3 5350 B10R1.470 NC1CCC(C1)(F)C(=O)O MCULE-3542104690 [0,2,0,0,0,0|1,0,0]=3 5351 B10R1.39 C=C(C)C1OCCC1CN MCULE-2272351432 [0,2,0,0,0,0|2,0,0]=4 5352 B10R1.39 CCC1CCCC1C(=O)O MCULE-2134315765 [0,2,0,0,0,0|1,0,0]=3 5353 B10R1.39 CCC1CCNC1C(=O)O MCULE-1392850907 [0,2,0,0,0,0|1,0,0]=3 5354 B10R1.39 CCC1CCNC1C(=O)O MCULE-2618729884 [0,2,0,0,0,0|1,0,0]=3 5355 B10R1.39 CCC1NCCC1C(=O)O MCULE-6308897662 [0,2,0,0,0,0|2,0,0]=4 5356 B10R1.39 CCC1NCCC1C(=O)O MCULE-6989316364 [0,2,0,0,0,0|2,0,0]=4 5357 B10R1.39 CCC1OCCC1C(=O)O MCULE-3029813377 [0,2,0,0,0,0|2,0,0]=4 5358 B10R1.39 CCN1CCCC1C(=O)O MCULE-9170639085 [0,2,0,0,0,0|1,0,0]=3 5359 B10R1.39 CCN1CCC[C@@H]1C(=O)N MCULE-2931781805 [0,2,0,0,0,0|2,0,0]=4 5360 B10R1.39 CCN1CCC[C@@H]1C(=O)O MCULE-6272401541 [0,2,0,0,0,0|1,0,0]=3 5361 B10R1.39 CCN1CCC[C@H]1C(=O)N MCULE-7196500635 [0,2,0,0,0,0|2,0,0]=4 5362 B10R1.39 CCN1CCC[C@H]1C(=O)N MCULE-8340783541 [0,2,0,0,0,0|2,0,0]=4 5363 B10R1.39 CCN1CCC[C@H]1C(=O)O MCULE-4672768595 [0,2,0,0,0,0|1,0,0]=3 5364 B10R1.39 CCN1CCC[C@H]1C(=O)O MCULE-5066096497 [0,2,0,0,0,0|1,0,0]=3 5365 B10R1.39 CC[C@@H]1CNC[C@@H]1C(=O)O MCULE-8464460557 [0,2,0,0,0,0|2,0,0]=4 5366 B10R1.39 CC[C@H]1CNC[C@H]1C(=O)O MCULE-2742804200 [0,2,0,0,0,0|2,0,0]=4 5367 B10R1.39 COC1CCCC1C(=O)O MCULE-6165424004 [0,2,0,0,0,0|1,0,0]=3 5368 B10R1.39 CSC1CCCC1C(=O)O MCULE-7830513386 [0,2,0,0,0,0|1,0,0]=3 5369 B10R1.39 N#CC1=C(CCC1)C(=O)O MCULE-5037268022 [0,2,0,0,0,0|1,0,1]=4 5370 B10R1.39 NCC1CCCC1C(=O)O MCULE-5775773821 [0,2,0,0,0,0|1,0,0]=3 5371 B10R1.39 NCC1CCCC1C(=O)O MCULE-6872336527 [0,2,0,0,0,0|1,0,0]=3 5372 B10R1.39 NCC1OCCC1C(=O)O MCULE-2668866861 [0,2,0,0,0,0|2,0,0]=4 5373 B10R1.39 NCC1OCCC1C(=O)O MCULE-9067491644 [0,2,0,0,0,0|2,0,0]=4 5374 B10R1.39 O=C(O)C1CNCC1CO MCULE-4689035983 [0,2,0,0,0,0|2,0,0]=4 5375 B10R1.39 O=CC1=CCCC1C(=O)O MCULE-5161313850 [0,2,0,0,0,0|1,0,1]=4 5376 B10R1.39 O=CN1CCC[C@H]1C(=O)O MCULE-4414225416 [0,2,0,0,0,0|1,0,0]=3 5377 B10R1.39 O=CN1CCC[C@H]1C(=O)O MCULE-8771289289 [0,2,0,0,0,0|1,0,0]=3 5378 B10R1.39 O=NN1CCCC1C(=O)O MCULE-4315718435 [0,2,0,0,0,0|1,0,0]=3 5379 B10R1.128 CC1(CCC=C1C(=O)O)C MCULE-6540475820 [0,2,0,0,0,0|1,0,1]=4 5380 B10R1.128 CC1(CCCC1C(=O)O)C MCULE-4580682391 [0,2,0,0,0,0|1,0,0]=3 5381 B10R1.128 CC1(CCCC1C(=O)O)N MCULE-6959799055 [0,2,0,0,0,0|1,0,0]=3 5382 B10R1.128 CC1(CCCC1C(=O)O)N MCULE-7529713765 [0,2,0,0,0,0|1,0,0]=3 5383 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-4368125699 [0,2,0,0,0,0|1,0,0]=3 5384 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-9548940162 [0,2,0,0,0,0|1,0,0]=3 5385 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9288829524 [0,2,0,0,0,0|1,0,0]=3 5386 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9565122593 [0,2,0,0,0,0|1,0,0]=3 5387 B10R1.128 CC1(CNCC1C(=O)O)C MCULE-3386370307 [0,2,0,0,0,0|2,0,0]=4 5388 B10R1.128 CC1(CNCC1C(=O)O)C MCULE-6121405177 [0,2,0,0,0,0|2,0,0]=4 5389 B10R1.128 CC1(CNC[C@@H]1C(=O)O)C MCULE-2007377437 [0,2,0,0,0,0|2,0,0]=4 5390 B10R1.128 CC1(CNC[C@@H]1C(=O)O)C MCULE-2184930829 [0,2,0,0,0,0|2,0,0]=4 5391 B10R1.128 CC1(CNC[C@H]1C(=O)O)C MCULE-1263349937 [0,2,0,0,0,0|2,0,0]=4 5392 B10R1.128 CC1(CNC[C@H]1C(=O)O)C MCULE-7547643584 [0,2,0,0,0,0|2,0,0]=4 5393 B10R1.128 CC1(OCCC1C(=O)O)C MCULE-4433776174 [0,2,0,0,0,0|2,0,0]=4 5394 B10R1.128 CC1(SCNC1C(=O)O)C MCULE-4649954723 [0,2,0,0,0,0|2,0,0]=4 5395 B10R1.128 CC1(SCN[C@@H]1C(=O)O)C MCULE-3039934368 [0,2,0,0,0,0|2,0,0]=4 5396 B10R1.128 CC1(SCN[C@@H]1C(=O)O)C MCULE-7607354946 [0,2,0,0,0,0|2,0,0]=4 5397 B10R1.128 CC1(SCN[C@H]1C(=O)O)C MCULE-3400987510 [0,2,0,0,0,0|2,0,0]=4 5398 B10R1.128 CC1(SCN[C@H]1C(=O)O)C MCULE-7230856340 [0,2,0,0,0,0|2,0,0]=4 5399 B10R1.128 C[C@]1(CCC[C@@H]1C(=O)O)N MCULE-2638855066 [0,2,0,0,0,0|1,0,0]=3 5400 B10R1.128 C[C@]1(CCC[C@@H]1C(=O)O)N MCULE-7472901526 [0,2,0,0,0,0|1,0,0]=3 5401 B10R1.128 C[N+]1(CCCC1C(=O)O)C MCULE-4111590223 [0,2,0,0,0,0|1,0,0]=3 5402 B10R1.128 C[N+]1(CCCC1C(=O)[O-])C MCULE-7648391686 [0,2,0,0,0,0|1,0,1]=4 5403 B10R1.128 C[N+]1(CCC[C@H]1C(=O)O)C MCULE-8126384491 [0,2,0,0,0,0|1,0,0]=3 5404 B10R1.128 C[N+]1(CCC[C@H]1C(=O)[O-])C MCULE-2247774893 [0,2,0,0,0,0|1,0,1]=4 5405 B10R1.128 C[N+]1(CCC[C@H]1C(=O)[O-])C MCULE-3828242954 [0,2,0,0,0,0|1,0,1]=4 5406 B10R1.128 C[N+]1(CCC[C@H]1C(=O)[O-])C MCULE-9538853712 [0,2,0,0,0,0|1,0,1]=4 5407 B10R1.128 O=C(O)C1CCCC1(F)F MCULE-3687597013 [0,2,0,0,0,0|1,0,0]=3 5408 B10R1.128 O=C(O)C1CCCS1(=O)=O MCULE-6333477940 [0,2,0,0,0,0|0,1,0]=3 5409 B10R1.128 O=C(O)C1CNCC1(F)F MCULE-2270064252 [0,2,0,0,0,0|2,0,0]=4 5410 B10R1.128 O=C(O)C1CNCC1(F)F MCULE-2781860407 [0,2,0,0,0,0|2,0,0]=4 5411 B10R1.128 O=C(O)C1NCCC1(F)F MCULE-2455048138 [0,2,0,0,0,0|1,0,0]=3 5412 B10R1.128 O=C(O)C1NCCC1(F)F MCULE-9521153177 [0,2,0,0,0,0|1,0,0]=3 5413 B10R1.128 O=C(O)C1OCCC1(F)F MCULE-1033630667 [0,2,0,0,0,0|0,0,0]=2 5414 B10R1.128 O=C(O)[C@@H]1OCCC1(F)F MCULE-3394730004 [0,2,0,0,0,0|0,0,0]=2 5415 B10R1.128 O=C(O)[C@H]1OCCC1(F)F MCULE-2296740232 [0,2,0,0,0,0|0,0,0]=2 5416 B10R1.192 CC1COC(=O)C1C(=O)O MCULE-6047208777 [0,2,0,0,0,0|2,0,0]=4 5417 B10R1.291 CC1(CCNC1=O)C(=O)O MCULE-9843438328 [0,2,0,0,0,0|2,0,0]=4 5418 B10R1.291 CC1CCCC1(C)C(=O)O MCULE-3149463709 [0,2,0,0,0,0|1,0,0]=3 5419 B10R1.291 CC1OCCC1(C)C(=O)O MCULE-4774939870 [0,2,0,0,0,0|2,0,0]=4 5420 B10R1.291 CN1CCCC1(C)C(=O)O MCULE-3073966944 [0,2,0,0,0,0|1,0,0]=3 5421 B10R1.291 CN1CCC[C@@]1(C)C(=O)O MCULE-3527940712 [0,2,0,0,0,0|1,0,0]=3 5422 B10R1.291 CN1CCC[C@]1(C)C(=O)O MCULE-2144267845 [0,2,0,0,0,0|1,0,0]=3 5423 B10R1.291 C[C@]1(CCC[C@@H]1N)C(=O)O MCULE-2571628010 [0,2,0,0,0,0|1,0,0]=3 5424 B10R1.291 C[C@]1(CCC[C@@H]1N)C(=O)O MCULE-3056122824 [0,2,0,0,0,0|1,0,0]=3 5425 B10R1.291 C[C@]1(CCNC1=O)C(=O)O MCULE-8372001609 [0,2,0,0,0,0|2,0,0]=4 5426 B10R1.477 C#CC1(CCCC1)C(=O)O MCULE-5542543621 [0,2,0,0,0,0|1,0,0]=3 5427 B10R1.477 CCC1(CCCC1)C(=O)O MCULE-5656602965 [0,2,0,0,0,0|1,0,0]=3 5428 B10R1.477 CCC1(CCCN1)C(=O)O MCULE-3641915361 [0,2,0,0,0,0|1,0,0]=3 5429 B10R1.477 CCC1(CCCN1)C(=O)O MCULE-4597310469 [0,2,0,0,0,0|1,0,0]=3 5430 B10R1.477 CCC1(CCCN1)C(=O)O MCULE-5699616237 [0,2,0,0,0,0|1,0,0]=3 5431 B10R1.477 CCC1(CCCN1)C(=O)O MCULE-9288027580 [0,2,0,0,0,0|1,0,0]=3 5432 B10R1.477 CC[C@@]1(CCCN1)C(=O)O MCULE-1110693309 [0,2,0,0,0,0|1,0,0]=3 5433 B10R1.477 CC[C@@]1(CCCN1)C(=O)O MCULE-3125780437 [0,2,0,0,0,0|1,0,0]=3 5434 B10R1.477 CC[C@@]1(CCCN1)C(=O)O MCULE-3747201084 [0,2,0,0,0,0|1,0,0]=3 5435 B10R1.477 CC[C@@]1(CCCN1)C(=O)O MCULE-4962257347 [0,2,0,0,0,0|1,0,0]=3 5436 B10R1.477 CC[C@]1(CCCN1)C(=O)O MCULE-3237722025 [0,2,0,0,0,0|1,0,0]=3 5437 B10R1.477 CC[C@]1(CCCN1)C(=O)O MCULE-4656804455 [0,2,0,0,0,0|1,0,0]=3 5438 B10R1.477 CC[C@]1(CCCN1)C(=O)O MCULE-7911479004 [0,2,0,0,0,0|1,0,0]=3 5439 B10R1.477 CC[C@]1(CCCN1)C(=O)O MCULE-8941344909 [0,2,0,0,0,0|1,0,0]=3 5440 B10R1.477 CNC1(CCCC1)C(=O)N MCULE-8303519887 [0,2,0,0,0,0|2,0,0]=4 5441 B10R1.477 CNC1(CCCC1)C(=O)O MCULE-1767562494 [0,2,0,0,0,0|1,0,0]=3 5442 B10R1.477 CNC1(CCCC1)C(=O)O MCULE-7365959763 [0,2,0,0,0,0|1,0,0]=3 5443 B10R1.477 CNC1(CCOC1)C(=O)O MCULE-7971278840 [0,2,0,0,0,0|2,0,0]=4 5444 B10R1.477 CNC1(CCSC1)C(=O)O MCULE-1204206450 [0,2,0,0,0,0|2,0,0]=4 5445 B10R1.477 COC1(CCCC1)C(=O)C MCULE-8752650901 [0,2,0,0,0,0|2,0,0]=4 5446 B10R1.477 COC1(CCCC1)C(=O)Cl MCULE-6593147343 [0,2,0,0,0,0|2,0,0]=4 5447 B10R1.477 COC1(CCCC1)C(=O)O MCULE-1739308870 [0,2,0,0,0,0|1,0,0]=3 5448 B10R1.477 COC1(CCNC1)C(=O)O MCULE-7327143800 [0,2,0,0,0,0|2,0,0]=4 5449 B10R1.477 COC1(CCNC1)C(=O)O MCULE-9120807147 [0,2,0,0,0,0|2,0,0]=4 5450 B10R1.477 COC1(CCOC1)C(=O)O MCULE-5931705357 [0,2,0,0,0,0|2,0,0]=4 5451 B10R1.477 COC1(CCSC1)C(=O)O MCULE-4950827658 [0,2,0,0,0,0|2,0,0]=4 5452 B10R1.477 N#CC1(CCCC1)C(=O)O MCULE-1638254148 [0,2,0,0,0,0|1,0,0]=3 5453 B10R1.477 N#CC1(CCOC1)C(=O)O MCULE-4615848690 [0,2,0,0,0,0|2,0,0]=4 5454 B10R1.477 NCC1(CCCC1)C(=O)N MCULE-7074465709 [0,2,0,0,0,0|2,0,0]=4 5455 B10R1.477 NCC1(CCCC1)C(=O)O MCULE-2746708245 [0,2,0,0,0,0|1,0,0]=3 5456 B10R1.477 NCC1(CCCC1)C(=O)O MCULE-4666634845 [0,2,0,0,0,0|1,0,0]=3 5457 B10R1.477 O=C(O)C1(CCCC1)CO MCULE-7987056998 [0,2,0,0,0,0|1,0,0]=3 5458 B10R1.477 O=C(O)C1(CCCO1)CO MCULE-7539008546 [0,2,0,0,0,0|0,0,0]=2 5459 B8R1.4 C1(CNCC(=O)N1)C MCULE-3246707428 [0,0,1,1,0,0|2,0,0]=4 5460 B8R1.4 C=C1CCCC(=O)O1 MCULE-1342678884 [0,0,1,1,0,0|1,0,1]=4 5461 B8R1.4 CC1=CC(CCC1)O MCULE-3389687006 [0,0,1,1,0,0|2,0,0]=4 5462 B8R1.4 CC1CC=CC(=O)O1 MCULE-3191839185 [0,0,1,1,0,0|1,0,1]=4 5463 B8R1.4 CC1CCCC(=O)C1 MCULE-6473963111 [0,0,1,1,0,0|2,0,0]=4 5464 B8R1.4 CC1CCCC(=O)C1 MCULE-9918051823 [0,0,1,1,0,0|2,0,0]=4 5465 B8R1.4 CC1CCCC(=O)N1 MCULE-3851963076 [0,0,1,1,0,0|2,0,0]=4 5466 B8R1.4 CC1CCCC(=O)O1 MCULE-4000069856 [0,0,1,1,0,0|1,0,0]=3 5467 B8R1.4 CC1CCOC(=O)O1 MCULE-5929311811 [0,0,1,1,0,0|2,0,0]=4 5468 B8R1.4 CC1CNCC(=O)N1 MCULE-5727167900 [0,0,1,1,0,0|2,0,0]=4 5469 B8R1.4 CC1CNCC(=O)N1 MCULE-9599432640 [0,0,1,1,0,0|2,0,0]=4 5470 B8R1.4 CC1COCC(=O)N1 MCULE-4768427051 [0,0,1,1,0,0|1,0,0]=3 5471 B8R1.4 CC1COCC(=O)N1 MCULE-5909800781 [0,0,1,1,0,0|1,0,0]=3 5472 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-1868776628 [0,0,1,1,0,0|2,0,0]=4 5473 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-6973928430 [0,0,1,1,0,0|2,0,0]=4 5474 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-2050655386 [0,0,1,1,0,0|2,0,0]=4 5475 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-7049359933 [0,0,1,1,0,0|2,0,0]=4 5476 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-6306078053 [0,0,1,1,0,0|1,0,0]=3 5477 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-7616070208 [0,0,1,1,0,0|1,0,0]=3 5478 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-3378865379 [0,0,1,1,0,0|2,0,0]=4 5479 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-5740698320 [0,0,1,1,0,0|2,0,0]=4 5480 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-7692987274 [0,0,1,1,0,0|2,0,0]=4 5481 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-8897582822 [0,0,1,1,0,0|2,0,0]=4 5482 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-1758598852 [0,0,1,1,0,0|1,0,0]=3 5483 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-2011395384 [0,0,1,1,0,0|1,0,0]=3 5484 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-4643975445 [0,0,1,1,0,0|2,0,0]=4 5485 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-6122391840 [0,0,1,1,0,0|2,0,0]=4 5486 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3182538973 [0,0,1,1,0,0|2,0,0]=4 5487 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3207104811 [0,0,1,1,0,0|2,0,0]=4 5488 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-5895954143 [0,0,1,1,0,0|2,0,0]=4 5489 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-6535652978 [0,0,1,1,0,0|2,0,0]=4 5490 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-5693624195 [0,0,1,1,0,0|1,0,0]=3 5491 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-8476323396 [0,0,1,1,0,0|1,0,0]=3 5492 B8R1.4 NC1CCCC(=O)C1 MCULE-3659606498 [0,0,1,1,0,0|2,0,0]=4 5493 B8R1.4 NC1CCCC(=O)C1 MCULE-8815445353 [0,0,1,1,0,0|2,0,0]=4 5494 B8R1.4 NC1COCC(=O)C1 MCULE-4958107203 [0,0,1,1,0,0|2,0,0]=4 5495 B8R1.4 NC1COCC(=O)C1 MCULE-9645630994 [0,0,1,1,0,0|2,0,0]=4 5496 B8R1.4 N[C@@H]1CCCC(=O)C1 MCULE-4006583256 [0,0,1,1,0,0|2,0,0]=4 5497 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-3299834957 [0,0,1,1,0,0|2,0,0]=4 5498 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-6683156371 [0,0,1,1,0,0|2,0,0]=4 5499 B8R1.4 N[C@H]1CCCC(=O)C1 MCULE-9786035316 [0,0,1,1,0,0|2,0,0]=4 5500 B8R1.4 O=C1C=C(CCC1)O MCULE-5615245957 [0,0,1,1,0,0|1,0,1]=4 5501 B8R1.4 O=C1CC(CCN1)O MCULE-5400068518 [0,0,1,1,0,0|2,0,0]=4 5502 B8R1.4 O=C1CC(CCN1)O MCULE-8702086069 [0,0,1,1,0,0|2,0,0]=4 5503 B8R1.4 O=C1CCCC(=O)O1 MCULE-4866925975 [0,0,1,1,0,0|0,0,2]=4 5504 B8R1.4 O=C1CCCC(C1)O MCULE-3100717907 [0,0,1,1,0,0|1,0,0]=3 5505 B8R1.4 O=C1CCC[C@@H](C1)O MCULE-3841179351 [0,0,1,1,0,0|1,0,0]=3 5506 B8R1.4 O=C1COCC(=O)O1 MCULE-7640970930 [0,0,1,1,0,0|1,0,1]=4 5507 B8R1.4 O=C1COCC(C1)O MCULE-6056926421 [0,0,1,1,0,0|2,0,0]=4 5508 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-8279613188 [0,0,1,1,0,0|2,0,0]=4 5509 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-9911849866 [0,0,1,1,0,0|2,0,0]=4 5510 B8R1.4 O=C1C[C@H](CCN1)O MCULE-3843806479 [0,0,1,1,0,0|2,0,0]=4 5511 B8R1.4 O=C1C[C@H](CCN1)O MCULE-9127195212 [0,0,1,1,0,0|2,0,0]=4 5512 B8R1.4 OC1CCCC(C1)O MCULE-5377622416 [0,0,1,1,0,0|1,0,1]=4 5513 B8R1.4 O[C@@H]1CCC[C@H](C1)O MCULE-1135108851 [0,0,1,1,0,0|1,0,1]=4 5514 B8R1.4 O[C@@H]1CCC[C@H](C1)O MCULE-4488851523 [0,0,1,1,0,0|1,0,1]=4 5515 B8R1.4 O[C@H]1CCC[C@@H](C1)O MCULE-4718573149 [0,0,1,1,0,0|1,0,1]=4 5516 B8R1.4 O[C@H]1CCC[C@H](C1)O MCULE-9402957017 [0,0,1,1,0,0|1,0,1]=4 5517 B8R1.4 [C@@H]1(CCCC(=O)N1)C MCULE-8906937588 [0,0,1,1,0,0|2,0,0]=4 5518 B8R1.6 CCCC1CC(=O)C1 MCULE-8820429798 [0,0,1,1,0,0|2,0,0]=4 5519 B8R1.19 CC1(CCCC1O)O MCULE-7509860049 [0,0,1,1,0,0|1,0,1]=4 5520 B8R1.19 CC1COCC1(C)O MCULE-8635665597 [0,0,1,1,0,0|1,0,1]=4 5521 B8R1.19 C[C@@H]1COC[C@]1(C)O MCULE-2882517612 [0,0,1,1,0,0|1,0,1]=4 5522 B8R1.19 C[C@H]1COC[C@@]1(C)O MCULE-6225656472 [0,0,1,1,0,0|1,0,1]=4 5523 B8R1.19 [C@@H]1(COC[C@@]1(C)O)C MCULE-5554336121 [0,0,1,1,0,0|1,0,1]=4 5524 B8R1.20 CC1CC1CC(=O)O MCULE-3151390667 [0,0,1,1,0,0|1,0,0]=3 5525 B8R1.22 O=C1C=CCCCC1 MCULE-5281461360 [0,0,1,1,0,0|2,0,0]=4 5526 B8R1.22 O=C1CCCCCC1 MCULE-3507111924 [0,0,1,1,0,0|2,0,0]=4 5527 B8R1.22 O=C1CCCCCN1 MCULE-4544579564 [0,0,1,1,0,0|2,0,0]=4 5528 B8R1.22 O=C1CCCCCO1 MCULE-3051096014 [0,0,1,1,0,0|1,0,0]=3 5529 B8R1.22 O=C1CCCCNC1 MCULE-8257380915 [0,0,1,1,0,0|2,0,0]=4 5530 B8R1.22 O=C1CCCCNC1 MCULE-8344538815 [0,0,1,1,0,0|2,0,0]=4 5531 B8R1.22 O=C1CCOCCO1 MCULE-1433837187 [0,0,1,1,0,0|2,0,0]=4 5532 B8R1.22 O=C1CNCCCN1 MCULE-6106237928 [0,0,1,1,0,0|2,0,0]=4 5533 B8R1.22 O=C1CNCCCN1 MCULE-9943393784 [0,0,1,1,0,0|2,0,0]=4 5534 B8R1.22 O=C1CNCCOC1 MCULE-7546546158 [0,0,1,1,0,0|2,0,0]=4 5535 B8R1.22 O=C1CNCCOC1 MCULE-9183427962 [0,0,1,1,0,0|2,0,0]=4 5536 B8R1.22 O=C1COCCCN1 MCULE-1471963909 [0,0,1,1,0,0|1,0,0]=3 5537 B8R1.22 O=C1COCCOC1 MCULE-4481438739 [0,0,1,1,0,0|2,0,0]=4 5538 B8R1.22 O=C1OCCCCO1 MCULE-1107419276 [0,0,1,1,0,0|2,0,0]=4 5539 B8R1.34 CC(=O)CC1CCC1 MCULE-8119711389 [0,0,1,1,0,0|2,0,0]=4 5540 B8R1.34 O=C(Cl)CC1CCC1 MCULE-4282346796 [0,0,1,1,0,0|2,0,0]=4 5541 B8R1.34 O=C(O)C=C1CCC1 MCULE-7015909117 [0,0,1,1,0,0|1,0,1]=4 5542 B8R1.34 O=C(O)CC1CCC1 MCULE-3720911045 [0,0,1,1,0,0|1,0,0]=3 5543 B8R1.34 O=C(O)CC1CCN1 MCULE-4161960358 [0,0,1,1,0,0|1,0,0]=3 5544 B8R1.34 O=C(O)CC1CCO1 MCULE-7021545652 [0,0,1,1,0,0|0,0,0]=2 5545 B8R1.34 O=C(O)CC1CNC1 MCULE-4671495498 [0,0,1,1,0,0|2,0,0]=4 5546 B8R1.34 O=C(O)CC1CNC1 MCULE-5456583939 [0,0,1,1,0,0|2,0,0]=4 5547 B8R1.34 O=C(O)CC1CNC1 MCULE-9655427403 [0,0,1,1,0,0|2,0,0]=4 5548 B8R1.34 O=C(O)CC1COC1 MCULE-1090518485 [0,0,1,1,0,0|2,0,0]=4 5549 B8R1.34 O=C(O)CC1CSC1 MCULE-1573505481 [0,0,1,1,0,0|2,0,0]=4 5550 B8R1.34 O=C(O)CN1CCC1 MCULE-2649525817 [0,0,1,1,0,0|1,0,0]=3 5551 B8R1.34 O=C(O)CN1CCC1 MCULE-6889274435 [0,0,1,1,0,0|1,0,0]=3 5552 B8R1.35 CC(=O)CCC1CC1 MCULE-1674877061 [0,0,1,1,0,0|2,0,0]=4 5553 B8R1.35 CC(=O)NCC1CO1 MCULE-8864606081 [0,0,1,1,0,0|2,0,0]=4 5554 B8R1.35 NC(=O)CNC1CC1 MCULE-1569675703 [0,0,1,1,0,0|2,0,0]=4 5555 B8R1.35 NC(=O)CNC1CC1 MCULE-2912062351 [0,0,1,1,0,0|2,0,0]=4 5556 B8R1.35 O=C(O)/C=C/C1CC1 MCULE-2218783834 [0,0,1,1,0,0|1,0,1]=4 5557 B8R1.35 O=C(O)C#CC1CC1 MCULE-8494271998 [0,0,1,1,0,0|1,0,1]=4 5558 B8R1.35 O=C(O)C=CC1CC1 MCULE-9706214568 [0,0,1,1,0,0|1,0,1]=4 5559 B8R1.35 O=C(O)CCC1CC1 MCULE-1377442346 [0,0,1,1,0,0|1,0,0]=3 5560 B8R1.35 O=C(O)CCC1CO1 MCULE-1859826371 [0,0,1,1,0,0|0,0,0]=2 5561 B8R1.35 O=C(O)CCC1N=N1 MCULE-7773347718 [0,0,1,1,0,0|2,0,0]=4 5562 B8R1.35 O=C(O)CNC1CC1 MCULE-7811029224 [0,0,1,1,0,0|1,0,0]=3 5563 B8R1.35 O=C(O)CNC1CC1 MCULE-9104732369 [0,0,1,1,0,0|1,0,0]=3 5564 B8R1.35 O=C(O)COC1CC1 MCULE-2555477617 [0,0,1,1,0,0|0,0,0]=2 5565 B8R1.35 O=C(O)CSC1CC1 MCULE-7890561094 [0,0,1,1,0,0|0,1,0]=3 5566 B8R1.36 CCCOCC1CO1 MCULE-2437381651 [0,0,1,1,0,0|1,0,1]=4 5567 B8R1.36 OCCCCC1CO1 MCULE-4018278864 [0,0,1,1,0,0|1,0,1]=4 5568 B8R1.43 C#CC1CC1C(=O)O MCULE-3287712150 [0,0,1,1,0,0|1,0,1]=4 5569 B8R1.43 C#C[C@@H]1C[C@H]1C(=O)O MCULE-3682886945 [0,0,1,1,0,0|1,0,1]=4 5570 B8R1.43 C#C[C@H]1C[C@@H]1C(=O)O MCULE-7332146893 [0,0,1,1,0,0|1,0,1]=4 5571 B8R1.43 C#C[C@H]1C[C@@H]1C(=O)O MCULE-8247580113 [0,0,1,1,0,0|1,0,1]=4 5572 B8R1.43 C#C[C@H]1C[C@H]1C(=O)O MCULE-7681925135 [0,0,1,1,0,0|1,0,1]=4 5573 B8R1.43 C=C[C@@H]1C[C@H]1C(=O)O MCULE-6323262453 [0,0,1,1,0,0|1,0,1]=4 5574 B8R1.43 C=C[C@H]1C[C@H]1C(=O)O MCULE-6983531899 [0,0,1,1,0,0|1,0,1]=4 5575 B8R1.43 CCC1CC1C(=O)O MCULE-2993174891 [0,0,1,1,0,0|1,0,0]=3 5576 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O MCULE-8944777861 [0,0,1,1,0,0|1,0,0]=3 5577 B8R1.43 COC1CC1C(=O)O MCULE-8490015991 [0,0,1,1,0,0|2,0,0]=4 5578 B8R1.43 N#CC1CC1C(=O)O MCULE-9124706645 [0,0,1,1,0,0|1,0,1]=4 5579 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O MCULE-5445653149 [0,0,1,1,0,0|1,0,1]=4 5580 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O MCULE-6130530861 [0,0,1,1,0,0|1,0,1]=4 5581 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O MCULE-3330628556 [0,0,1,1,0,0|1,0,1]=4 5582 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O MCULE-6684718700 [0,0,1,1,0,0|1,0,1]=4 5583 B8R1.43 NC(=O)C1CC1CO MCULE-3191620985 [0,0,1,1,0,0|1,0,0]=3 5584 B8R1.43 NCC1CC1C(=O)O MCULE-8216751454 [0,0,1,1,0,0|1,0,0]=3 5585 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-3415372050 [0,0,1,1,0,0|1,0,0]=3 5586 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-6765918556 [0,0,1,1,0,0|1,0,0]=3 5587 B8R1.43 O=C(O)C1CC1CCl MCULE-8596410287 [0,0,1,1,0,0|1,0,0]=3 5588 B8R1.43 O=C(O)C1CC1CF MCULE-8263605468 [0,0,1,1,0,0|1,0,0]=3 5589 B8R1.43 O=C(O)C1CC1CO MCULE-5433690867 [0,0,1,1,0,0|0,0,0]=2 5590 B8R1.43 O=C(O)[C@@H]1C[C@H]1CCl MCULE-7560724994 [0,0,1,1,0,0|1,0,0]=3 5591 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO MCULE-9657133495 [0,0,1,1,0,0|0,0,0]=2 5592 B8R1.43 O=C(O)[C@H]1C[C@@H]1CO MCULE-1395497386 [0,0,1,1,0,0|0,0,0]=2 5593 B8R1.43 [C@@H]1(C[C@H]1C(=O)O)C#N MCULE-9124193326 [0,0,1,1,0,0|1,0,1]=4 5594 B8R1.43 [C@H]1(C[C@H]1C(=O)O)C#N MCULE-3751215343 [0,0,1,1,0,0|1,0,1]=4 5595 B8R1.48 O=S1(=O)CCC1CO MCULE-2804079934 [0,0,1,1,0,0|1,0,1]=4 5596 B8R1.72 O=S1(=O)CCCCO1 MCULE-8722166220 [0,0,1,1,0,0|1,0,1]=4 5597 B8R1.5 C=C1CCCCC1O MCULE-3853228524 [0,0,1,1,0,0|2,0,0]=4 5598 B8R1.5 C=C1CCCCC1O MCULE-5911864977 [0,0,1,1,0,0|2,0,0]=4 5599 B8R1.5 CC1CCCCC1=O MCULE-6363555535 [0,0,1,1,0,0|2,0,0]=4 5600 B8R1.5 CC1CCCNC1=O MCULE-5295531632 [0,0,1,1,0,0|2,0,0]=4 5601 B8R1.5 CC1CCCOC1=O MCULE-5926029136 [0,0,1,1,0,0|1,0,0]=3 5602 B8R1.5 CC1NCCCC1=O MCULE-1303642695 [0,0,1,1,0,0|2,0,0]=4 5603 B8R1.5 CC1NCCCC1=O MCULE-6618358169 [0,0,1,1,0,0|2,0,0]=4 5604 B8R1.5 CC1NCCNC1=O MCULE-3078767867 [0,0,1,1,0,0|2,0,0]=4 5605 B8R1.5 CC1NCCNC1=O MCULE-9884862705 [0,0,1,1,0,0|2,0,0]=4 5606 B8R1.5 CC1OCCNC1=O MCULE-8812176499 [0,0,1,1,0,0|1,0,0]=3 5607 B8R1.5 CC1SCCCC1=O MCULE-7641066964 [0,0,1,1,0,0|1,1,0]=4 5608 B8R1.5 CC1SCCNC1=O MCULE-1825894745 [0,0,1,1,0,0|1,1,0]=4 5609 B8R1.5 C[C@@H]1NCCNC1=O MCULE-1719923601 [0,0,1,1,0,0|2,0,0]=4 5610 B8R1.5 C[C@@H]1NCCNC1=O MCULE-3211216058 [0,0,1,1,0,0|2,0,0]=4 5611 B8R1.5 C[C@@H]1NCCNC1=O MCULE-4268624973 [0,0,1,1,0,0|2,0,0]=4 5612 B8R1.5 C[C@H]1NCCNC1=O MCULE-1350777729 [0,0,1,1,0,0|2,0,0]=4 5613 B8R1.5 C[C@H]1NCCNC1=O MCULE-3433713206 [0,0,1,1,0,0|2,0,0]=4 5614 B8R1.5 C[C@H]1NCCNC1=O MCULE-6014092524 [0,0,1,1,0,0|2,0,0]=4 5615 B8R1.5 NC1CCCCC1=O MCULE-2382898926 [0,0,1,1,0,0|2,0,0]=4 5616 B8R1.5 NC1CCCCC1=O MCULE-9230455128 [0,0,1,1,0,0|2,0,0]=4 5617 B8R1.5 NC1CCCNC1=O MCULE-2560564171 [0,0,1,1,0,0|2,0,0]=4 5618 B8R1.5 NC1CCCNC1=O MCULE-4494449620 [0,0,1,1,0,0|2,0,0]=4 5619 B8R1.5 NC1CCCNC1=O MCULE-7473475906 [0,0,1,1,0,0|2,0,0]=4 5620 B8R1.5 NC1CCCNC1=O MCULE-8288645102 [0,0,1,1,0,0|2,0,0]=4 5621 B8R1.5 NN1CCCOC1=O MCULE-6942418314 [0,0,1,1,0,0|2,0,0]=4 5622 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2058435105 [0,0,1,1,0,0|2,0,0]=4 5623 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2444659445 [0,0,1,1,0,0|2,0,0]=4 5624 B8R1.5 N[C@@H]1CCCNC1=O MCULE-3005560472 [0,0,1,1,0,0|2,0,0]=4 5625 B8R1.5 N[C@@H]1CCCNC1=O MCULE-6935410876 [0,0,1,1,0,0|2,0,0]=4 5626 B8R1.5 N[C@H]1CCCNC1=O MCULE-1247931890 [0,0,1,1,0,0|2,0,0]=4 5627 B8R1.5 N[C@H]1CCCNC1=O MCULE-2425510086 [0,0,1,1,0,0|2,0,0]=4 5628 B8R1.5 N[C@H]1CCCNC1=O MCULE-6121950966 [0,0,1,1,0,0|2,0,0]=4 5629 B8R1.5 N[C@H]1CCCNC1=O MCULE-7701042199 [0,0,1,1,0,0|2,0,0]=4 5630 B8R1.5 O=C1CCCCC1Br MCULE-9356057483 [0,0,1,1,0,0|2,0,0]=4 5631 B8R1.5 O=C1CCCCC1Cl MCULE-1580566298 [0,0,1,1,0,0|2,0,0]=4 5632 B8R1.5 O=C1CCCCC1F MCULE-6406930837 [0,0,1,1,0,0|2,0,0]=4 5633 B8R1.5 O=C1CCCCC1O MCULE-7509366699 [0,0,1,1,0,0|1,0,0]=3 5634 B8R1.5 O=C1CCOCC1O MCULE-7032874317 [0,0,1,1,0,0|2,0,0]=4 5635 B8R1.5 O=C1NCCCC1Br MCULE-1860833784 [0,0,1,1,0,0|2,0,0]=4 5636 B8R1.5 O=C1NCCCC1O MCULE-4922755542 [0,0,1,1,0,0|1,0,0]=3 5637 B8R1.5 O=C1NCCC[C@@H]1O MCULE-2813817931 [0,0,1,1,0,0|1,0,0]=3 5638 B8R1.5 O=C1NCCC[C@@H]1O MCULE-3354550946 [0,0,1,1,0,0|1,0,0]=3 5639 B8R1.5 O=C1NCCC[C@H]1O MCULE-2892218765 [0,0,1,1,0,0|1,0,0]=3 5640 B8R1.5 O=C1NCCC[C@H]1O MCULE-8394704933 [0,0,1,1,0,0|1,0,0]=3 5641 B8R1.5 O=C1OCCCC1Br MCULE-4407787541 [0,0,1,1,0,0|1,0,0]=3 5642 B8R1.5 O=C1OCCCC1O MCULE-3021418071 [0,0,1,1,0,0|0,0,0]=2 5643 B8R1.5 OC1CCCC=C1Br MCULE-1040444564 [0,0,1,1,0,0|2,0,0]=4 5644 B8R1.5 OC1CCCCC1O MCULE-2967360901 [0,0,1,1,0,0|1,0,1]=4 5645 B8R1.5 O[C@@H]1CCCC=C1Br MCULE-9847748740 [0,0,1,1,0,0|2,0,0]=4 5646 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3067807104 [0,0,1,1,0,0|1,0,1]=4 5647 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3429096841 [0,0,1,1,0,0|1,0,1]=4 5648 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-9892753066 [0,0,1,1,0,0|1,0,1]=4 5649 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-7078207162 [0,0,1,1,0,0|1,0,1]=4 5650 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-9836847707 [0,0,1,1,0,0|1,0,1]=4 5651 B8R1.5 O[C@H]1CCCC[C@H]1O MCULE-3539097516 [0,0,1,1,0,0|1,0,1]=4 5652 B8R1.13 CCCC1CCC1=O MCULE-7626165824 [0,0,1,1,0,0|2,0,0]=4 5653 B8R1.18 C=C1CC(OC1=O)C MCULE-4610228867 [0,0,1,1,0,0|1,0,1]=4 5654 B8R1.18 CC1=CC(=O)C(O1)C MCULE-7165152063 [0,0,1,1,0,0|1,0,1]=4 5655 B8R1.18 CC1=NC(OC1C)C MCULE-1601265239 [0,0,1,1,0,0|2,0,0]=4 5656 B8R1.18 CC1CC(=O)C(O1)C MCULE-9648127298 [0,0,1,1,0,0|1,0,0]=3 5657 B8R1.18 CC1CC(C(=O)O1)Br MCULE-3628819780 [0,0,1,1,0,0|1,0,0]=3 5658 B8R1.18 CC1CC(C(=O)O1)N MCULE-4414809681 [0,0,1,1,0,0|1,0,0]=3 5659 B8R1.18 CC1CC(C(=O)O1)N MCULE-7247771680 [0,0,1,1,0,0|1,0,0]=3 5660 B8R1.30 CC1(CC1Br)C(=O)O MCULE-8673991477 [0,0,1,1,0,0|2,0,0]=4 5661 B8R1.30 CC1(CC1F)C(=O)O MCULE-8465675013 [0,0,1,1,0,0|2,0,0]=4 5662 B8R1.30 CC1CC1(C)C(=O)O MCULE-8330983425 [0,0,1,1,0,0|1,0,0]=3 5663 B8R1.30 C[C@@]1(C[C@@H]1Br)C(=O)O MCULE-1474744945 [0,0,1,1,0,0|2,0,0]=4 5664 B8R1.30 C[C@]1(C[C@@H]1F)C(=O)O MCULE-3210206701 [0,0,1,1,0,0|2,0,0]=4 5665 B8R1.30 C[C@]1(C[C@H]1F)C(=O)O MCULE-6362421682 [0,0,1,1,0,0|2,0,0]=4 5666 B8R1.30 C[C@]1(C[C@H]1F)C(=O)O MCULE-9963754001 [0,0,1,1,0,0|2,0,0]=4 5667 B8R1.54 C(N)(C(=O)O)C1CC1 MCULE-4833544032 [0,0,1,1,0,0|1,0,0]=3 5668 B8R1.54 C=C(C(=O)O)C1CC1 MCULE-9531805422 [0,0,1,1,0,0|1,0,1]=4 5669 B8R1.54 CC(=C1CC1)C(=O)O MCULE-5864255450 [0,0,1,1,0,0|1,0,1]=4 5670 B8R1.54 CC(=O)C(C)C1CC1 MCULE-9797389889 [0,0,1,1,0,0|2,0,0]=4 5671 B8R1.54 CC(C(=O)O)C1CC1 MCULE-9343385076 [0,0,1,1,0,0|1,0,0]=3 5672 B8R1.54 NC(=O)C(N)C1CC1 MCULE-5863587661 [0,0,1,1,0,0|2,0,0]=4 5673 B8R1.54 NC(=O)C(N)C1CC1 MCULE-5987826744 [0,0,1,1,0,0|2,0,0]=4 5674 B8R1.54 NC(=O)C(O)C1CC1 MCULE-4055290448 [0,0,1,1,0,0|1,0,0]=3 5675 B8R1.54 NC(C(=O)O)C1CC1 MCULE-1974514713 [0,0,1,1,0,0|1,0,0]=3 5676 B8R1.54 NC(C(=O)O)C1CC1 MCULE-3126466096 [0,0,1,1,0,0|1,0,0]=3 5677 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-5662004537 [0,0,1,1,0,0|1,0,0]=3 5678 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-9004548949 [0,0,1,1,0,0|1,0,0]=3 5679 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-4323013494 [0,0,1,1,0,0|1,0,0]=3 5680 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-9475774396 [0,0,1,1,0,0|1,0,0]=3 5681 B8R1.54 O=C(O)C(=O)C1CC1 MCULE-2935818452 [0,0,1,1,0,0|0,0,2]=4 5682 B8R1.54 O=C(O)C(F)C1CC1 MCULE-4799246955 [0,0,1,1,0,0|1,0,0]=3 5683 B8R1.54 O=C(O)C(O)C1CC1 MCULE-9945035089 [0,0,1,1,0,0|0,0,0]=2 5684 B8R1.54 O=C(O)[C@@H](O)C1CC1 MCULE-2409990996 [0,0,1,1,0,0|0,0,0]=2 5685 B8R1.54 O=C(O)[C@H](O)C1CC1 MCULE-2255829314 [0,0,1,1,0,0|0,0,0]=2 5686 B8R1.63 C#CC1(CC1)C(=O)O MCULE-6621925501 [0,0,1,1,0,0|1,0,1]=4 5687 B8R1.63 C=CC1(CC1)C(=O)O MCULE-8050617761 [0,0,1,1,0,0|1,0,1]=4 5688 B8R1.63 CCC1(CC1)C(=O)O MCULE-7607784304 [0,0,1,1,0,0|1,0,0]=3 5689 B8R1.63 CNC1(CC1)C(=O)O MCULE-3174431935 [0,0,1,1,0,0|1,0,0]=3 5690 B8R1.63 CNC1(CC1)C(=O)O MCULE-5558985564 [0,0,1,1,0,0|1,0,0]=3 5691 B8R1.63 COC1(CC1)C(=O)O MCULE-2609996745 [0,0,1,1,0,0|0,0,0]=2 5692 B8R1.63 CSC1(CC1)C(=O)O MCULE-9737877956 [0,0,1,1,0,0|0,1,0]=3 5693 B8R1.63 N#CC1(CC1)C(=O)O MCULE-9709025654 [0,0,1,1,0,0|2,0,0]=4 5694 B8R1.63 NCC1(CC1)C(=O)O MCULE-1804159571 [0,0,1,1,0,0|2,0,0]=4 5695 B8R1.63 NCC1(CC1)C(=O)O MCULE-4552998222 [0,0,1,1,0,0|2,0,0]=4 5696 B8R1.63 O=C(O)C1(CC1)CBr MCULE-6158877293 [0,0,1,1,0,0|2,0,0]=4 5697 B8R1.63 O=C(O)C1(CC1)CF MCULE-8400153389 [0,0,1,1,0,0|2,0,0]=4 5698 B8R1.63 O=C(O)C1(CC1)CO MCULE-4753217590 [0,0,1,1,0,0|2,0,0]=4 5699 B8R1.63 O=CC1(CC1)C(=O)O MCULE-8329913880 [0,0,1,1,0,0|2,0,0]=4 5700 B8R1.67 C[C@H]1[C@H]([C@@H]1C(=O)O)C MCULE-2637094670 [0,0,1,1,0,0|1,0,0]=3 5701 B8R2.34 C12CCC(O1)CC2 MCULE-3311907785 [1,0,0,1,0,0|1,0,1]=4 5702 B8R2.34 C1=CC2CC1CN2 MCULE-8550335449 [1,0,0,1,0,0|2,0,0]=4 5703 B8R2.34 C1=CC2CC1CN2 MCULE-8595299184 [1,0,0,1,0,0|2,0,0]=4 5704 B8R2.34 C1=CC2CC1CN2 MCULE-8666434833 [1,0,0,1,0,0|2,0,0]=4 5705 B8R2.34 C1=CC2CCC1C2 MCULE-5201834756 [1,0,0,1,0,0|2,0,0]=4 5706 B8R2.34 C1=CC2CCC1N2 MCULE-2555429737 [1,0,0,1,0,0|2,0,0]=4 5707 B8R2.34 C1=C[C@@H]2CC[C@H]1C2 MCULE-7203152549 [1,0,0,1,0,0|2,0,0]=4 5708 B8R2.34 C1CC2CCC1O2 MCULE-2448969815 [1,0,0,1,0,0|1,0,1]=4 5709 B8R2.34 C1OC2CNC1C2 MCULE-1822736928 [1,0,0,1,0,0|1,0,1]=4 5710 B8R2.34 C1OC2CNC1C2 MCULE-5214142451 [1,0,0,1,0,0|1,0,1]=4 5711 B8R2.34 C1OC2CNC1C2 MCULE-5921409308 [1,0,0,1,0,0|1,0,1]=4 5712 B8R2.34 C1O[C@@H]2CN[C@H]1C2 MCULE-4658845641 [1,0,0,1,0,0|1,0,1]=4 5713 B8R2.34 C1O[C@@H]2CN[C@H]1C2 MCULE-5841645438 [1,0,0,1,0,0|1,0,1]=4 5714 B8R2.34 C1O[C@@H]2CN[C@H]1C2 MCULE-6364409636 [1,0,0,1,0,0|1,0,1]=4 5715 B8R2.34 C1O[C@@H]2CN[C@H]1C2 MCULE-8524390425 [1,0,0,1,0,0|1,0,1]=4 5716 B8R2.34 C1O[C@H]2CN[C@@H]1C2 MCULE-7383738702 [1,0,0,1,0,0|1,0,1]=4 5717 B8R2.34 C1O[C@H]2CN[C@@H]1C2 MCULE-8517533101 [1,0,0,1,0,0|1,0,1]=4 5718 B8R2.34 [C@@H]12C=C[C@@H](C1)CN2 MCULE-4661302801 [1,0,0,1,0,0|2,0,0]=4 5719 B8R2.34 [C@@H]12C=C[C@@H](C1)CN2 MCULE-8640120207 [1,0,0,1,0,0|2,0,0]=4 5720 B8R2.34 [C@@H]12C=C[C@@H](C1)NC2 MCULE-7320340451 [1,0,0,1,0,0|2,0,0]=4 5721 B8R2.34 [C@@H]12CN[C@H](C1)CO2 MCULE-9276251911 [1,0,0,1,0,0|1,0,1]=4 5722 B8R2.34 [C@@H]12CN[C@H](C1)CO2 MCULE-9302249152 [1,0,0,1,0,0|1,0,1]=4 5723 B8R2.34 [C@@H]12CO[C@@H](C1)CN2 MCULE-1034525360 [1,0,0,1,0,0|1,0,1]=4 5724 B8R2.34 [C@@H]12CO[C@@H](C1)CN2 MCULE-1504973326 [1,0,0,1,0,0|1,0,1]=4 5725 B8R2.34 [C@H]12CO[C@H](C1)CN2 MCULE-1837369673 [1,0,0,1,0,0|1,0,1]=4 5726 B8R2.34 [C@H]12CO[C@H](C1)CN2 MCULE-2902675586 [1,0,0,1,0,0|1,0,1]=4 5727 B8R2.34 [C@H]12CO[C@H](C1)CN2 MCULE-5084112178 [1,0,0,1,0,0|1,0,1]=4 5728 B8R2.34 [C@H]12CO[C@H](C1)CN2 MCULE-5109663912 [1,0,0,1,0,0|1,0,1]=4 5729 B8R2.34 [C@H]12CO[C@H](C1)CN2 MCULE-9224940002 [1,0,0,1,0,0|1,0,1]=4 5730 B8R2.34 [C@H]12CO[C@H](C1)CN2 MCULE-9292793734 [1,0,0,1,0,0|1,0,1]=4 5731 B8R2.34 [C@H]12CO[C@H](C1)CN2 MCULE-9503097866 [1,0,0,1,0,0|1,0,1]=4 5732 B8R2.55 C1CCC2(C1)CO2 MCULE-3685762990 [1,0,0,1,0,0|1,0,1]=4 5733 B8R2.1 C1CC(C1)C2CO2 MCULE-8033150021 [0,0,0,1,1,0|1,0,1]=4 5734 B8R2.4 O=C1CC2CC1C2 MCULE-5372379094 [0,0,0,1,1,0|1,0,0]=3 5735 B10R2.61 O=C1CC2CCCC1C2 MCULE-9902349455 [0,0,0,1,0,1|2,0,0]=4 5736 B10R2.61 O=C1CC2COCC1C2 MCULE-6820169357 [0,0,0,1,0,1|1,0,0]=3 5737 B10R2.61 O=C1NC2CCCC1C2 MCULE-9859470381 [0,0,0,1,0,1|2,0,0]=4 5738 B10R2.61 O=C1NC2CCNC1C2 MCULE-4221823714 [0,0,0,1,0,1|2,0,0]=4 5739 B10R2.61 O=C1N[C@H]2CCC[C@@H]1C2 MCULE-2498857906 [0,0,0,1,0,1|2,0,0]=4 5740 B10R2.61 O=C1OC2C=CCC1C2 MCULE-3922449822 [0,0,0,1,0,1|1,0,1]=4 5741 B10R2.61 O=C1OC2CCNC1C2 MCULE-8392788767 [0,0,0,1,0,1|1,0,0]=3 5742 B10R2.61 O=C1OC2CCOC1C2 MCULE-4977323499 [0,0,0,1,0,1|0,0,0]=2 5743 B10R2.61 OC1CC2COCC1C2 MCULE-2752913110 [0,0,0,1,0,1|1,0,1]=4 5744 B10R2.61 [C@H]12CCC[C@H](C1)C(=O)N2 MCULE-6927488861 [0,0,0,1,0,1|2,0,0]=4 5745 B10R2.62 C12CCC(CC1)C(=O)C2 MCULE-8282529338 [0,0,0,1,0,1|2,0,0]=4 5746 B10R2.62 C12CCC(CC1)C(=O)O2 MCULE-4611258343 [0,0,0,1,0,1|1,0,0]=3 5747 B10R2.62 O=C1CC2C=CC1CC2 MCULE-1084971182 [0,0,0,1,0,1|2,0,0]=4 5748 B10R2.62 O=C1CC2CCC1CC2 MCULE-8331389597 [0,0,0,1,0,1|2,0,0]=4 5749 B10R2.62 O=C1CC2CCC1CN2 MCULE-3732970881 [0,0,0,1,0,1|2,0,0]=4 5750 B10R2.62 O=C1CC2CCC1CN2 MCULE-5949700463 [0,0,0,1,0,1|2,0,0]=4 5751 B10R2.62 O=C1CN2CCC1CC2 MCULE-1582448541 [0,0,0,1,0,1|2,0,0]=4 5752 B10R2.62 O=C1C[C@H]2C=C[C@@H]1CC2 MCULE-6040839273 [0,0,0,1,0,1|2,0,0]=4 5753 B10R2.62 O=C1NC2CCC1CC2 MCULE-1572331637 [0,0,0,1,0,1|2,0,0]=4 5754 B10R2.62 O=C1OC2CCC1CC2 MCULE-7150392682 [0,0,0,1,0,1|1,0,0]=3 5755 B10R2.62 [NH+]12CCC(CC1)C(=O)C2 MCULE-7751080008 [0,0,0,1,0,1|2,0,0]=4 5756 B10R2.320 O=C1CC2C1CCCC2 MCULE-8899093243 [0,0,0,1,0,1|2,0,0]=4 5757 B10R2.320 O=C1NC2C1CCCC2 MCULE-4769358198 [0,0,0,1,0,1|2,0,0]=4 5758 B10R2.344 O=C(O)C12CC1CCN2 MCULE-8958769379 [0,0,0,1,0,1|1,0,0]=3 5759 B10R2.344 O=C(O)C12CC1CCN2 MCULE-9918894627 [0,0,0,1,0,1|1,0,0]=3 5760 B10R2.344 O=C(O)C12CCCC1C2 MCULE-1433395114 [0,0,0,1,0,1|1,0,0]=3 5761 B10R2.344 O=C(O)C12CCNC1C2 MCULE-4622558327 [0,0,0,1,0,1|1,0,0]=3 5762 B10R2.344 O=C(O)C12CCNC1C2 MCULE-5876870827 [0,0,0,1,0,1|1,0,0]=3 5763 B10R2.344 O=C(O)C12CNCC1C2 MCULE-1023234959 [0,0,0,1,0,1|1,0,0]=3 5764 B10R2.344 O=C(O)C12CNCC1C2 MCULE-2698470641 [0,0,0,1,0,1|1,0,0]=3 5765 B10R2.344 O=C(O)C12COCC1C2 MCULE-4962599130 [0,0,0,1,0,1|0,0,0]=2 5766 B10R2.344 O=C(O)[C@@]12CC1CCN2 MCULE-8361805191 [0,0,0,1,0,1|1,0,0]=3 5767 B10R2.344 O=C(O)[C@@]12CC1CCN2 MCULE-9298532680 [0,0,0,1,0,1|1,0,0]=3 5768 B10R2.344 O=C(O)[C@@]12COC[C@@H]1C2 MCULE-5335382694 [0,0,0,1,0,1|0,0,0]=2 5769 B10R2.344 O=C(O)[C@@]12COC[C@@H]1C2 MCULE-6955865926 [0,0,0,1,0,1|0,0,0]=2 5770 B10R2.344 O=C(O)[C@]12COCC1C2 MCULE-6646373866 [0,0,0,1,0,1|0,0,0]=2 5771 B10R2.344 [C@@H]12COC[C@@]1(C2)C(=O)O MCULE-1926490936 [0,0,0,1,0,1|0,0,0]=2 5772 B10R2.344 [C@@H]12COC[C@@]1(C2)C(=O)O MCULE-4045090245 [0,0,0,1,0,1|0,0,0]=2 5773 B10R2.351 C12CNCC1C2C(=O)N MCULE-7561625164 [0,0,0,1,0,1|2,0,0]=4 5774 B10R2.351 NC(=O)C1C2C1CNC2 MCULE-6557910674 [0,0,0,1,0,1|2,0,0]=4 5775 B10R2.351 O=C(O)C1C2C1CCC2 MCULE-5457069948 [0,0,0,1,0,1|1,0,0]=3 5776 B10R2.351 O=C(O)C1C2C1CNC2 MCULE-2636221459 [0,0,0,1,0,1|1,0,0]=3 5777 B10R2.351 O=C(O)C1C2C1CNC2 MCULE-6853944528 [0,0,0,1,0,1|1,0,0]=3 5778 B10R2.351 O=C(O)C1C2C1COC2 MCULE-7410101644 [0,0,0,1,0,1|1,0,0]=3 5779 B10R2.351 O=C(O)C1C2C1OCC2 MCULE-7995568672 [0,0,0,1,0,1|0,0,0]=2 5780 B10R2.351 O=C(O)[C@@H]1[C@@H]2[C@H]1CNC2 MCULE-4336908718 [0,0,0,1,0,1|1,0,0]=3 5781 B10R2.351 O=C(O)[C@@H]1[C@@H]2[C@H]1COC2 MCULE-2602641452 [0,0,0,1,0,1|1,0,0]=3 5782 B10R2.351 O=C(O)[C@H]1[C@@H]2[C@H]1CNC2 MCULE-3047485005 [0,0,0,1,0,1|1,0,0]=3 5783 B10R2.351 O=C(O)[C@H]1[C@@H]2[C@H]1CNC2 MCULE-7215981155 [0,0,0,1,0,1|1,0,0]=3 5784 B10R2.351 [C@@H]12CNC[C@@H]1[C@H]2C(=O)O MCULE-8121766639 [0,0,0,1,0,1|1,0,0]=3 5785 B10R2.351 [C@H]12CNC[C@H]1[C@@H]2C(=O)N MCULE-2633595158 [0,0,0,1,0,1|2,0,0]=4 5786 B10R2.351 [C@H]12CNC[C@H]1[C@@H]2C(=O)N MCULE-4717722182 [0,0,0,1,0,1|2,0,0]=4 5787 B10R2.351 [C@H]12COC[C@H]1[C@H]2C(=O)O MCULE-2561176480 [0,0,0,1,0,1|1,0,0]=3 5788 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-8087821545 [0,0,0,1,0,1|1,0,0]=3 5789 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-9943749675 [0,0,0,1,0,1|1,0,0]=3 5790 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-3741942930 [0,0,0,1,0,1|1,0,0]=3 5791 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-8099098772 [0,0,0,1,0,1|1,0,0]=3 5792 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-6549710478 [0,0,0,1,0,1|1,0,0]=3 5793 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-7349536483 [0,0,0,1,0,1|1,0,0]=3 5794 B10R2.355 O=C(O)[C@H]1NC[C@@H]2[C@H]1C2 MCULE-1865131686 [0,0,0,1,0,1|1,0,0]=3 5795 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-3923610209 [0,0,0,1,0,1|1,0,0]=3 5796 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-6551780838 [0,0,0,1,0,1|1,0,0]=3 5797 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-9694754423 [0,0,0,1,0,1|1,0,0]=3 5798 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-4493728887 [0,0,0,1,0,1|1,0,0]=3 5799 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8766409370 [0,0,0,1,0,1|1,0,0]=3 5800 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8840539566 [0,0,0,1,0,1|1,0,0]=3 5801 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-1970630066 [0,0,0,1,0,1|1,0,0]=3 5802 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-7946950016 [0,0,0,1,0,1|1,0,0]=3 5803 B10R2.355 [C@H]12C[C@H]1CN[C@@H]2C(=O)O MCULE-9408302039 [0,0,0,1,0,1|1,0,0]=3 5804 B10R2.355 [C@H]12C[C@H]1CN[C@H]2C(=O)O MCULE-4802776373 [0,0,0,1,0,1|1,0,0]=3 5805 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-4859115894 [0,0,0,1,0,1|2,0,0]=4 5806 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-7323043594 [0,0,0,1,0,1|2,0,0]=4 5807 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-7946144059 [0,0,0,1,0,1|2,0,0]=4 5808 B10R2.357 O=C(O)C1CC2CC2C1 MCULE-9890442572 [0,0,0,1,0,1|1,0,0]=3 5809 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-4212410891 [0,0,0,1,0,1|1,0,0]=3 5810 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-5642169472 [0,0,0,1,0,1|1,0,0]=3 5811 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-6526449280 [0,0,0,1,0,1|1,0,0]=3 5812 B10R2.357 O=C(O)C1CC2OC2C1 MCULE-1665894100 [0,0,0,1,0,1|1,0,0]=3 5813 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 MCULE-8901519673 [0,0,0,1,0,1|1,0,0]=3 5814 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 MCULE-8974728452 [0,0,0,1,0,1|1,0,0]=3 5815 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-2251552616 [0,0,0,1,0,1|1,0,0]=3 5816 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-3670081653 [0,0,0,1,0,1|1,0,0]=3 5817 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-4127413852 [0,0,0,1,0,1|1,0,0]=3 5818 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-5543837378 [0,0,0,1,0,1|1,0,0]=3 5819 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-2699537727 [0,0,0,1,0,1|1,0,0]=3 5820 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-2957583599 [0,0,0,1,0,1|1,0,0]=3 5821 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-8019742930 [0,0,0,1,0,1|1,0,0]=3 5822 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-9906255485 [0,0,0,1,0,1|1,0,0]=3 5823 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-1783881546 [0,0,0,1,0,1|2,0,0]=4 5824 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-2191940678 [0,0,0,1,0,1|2,0,0]=4 5825 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-3269432034 [0,0,0,1,0,1|2,0,0]=4 5826 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-4463912241 [0,0,0,1,0,1|2,0,0]=4 5827 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-6809518361 [0,0,0,1,0,1|2,0,0]=4 5828 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-6941150528 [0,0,0,1,0,1|2,0,0]=4 5829 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-9444667290 [0,0,0,1,0,1|2,0,0]=4 5830 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-9739462821 [0,0,0,1,0,1|2,0,0]=4 5831 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-3004356941 [0,0,0,1,0,1|1,0,0]=3 5832 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-7104749205 [0,0,0,1,0,1|1,0,0]=3 5833 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-9522199577 [0,0,0,1,0,1|1,0,0]=3 5834 B10R2.2 O=C1CC2C=CCC2O1 MCULE-5417858498 [0,0,0,1,0,1|1,0,1]=4 5835 B10R2.2 O=C1CC2NCCC2N1 MCULE-2516258983 [0,0,0,1,0,1|2,0,0]=4 5836 B10R2.2 O=C1CC2NCCC2N1 MCULE-4812066577 [0,0,0,1,0,1|2,0,0]=4 5837 B10R2.2 O=C1NC2CCCC2O1 MCULE-1083402024 [0,0,0,1,0,1|1,0,0]=3 5838 B10R2.2 [C@@H]12CCC=C1CC(=O)O2 MCULE-9594804536 [0,0,0,1,0,1|1,0,1]=4 5839 B10R2.2 [C@@H]12CCC[C@@H]1NC(=O)C2 MCULE-5874650388 [0,0,0,1,0,1|2,0,0]=4 5840 B10R2.2 [C@H]12CC(=O)N[C@H]1CCN2 MCULE-1007187560 [0,0,0,1,0,1|2,0,0]=4 5841 B10R2.2 [C@H]12CC(=O)N[C@H]1CCN2 MCULE-8278160952 [0,0,0,1,0,1|2,0,0]=4 5842 B10R2.2 [C@H]12CC=C[C@H]1CC(=O)O2 MCULE-4514192918 [0,0,0,1,0,1|1,0,1]=4 5843 B10R2.2 [C@H]12CC=C[C@H]1CC(=O)O2 MCULE-6824565850 [0,0,0,1,0,1|1,0,1]=4 5844 B10R2.2 [C@H]12CCC[C@@H]1OC(=N2)C MCULE-4051509190 [0,0,0,1,0,1|2,0,0]=4 5845 B10R2.71 C1(CC2CCC(C1)O2)O MCULE-1647391755 [0,0,0,1,0,1|1,0,1]=4 5846 B10R2.71 O=C1CC2CCC(C1)C2 MCULE-7387433305 [0,0,0,1,0,1|2,0,0]=4 5847 B10R2.71 O=C1CC2CCC(C1)N2 MCULE-2112708434 [0,0,0,1,0,1|2,0,0]=4 5848 B10R2.71 O=C1CC2CCC(C1)N2 MCULE-8795004919 [0,0,0,1,0,1|2,0,0]=4 5849 B10R2.71 O=C1CC2CCC(C1)O2 MCULE-1445667771 [0,0,0,1,0,1|1,0,0]=3 5850 B10R2.71 O=C1CC2CCC(C1)S2 MCULE-6020280495 [0,0,0,1,0,1|1,1,0]=4 5851 B10R2.71 O=C1CC2COC(C1)O2 MCULE-4570065663 [0,0,0,1,0,1|2,0,0]=4 5852 B10R2.71 O=C1C[C@@H]2CC[C@H](C1)N2 MCULE-5358522556 [0,0,0,1,0,1|2,0,0]=4 5853 B10R2.71 [C@@H]1(C[C@@H]2CC[C@H](C1)O2)O MCULE-3855768470 [0,0,0,1,0,1|1,0,1]=4 5854 B10R2.71 [C@@H]12CC[C@@H](N1)CC(=O)C2 MCULE-2967790803 [0,0,0,1,0,1|2,0,0]=4 5855 B10R2.71 [C@@H]12CC[C@@H](N1)CC(=O)C2 MCULE-9821654462 [0,0,0,1,0,1|2,0,0]=4 5856 B10R2.71 [C@@H]12CC[C@@H](O1)C[C@@H](C2)O MCULE-1754778403 [0,0,0,1,0,1|1,0,1]=4 5857 B10R2.193 C1COC(C1)CC2CO2 MCULE-7632523173 [0,0,0,1,0,1|1,0,1]=4 5858 B10R2.316 O=C1CC2(C1)CCCC2 MCULE-7565643889 [0,0,0,1,0,1|2,0,0]=4 5859 B10R2.316 O=C1CC2(C1)OCCO2 MCULE-1529311905 [0,0,0,1,0,1|2,0,0]=4 5860 B10R2.316 O=C1CC2(N1)CCCC2 MCULE-3716375013 [0,0,0,1,0,1|2,0,0]=4 5861 B10R2.3 O=C1CCC12CCCC2 MCULE-3635781660 [0,1,0,1,0,0|2,0,0]=4 5862 B10R2.3 O=C1CCC12CCCO2 MCULE-2259333653 [0,1,0,1,0,0|1,0,0]=3 5863 B10R2.3 O=C1COC12CCCC2 MCULE-2720364777 [0,1,0,1,0,0|1,0,0]=3 5864 B10R2.3 O=C1NCC12CCCC2 MCULE-1319211994 [0,1,0,1,0,0|2,0,0]=4 5865 B10R2.25 C=C1C(=O)C2CCC1C2 MCULE-6446104918 [0,1,0,1,0,0|2,0,0]=4 5866 B10R2.25 O=C1C2CCC(C2)C1Cl MCULE-5605308647 [0,1,0,1,0,0|2,0,0]=4 5867 B10R2.25 [C@H]12CC[C@H](C1)C(=C)C2=O MCULE-3111478302 [0,1,0,1,0,0|2,0,0]=4 5868 B10R2.25 [C@H]12CC[C@H](C1)C(=C)C2=O MCULE-7597877958 [0,1,0,1,0,0|2,0,0]=4 5869 B10R2.25 [C@H]12CC[C@H](C1)C(C2=O)Cl MCULE-3759432797 [0,1,0,1,0,0|2,0,0]=4 5870 B10R2.32 BrC1=NOC2C1CCC2 MCULE-5136396790 [0,1,0,1,0,0|2,0,0]=4 5871 B10R2.32 C12CCNC1C(=O)NC2 MCULE-9691167616 [0,1,0,1,0,0|2,0,0]=4 5872 B10R2.32 O=C1CCC2C1CCC2 MCULE-7663799084 [0,1,0,1,0,0|2,0,0]=4 5873 B10R2.32 O=C1CCN2C1CCC2 MCULE-3092093752 [0,1,0,1,0,0|2,0,0]=4 5874 B10R2.32 O=C1CCN2C1CCC2 MCULE-4507826088 [0,1,0,1,0,0|2,0,0]=4 5875 B10R2.32 O=C1CCN2C1CCC2 MCULE-7547906890 [0,1,0,1,0,0|2,0,0]=4 5876 B10R2.32 O=C1COC2C1CCO2 MCULE-7661164946 [0,1,0,1,0,0|2,0,0]=4 5877 B10R2.32 O=C1NN=C2C1CCC2 MCULE-4472632000 [0,1,0,1,0,0|2,0,0]=4 5878 B10R2.32 O=C1OCC2C1CCC2 MCULE-1680539728 [0,1,0,1,0,0|1,0,0]=3 5879 B10R2.32 O[C@@H]1CO[C@H]2[C@@H]1OCC2 MCULE-7718906696 [0,1,0,1,0,0|0,0,2]=4 5880 B10R2.32 [C@@H]12CCN[C@@H]1C(=O)NC2 MCULE-6925376025 [0,1,0,1,0,0|2,0,0]=4 5881 B10R2.32 [C@H]12CCC[C@H]1C(=O)OC2 MCULE-7791113994 [0,1,0,1,0,0|1,0,0]=3 5882 B10R2.32 [C@H]12CCN[C@H]1C(=O)NC2 MCULE-5094345573 [0,1,0,1,0,0|2,0,0]=4 5883 B10R2.32 [C@H]12CCN[C@H]1C(=O)NC2 MCULE-5128140663 [0,1,0,1,0,0|2,0,0]=4 5884 B10R2.32 [C@H]12OCC[C@H]1C(=O)CO2 MCULE-1704814142 [0,1,0,1,0,0|2,0,0]=4 5885 B10R2.99 O=CC1CC2CCC1O2 MCULE-4228792822 [0,1,0,1,0,0|1,0,1]=4 5886 B10R2.99 OCC1CC2CCC1O2 MCULE-2678708893 [0,1,0,1,0,0|1,0,1]=4 5887 B10R2.99 OC[C@@H]1C[C@@H]2CC[C@H]1O2 MCULE-7195218381 [0,1,0,1,0,0|1,0,1]=4 5888 B10R2.99 OC[C@@H]1C[C@H]2CC[C@@H]1O2 MCULE-7682722680 [0,1,0,1,0,0|1,0,1]=4 5889 B10R2.99 OC[C@H]1C[C@@H]2CC[C@H]1O2 MCULE-2367755760 [0,1,0,1,0,0|1,0,1]=4 5890 B10R2.99 ON=C1CC2CCC1C2 MCULE-4446489729 [0,1,0,1,0,0|2,0,0]=4 5891 B10R2.178 O=C1C=CC2COC1O2 MCULE-4366139156 [0,1,0,1,0,0|2,0,0]=4 5892 B10R2.178 O=C1C=C[C@H]2CO[C@@H]1O2 MCULE-3146581070 [0,1,0,1,0,0|2,0,0]=4 5893 B10R2.178 O=C1CCC2CCC1C2 MCULE-9878559019 [0,1,0,1,0,0|2,0,0]=4 5894 B10R2.178 O=C1CCC2CCC1N2 MCULE-6973216208 [0,1,0,1,0,0|2,0,0]=4 5895 B10R2.178 O=C1CCC2CCC1N2 MCULE-8820198645 [0,1,0,1,0,0|2,0,0]=4 5896 B10R2.178 O=C1CCC2CCC1O2 MCULE-3236338675 [0,1,0,1,0,0|1,0,0]=3 5897 B10R2.178 O=C1CCC2COC1O2 MCULE-8791862906 [0,1,0,1,0,0|2,0,0]=4 5898 B10R2.178 O=C1CCC2CO[C@@H]1O2 MCULE-2142238590 [0,1,0,1,0,0|2,0,0]=4 5899 B10R2.178 O=C1CC[C@H]2CO[C@@H]1O2 MCULE-9827917652 [0,1,0,1,0,0|2,0,0]=4 5900 B10R2.178 O=C1NCC2CCC1C2 MCULE-3479263424 [0,1,0,1,0,0|2,0,0]=4 5901 B10R2.178 O=C1NCC2CCC1N2 MCULE-3116159232 [0,1,0,1,0,0|2,0,0]=4 5902 B10R2.178 O=C1NCC2CCC1N2 MCULE-6500052801 [0,1,0,1,0,0|2,0,0]=4 5903 B10R2.178 O=C1NCC2CCC1O2 MCULE-2784769464 [0,1,0,1,0,0|1,0,0]=3 5904 B10R2.178 O=C1NC[C@@H]2CC[C@H]1O2 MCULE-2850895205 [0,1,0,1,0,0|1,0,0]=3 5905 B10R2.178 S=C1NCC2CCC1O2 MCULE-5947261418 [0,1,0,1,0,0|1,1,0]=4 5906 B10R2.178 [C@@H]12C=CC(=O)[C@@H](O1)OC2 MCULE-3608004058 [0,1,0,1,0,0|2,0,0]=4 5907 B10R2.178 [C@@H]12CCC(=O)[C@@H](O1)OC2 MCULE-5951038094 [0,1,0,1,0,0|2,0,0]=4 5908 B10R2.178 [C@H]12CCC(N1)CNC2=O MCULE-3692240327 [0,1,0,1,0,0|2,0,0]=4 5909 B10R2.178 [C@H]12CCC(N1)CNC2=O MCULE-7438818057 [0,1,0,1,0,0|2,0,0]=4 5910 B10R2.178 [C@H]12CNC(=O)[C@H](C1)NC2 MCULE-4419255963 [0,1,0,1,0,0|2,0,0]=4 5911 B10R2.178 [C@H]12CNC(=O)[C@H](C1)NC2 MCULE-8674860929 [0,1,0,1,0,0|2,0,0]=4 5912 B10R2.60 O=C1OC2CC1CC2Br MCULE-9788012516 [0,1,0,1,0,0|1,0,0]=3 5913 B10R2.348 NC(=O)C12CC(C1)CN2 MCULE-4899287908 [0,1,0,1,0,0|2,0,0]=4 5914 B10R2.348 NC(=O)C12CCC(C1)C2 MCULE-7319305149 [0,1,0,1,0,0|2,0,0]=4 5915 B10R2.348 O=C(O)C12CC(C1)CN2 MCULE-3301053502 [0,1,0,1,0,0|1,0,0]=3 5916 B10R2.348 O=C(O)C12CC(C1)CN2 MCULE-9060454076 [0,1,0,1,0,0|1,0,0]=3 5917 B10R2.348 O=C(O)C12CC(C1)CO2 MCULE-4565029695 [0,1,0,1,0,0|0,0,0]=2 5918 B10R2.348 O=C(O)C12CC(C1)CO2 MCULE-7423494837 [0,1,0,1,0,0|0,0,0]=2 5919 B10R2.348 O=C(O)C12CCC(C1)C2 MCULE-8219273908 [0,1,0,1,0,0|1,0,0]=3 5920 B10R2.348 O=C(O)C12CNC(C1)C2 MCULE-7157298202 [0,1,0,1,0,0|2,0,0]=4 5921 B10R2.348 O=C(O)C12COC(C1)C2 MCULE-8326120300 [0,1,0,1,0,0|2,0,0]=4 5922 B10R2.20 CN1C2CCC1C(=O)C2 MCULE-2169813004 [0,1,0,1,0,0|2,0,0]=4 5923 B10R2.63 CN1CC2CC(=O)C1C2 MCULE-2081683305 [0,1,0,1,0,0|2,0,0]=4 5924 B10R2.117 CC12CCCC1C(=O)N2 MCULE-9281165627 [0,1,0,1,0,0|2,0,0]=4 5925 B10R2.19 NC12CCC(C1)CC2=O MCULE-5076988928 [0,1,0,1,0,0|2,0,0]=4 5926 B10R2.19 NC12CCC(C1)CC2=O MCULE-6116588211 [0,1,0,1,0,0|2,0,0]=4 5927 B10R3.26 O=C1C2CC3C1C3C2 MCULE-5088609065 [0,0,0,2,0,0|2,0,0]=4 5928 B6R1.6 BrCC1CCC1 MCULE-6307620219 [1,0,0,0,1,0|1,0,1]=4 5929 B6R1.6 BrCC1CCO1 MCULE-8997197221 [1,0,0,0,1,0|1,0,1]=4 5930 B6R1.6 BrC[C@@H]1CCO1 MCULE-5332541596 [1,0,0,0,1,0|1,0,1]=4 5931 B6R1.6 BrC[C@H]1CCO1 MCULE-4327725094 [1,0,0,0,1,0|1,0,1]=4 5932 B6R1.6 BrC[C@H]1CCO1 MCULE-5319595119 [1,0,0,0,1,0|1,0,1]=4 5933 B6R1.6 C#CC1CCC1 MCULE-3076610847 [1,0,0,0,1,0|1,0,1]=4 5934 B6R1.6 C#CC1CCO1 MCULE-6571223458 [1,0,0,0,1,0|1,0,1]=4 5935 B6R1.6 C1(CCN1)CO MCULE-6309114010 [1,0,0,0,1,0|1,0,1]=4 5936 B6R1.6 C=CC1CNC1 MCULE-9929515921 [1,0,0,0,1,0|2,0,0]=4 5937 B6R1.6 CNC1CCC1 MCULE-1364608179 [1,0,0,0,1,0|2,0,0]=4 5938 B6R1.6 CNC1CCC1 MCULE-2951993315 [1,0,0,0,1,0|2,0,0]=4 5939 B6R1.6 ClCC1CCC1 MCULE-2464596839 [1,0,0,0,1,0|1,0,1]=4 5940 B6R1.6 ClCC1CCO1 MCULE-3809712491 [1,0,0,0,1,0|1,0,1]=4 5941 B6R1.6 ICC1CCC1 MCULE-7767711699 [1,0,0,0,1,0|1,0,1]=4 5942 B6R1.6 ICC1CCO1 MCULE-4132798336 [1,0,0,0,1,0|1,0,1]=4 5943 B6R1.6 N#CC1CCC1 MCULE-3335810526 [1,0,0,0,1,0|1,0,1]=4 5944 B6R1.6 NCC1CCC1 MCULE-4977602211 [1,0,0,0,1,0|1,0,1]=4 5945 B6R1.6 NCC1CCC1 MCULE-8434128112 [1,0,0,0,1,0|1,0,1]=4 5946 B6R1.6 NCC1CCO1 MCULE-4478591600 [1,0,0,0,1,0|1,0,1]=4 5947 B6R1.6 NC[C@@H]1CCO1 MCULE-2375359339 [1,0,0,0,1,0|1,0,1]=4 5948 B6R1.6 NC[C@@H]1CCO1 MCULE-4004256578 [1,0,0,0,1,0|1,0,1]=4 5949 B6R1.6 NC[C@H]1CCO1 MCULE-2811111103 [1,0,0,0,1,0|1,0,1]=4 5950 B6R1.6 NC[C@H]1CCO1 MCULE-4329808216 [1,0,0,0,1,0|1,0,1]=4 5951 B6R1.6 NC[C@H]1CCO1 MCULE-9974781002 [1,0,0,0,1,0|1,0,1]=4 5952 B6R1.6 NNC1CCC1 MCULE-2058855063 [1,0,0,0,1,0|2,0,0]=4 5953 B6R1.6 NNC1CCC1 MCULE-2355527907 [1,0,0,0,1,0|2,0,0]=4 5954 B6R1.6 NNC1CCC1 MCULE-7674249555 [1,0,0,0,1,0|2,0,0]=4 5955 B6R1.6 NOC1CCC1 MCULE-2140396646 [1,0,0,0,1,0|2,0,0]=4 5956 B6R1.6 NOC1CCC1 MCULE-9347173321 [1,0,0,0,1,0|2,0,0]=4 5957 B6R1.6 O=CC1CCC1 MCULE-8678026416 [1,0,0,0,1,0|0,0,0]=2 5958 B6R1.6 O=CC1COC1 MCULE-3773699476 [1,0,0,0,1,0|1,0,0]=3 5959 B6R1.6 O=CC1CSC1 MCULE-2648443908 [1,0,0,0,1,0|1,0,0]=3 5960 B6R1.6 OCC1CCC1 MCULE-3046613150 [1,0,0,0,1,0|0,0,1]=3 5961 B6R1.6 OCC1CCN1 MCULE-1812443062 [1,0,0,0,1,0|1,0,1]=4 5962 B6R1.6 OCC1CCN1 MCULE-8390631765 [1,0,0,0,1,0|1,0,1]=4 5963 B6R1.6 OCC1CCO1 MCULE-7120761203 [1,0,0,0,1,0|0,0,1]=3 5964 B6R1.6 OCC1CCO1 MCULE-7517577386 [1,0,0,0,1,0|0,0,1]=3 5965 B6R1.6 OCC1CNC1 MCULE-1537874886 [1,0,0,0,1,0|1,0,1]=4 5966 B6R1.6 OCC1CNC1 MCULE-8316085177 [1,0,0,0,1,0|1,0,1]=4 5967 B6R1.6 OCC1COC1 MCULE-5031415478 [1,0,0,0,1,0|1,0,1]=4 5968 B6R1.6 OCC1CSC1 MCULE-9388221183 [1,0,0,0,1,0|1,0,1]=4 5969 B6R1.6 OC[C@@H]1CCN1 MCULE-5565957906 [1,0,0,0,1,0|1,0,1]=4 5970 B6R1.6 OC[C@@H]1CCN1 MCULE-7064010066 [1,0,0,0,1,0|1,0,1]=4 5971 B6R1.6 OC[C@@H]1CCN1 MCULE-7539121327 [1,0,0,0,1,0|1,0,1]=4 5972 B6R1.6 OC[C@@H]1CCN1 MCULE-9740096939 [1,0,0,0,1,0|1,0,1]=4 5973 B6R1.6 OC[C@@H]1CCO1 MCULE-7613449097 [1,0,0,0,1,0|0,0,1]=3 5974 B6R1.6 OC[C@@H]1CCO1 MCULE-9444003682 [1,0,0,0,1,0|0,0,1]=3 5975 B6R1.6 OC[C@H]1CCN1 MCULE-5733363493 [1,0,0,0,1,0|1,0,1]=4 5976 B6R1.6 OC[C@H]1CCN1 MCULE-8466413816 [1,0,0,0,1,0|1,0,1]=4 5977 B6R1.6 OC[C@H]1CCO1 MCULE-1446169257 [1,0,0,0,1,0|0,0,1]=3 5978 B6R1.6 OC[C@H]1CCO1 MCULE-2929052431 [1,0,0,0,1,0|0,0,1]=3 5979 B6R1.6 ON=C1CCC1 MCULE-4777625640 [1,0,0,0,1,0|1,0,1]=4 5980 B6R1.6 SCC1CCC1 MCULE-4083757063 [1,0,0,0,1,0|0,1,1]=4 5981 B6R1.11 C=C(C)C1CO1 MCULE-3656533343 [0,0,0,0,2,0|2,0,0]=4 5982 B6R1.11 C=C(Cl)C1CO1 MCULE-5190310903 [0,0,0,0,2,0|2,0,0]=4 5983 B6R1.11 CC(=O)C1CC1 MCULE-3846146416 [0,0,0,0,2,0|1,0,0]=3 5984 B6R1.11 CC(=O)C1CO1 MCULE-4329154079 [0,0,0,0,2,0|1,0,0]=3 5985 B6R1.11 CC(O)C1CC1 MCULE-8628810684 [0,0,0,0,2,0|1,0,1]=4 5986 B6R1.11 CC(O)C1CO1 MCULE-2044990126 [0,0,0,0,2,0|1,0,1]=4 5987 B6R1.11 C[C@@H](O)C1CC1 MCULE-8359847821 [0,0,0,0,2,0|1,0,1]=4 5988 B6R1.11 C[C@H](O)C1CC1 MCULE-2458075152 [0,0,0,0,2,0|1,0,1]=4 5989 B6R1.11 N=C(N)C1CC1 MCULE-1244673727 [0,0,0,0,2,0|2,0,0]=4 5990 B6R1.11 N=C(N)C1CC1 MCULE-2494860413 [0,0,0,0,2,0|2,0,0]=4 5991 B6R1.11 NC(=O)C1CC1 MCULE-9911054913 [0,0,0,0,2,0|1,0,0]=3 5992 B6R1.11 NC(=O)C1CO1 MCULE-6911744868 [0,0,0,0,2,0|1,0,0]=3 5993 B6R1.11 NC(=S)C1CC1 MCULE-7304936539 [0,0,0,0,2,0|1,1,0]=4 5994 B6R1.11 O=C(Cl)C1CC1 MCULE-8675746452 [0,0,0,0,2,0|1,0,0]=3 5995 B6R1.11 O=C(O)C1CC1 MCULE-4677373694 [0,0,0,0,2,0|0,0,0]=2 5996 B6R1.11 O=C(O)C1CN1 MCULE-3236125597 [0,0,0,0,2,0|1,0,0]=3 5997 B6R1.11 O=C(O)C1CO1 MCULE-2152916793 [0,0,0,0,2,0|0,0,0]=2 5998 B6R1.11 O=C(O)[C@@H]1CN1 MCULE-4363753412 [0,0,0,0,2,0|1,0,0]=3 5999 B6R1.11 O=C(O)[C@H]1CN1 MCULE-4830347195 [0,0,0,0,2,0|1,0,0]=3 6000 B6R1.11 O=C(O)[C@H]1CO1 MCULE-5204459723 [0,0,0,0,2,0|0,0,0]=2 6001 B6R1.11 O=C(O)[C@H]1CO1 MCULE-6983707093 [0,0,0,0,2,0|0,0,0]=2 6002 B6R1.11 O=C([O-])C1CN1 MCULE-6490437892 [0,0,0,0,2,0|1,0,1]=4 6003 B6R1.11 O=C([O-])C1CO1 MCULE-4586459966 [0,0,0,0,2,0|0,0,1]=3 6004 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1647975669 [0,0,0,0,2,0|0,0,1]=3 6005 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1906997950 [0,0,0,0,2,0|0,0,1]=3 6006 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-4899800766 [0,0,0,0,2,0|0,0,1]=3 6007 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-9148170094 [0,0,0,0,2,0|0,0,1]=3 6008 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-6663734494 [0,0,0,0,2,0|0,0,1]=3 6009 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-8580451361 [0,0,0,0,2,0|0,0,1]=3 6010 B6R1.11 O=S(O)C1CC1 MCULE-1616243918 [0,0,0,0,2,0|1,0,0]=3 6011 B6R1.11 O=S([O-])C1CC1 MCULE-9446364072 [0,0,0,0,2,0|1,0,1]=4 6012 B6R1.11 OB(O)C1CC1 MCULE-5364427631 [0,0,0,0,2,0|1,0,1]=4 6013 B8R0.16 C=CC(CC)CC(=O)O MCULE-3976460208 [0,0,1,0,0,1|1,0,1]=4 6014 B8R0.16 CCC(=CC(=O)O)CC MCULE-1347248467 [0,0,1,0,0,1|1,0,1]=4 6015 B8R0.16 CCC(CC(=O)N)OC MCULE-9685044533 [0,0,1,0,0,1|1,0,0]=3 6016 B8R0.16 CCC(CC(=O)O)OC MCULE-7066116722 [0,0,1,0,0,1|0,0,0]=2 6017 B8R0.16 CCC(CC(=O)O)SC MCULE-6546556452 [0,0,1,0,0,1|0,1,0]=3 6018 B8R0.16 CCC(CC)CC(=O)C MCULE-6127320575 [0,0,1,0,0,1|2,0,0]=4 6019 B8R0.16 CCC(CC)CC(=O)N MCULE-7974720854 [0,0,1,0,0,1|2,0,0]=4 6020 B8R0.16 CCC(CC)CC(=O)O MCULE-1604696319 [0,0,1,0,0,1|1,0,0]=3 6021 B8R0.16 CCN(CC)CC(=O)O MCULE-3120416437 [0,0,1,0,0,1|2,0,0]=4 6022 B8R0.16 CCN(CC)CC(=O)O MCULE-4968287986 [0,0,1,0,0,1|2,0,0]=4 6023 B8R0.16 COC(CC(=O)C)OC MCULE-4638877505 [0,0,1,0,0,1|2,0,0]=4 6024 B8R0.16 COC(CC(=O)N)OC MCULE-8599636273 [0,0,1,0,0,1|2,0,0]=4 6025 B8R0.16 COC(CC(=O)O)OC MCULE-5378328171 [0,0,1,0,0,1|1,0,0]=3 6026 B8R0.16 COC(CN)CC(=O)O MCULE-5640667137 [0,0,1,0,0,1|1,0,0]=3 6027 B8R0.16 COC(CN)CC(=O)O MCULE-6451369002 [0,0,1,0,0,1|1,0,0]=3 6028 B8R1.2 BrCC1CCCCO1 MCULE-7555024882 [1,0,0,0,0,1|1,0,1]=4 6029 B8R1.2 BrCC1CCCOC1 MCULE-8233955986 [1,0,0,0,0,1|1,0,1]=4 6030 B8R1.2 BrCC1CCOCO1 MCULE-1621211624 [1,0,0,0,0,1|1,0,1]=4 6031 B8R1.2 BrCC1CNCCO1 MCULE-4182788522 [1,0,0,0,0,1|1,0,1]=4 6032 B8R1.2 BrCC1CNCCO1 MCULE-4827459875 [1,0,0,0,0,1|1,0,1]=4 6033 B8R1.2 BrCC1COCCO1 MCULE-5294427682 [1,0,0,0,0,1|1,0,1]=4 6034 B8R1.2 BrC[C@@H]1COCCO1 MCULE-4849633409 [1,0,0,0,0,1|1,0,1]=4 6035 B8R1.2 BrC[C@H]1CCCOC1 MCULE-4617251201 [1,0,0,0,0,1|1,0,1]=4 6036 B8R1.2 C#CC1CCCCO1 MCULE-3115070208 [1,0,0,0,0,1|1,0,1]=4 6037 B8R1.2 C#CC1CCCOC1 MCULE-3580388819 [1,0,0,0,0,1|1,0,1]=4 6038 B8R1.2 C#CC1CNCCO1 MCULE-5920372974 [1,0,0,0,0,1|1,0,1]=4 6039 B8R1.2 C1(CCCCN1)CO MCULE-7414417382 [1,0,0,0,0,1|1,0,1]=4 6040 B8R1.2 C1(CCCCO1)CC MCULE-5189391029 [1,0,0,0,0,1|1,0,1]=4 6041 B8R1.2 C1(CCCOC1)CN MCULE-9009856435 [1,0,0,0,0,1|1,0,1]=4 6042 B8R1.2 C1(COCCO1)CN MCULE-3098204775 [1,0,0,0,0,1|1,0,1]=4 6043 B8R1.2 C1(COCCO1)CN MCULE-7024108523 [1,0,0,0,0,1|1,0,1]=4 6044 B8R1.2 C=CC1CCCCC1 MCULE-5657998956 [1,0,0,0,0,1|2,0,0]=4 6045 B8R1.2 C=CC1CCCCN1 MCULE-1327502475 [1,0,0,0,0,1|2,0,0]=4 6046 B8R1.2 C=CC1CCCCN1 MCULE-7059257921 [1,0,0,0,0,1|2,0,0]=4 6047 B8R1.2 C=CC1CCCNC1 MCULE-4200920592 [1,0,0,0,0,1|2,0,0]=4 6048 B8R1.2 C=CC1CCCNC1 MCULE-5849078027 [1,0,0,0,0,1|2,0,0]=4 6049 B8R1.2 C=CC1CCNCC1 MCULE-1082479185 [1,0,0,0,0,1|2,0,0]=4 6050 B8R1.2 C=CC1CCNCC1 MCULE-1750757751 [1,0,0,0,0,1|2,0,0]=4 6051 B8R1.2 CCC1CNCCO1 MCULE-1491754999 [1,0,0,0,0,1|1,0,1]=4 6052 B8R1.2 CCC1CNCCO1 MCULE-2804411387 [1,0,0,0,0,1|1,0,1]=4 6053 B8R1.2 CC[C@@H]1CNCCO1 MCULE-5576287129 [1,0,0,0,0,1|1,0,1]=4 6054 B8R1.2 CC[C@@H]1CNCCO1 MCULE-7329824991 [1,0,0,0,0,1|1,0,1]=4 6055 B8R1.2 CC[C@H]1CNCCO1 MCULE-1213088635 [1,0,0,0,0,1|1,0,1]=4 6056 B8R1.2 CC[C@H]1CNCCO1 MCULE-1732774154 [1,0,0,0,0,1|1,0,1]=4 6057 B8R1.2 CC[C@H]1CNCCO1 MCULE-2604595853 [1,0,0,0,0,1|1,0,1]=4 6058 B8R1.2 CC[C@H]1CNCCO1 MCULE-6508226283 [1,0,0,0,0,1|1,0,1]=4 6059 B8R1.2 CNC1CCCOC1 MCULE-5347484719 [1,0,0,0,0,1|2,0,0]=4 6060 B8R1.2 CNC1CCCOC1 MCULE-9684329786 [1,0,0,0,0,1|2,0,0]=4 6061 B8R1.2 CN[C@@H]1CCCOC1 MCULE-4540841602 [1,0,0,0,0,1|2,0,0]=4 6062 B8R1.2 CN[C@@H]1CCCOC1 MCULE-6421899072 [1,0,0,0,0,1|2,0,0]=4 6063 B8R1.2 CN[C@H]1CCCOC1 MCULE-2085945812 [1,0,0,0,0,1|2,0,0]=4 6064 B8R1.2 CN[C@H]1CCCOC1 MCULE-3537766000 [1,0,0,0,0,1|2,0,0]=4 6065 B8R1.2 COC1CCCCO1 MCULE-5586923898 [1,0,0,0,0,1|2,0,0]=4 6066 B8R1.2 COC1CNCCO1 MCULE-4273991787 [1,0,0,0,0,1|2,0,0]=4 6067 B8R1.2 ClCC1CCCCO1 MCULE-7493119643 [1,0,0,0,0,1|1,0,1]=4 6068 B8R1.2 ClCC1CCCOC1 MCULE-8502008950 [1,0,0,0,0,1|1,0,1]=4 6069 B8R1.2 ClCC1CCOCO1 MCULE-9757657411 [1,0,0,0,0,1|1,0,1]=4 6070 B8R1.2 ClCC1CNCCO1 MCULE-6977459966 [1,0,0,0,0,1|1,0,1]=4 6071 B8R1.2 ClCC1CNCCO1 MCULE-7633503523 [1,0,0,0,0,1|1,0,1]=4 6072 B8R1.2 ClCC1COCCO1 MCULE-5491048081 [1,0,0,0,0,1|1,0,1]=4 6073 B8R1.2 ClCC1OCCCO1 MCULE-7396357867 [1,0,0,0,0,1|1,0,1]=4 6074 B8R1.2 ClC[C@@H]1CNCCO1 MCULE-8134652552 [1,0,0,0,0,1|1,0,1]=4 6075 B8R1.2 ClC[C@H]1CNCCO1 MCULE-4491372571 [1,0,0,0,0,1|1,0,1]=4 6076 B8R1.2 FCC1CNCCO1 MCULE-1442465580 [1,0,0,0,0,1|1,0,1]=4 6077 B8R1.2 FCC1CNCCO1 MCULE-9755393279 [1,0,0,0,0,1|1,0,1]=4 6078 B8R1.2 ICC1CCCCO1 MCULE-4630701067 [1,0,0,0,0,1|1,0,1]=4 6079 B8R1.2 ICC1CCCOC1 MCULE-7706519514 [1,0,0,0,0,1|1,0,1]=4 6080 B8R1.2 ICC1COCCO1 MCULE-1992463610 [1,0,0,0,0,1|1,0,1]=4 6081 B8R1.2 N#CC1CCCCO1 MCULE-3506953632 [1,0,0,0,0,1|1,0,1]=4 6082 B8R1.2 N#CC1CCCOC1 MCULE-2931796321 [1,0,0,0,0,1|1,0,1]=4 6083 B8R1.2 N#CC1CNCCO1 MCULE-4550543456 [1,0,0,0,0,1|1,0,1]=4 6084 B8R1.2 N#CC1CNCCO1 MCULE-6560196862 [1,0,0,0,0,1|1,0,1]=4 6085 B8R1.2 N#CC1COCCO1 MCULE-2295478591 [1,0,0,0,0,1|1,0,1]=4 6086 B8R1.2 N#C[C@@H]1CNCCO1 MCULE-1210885105 [1,0,0,0,0,1|1,0,1]=4 6087 B8R1.2 N#C[C@@H]1CNCCO1 MCULE-1702118123 [1,0,0,0,0,1|1,0,1]=4 6088 B8R1.2 N#C[C@H]1CNCCO1 MCULE-7284312056 [1,0,0,0,0,1|1,0,1]=4 6089 B8R1.2 N#C[C@H]1CNCCO1 MCULE-7835414987 [1,0,0,0,0,1|1,0,1]=4 6090 B8R1.2 N#C[C@H]1CNCCO1 MCULE-8434238785 [1,0,0,0,0,1|1,0,1]=4 6091 B8R1.2 N#C[C@H]1CNCCO1 MCULE-9489364726 [1,0,0,0,0,1|1,0,1]=4 6092 B8R1.2 NCC1CCCCO1 MCULE-2644735894 [1,0,0,0,0,1|1,0,1]=4 6093 B8R1.2 NCC1CCCCO1 MCULE-5042678896 [1,0,0,0,0,1|1,0,1]=4 6094 B8R1.2 NCC1CCCOC1 MCULE-2859652493 [1,0,0,0,0,1|1,0,1]=4 6095 B8R1.2 NCC1CCCOC1 MCULE-5411442728 [1,0,0,0,0,1|1,0,1]=4 6096 B8R1.2 NCC1CCCOC1 MCULE-6616131288 [1,0,0,0,0,1|1,0,1]=4 6097 B8R1.2 NCC1CCCOC1 MCULE-9893994601 [1,0,0,0,0,1|1,0,1]=4 6098 B8R1.2 NCC1CNCCO1 MCULE-4362254656 [1,0,0,0,0,1|1,0,1]=4 6099 B8R1.2 NCC1CNCCO1 MCULE-9062864656 [1,0,0,0,0,1|1,0,1]=4 6100 B8R1.2 NCC1COCCO1 MCULE-1612004893 [1,0,0,0,0,1|1,0,1]=4 6101 B8R1.2 NCC1COCCO1 MCULE-9278150730 [1,0,0,0,0,1|1,0,1]=4 6102 B8R1.2 NCC1OCCCO1 MCULE-8138335107 [1,0,0,0,0,1|1,0,1]=4 6103 B8R1.2 NC[C@@H]1CCCCO1 MCULE-1435985280 [1,0,0,0,0,1|1,0,1]=4 6104 B8R1.2 NC[C@@H]1CCCCO1 MCULE-4778440271 [1,0,0,0,0,1|1,0,1]=4 6105 B8R1.2 NC[C@@H]1CCCCO1 MCULE-6014338525 [1,0,0,0,0,1|1,0,1]=4 6106 B8R1.2 NC[C@@H]1CCCCO1 MCULE-9488694680 [1,0,0,0,0,1|1,0,1]=4 6107 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5314997557 [1,0,0,0,0,1|1,0,1]=4 6108 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5553412637 [1,0,0,0,0,1|1,0,1]=4 6109 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6349833867 [1,0,0,0,0,1|1,0,1]=4 6110 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6463109886 [1,0,0,0,0,1|1,0,1]=4 6111 B8R1.2 NC[C@@H]1COCCO1 MCULE-2337005422 [1,0,0,0,0,1|1,0,1]=4 6112 B8R1.2 NC[C@@H]1COCCO1 MCULE-5052227155 [1,0,0,0,0,1|1,0,1]=4 6113 B8R1.2 NC[C@@H]1COCCO1 MCULE-5182478394 [1,0,0,0,0,1|1,0,1]=4 6114 B8R1.2 NC[C@@H]1COCCO1 MCULE-9731790782 [1,0,0,0,0,1|1,0,1]=4 6115 B8R1.2 NC[C@H]1CCCCO1 MCULE-2835389541 [1,0,0,0,0,1|1,0,1]=4 6116 B8R1.2 NC[C@H]1CCCCO1 MCULE-4500797236 [1,0,0,0,0,1|1,0,1]=4 6117 B8R1.2 NC[C@H]1CCCCO1 MCULE-5990717573 [1,0,0,0,0,1|1,0,1]=4 6118 B8R1.2 NC[C@H]1CCCCO1 MCULE-7362278601 [1,0,0,0,0,1|1,0,1]=4 6119 B8R1.2 NC[C@H]1CCCOC1 MCULE-1996808023 [1,0,0,0,0,1|1,0,1]=4 6120 B8R1.2 NC[C@H]1CCCOC1 MCULE-8044635428 [1,0,0,0,0,1|1,0,1]=4 6121 B8R1.2 NC[C@H]1CCCOC1 MCULE-8246511133 [1,0,0,0,0,1|1,0,1]=4 6122 B8R1.2 NC[C@H]1CCCOC1 MCULE-8378816563 [1,0,0,0,0,1|1,0,1]=4 6123 B8R1.2 NC[C@H]1COCCO1 MCULE-1148680339 [1,0,0,0,0,1|1,0,1]=4 6124 B8R1.2 NC[C@H]1COCCO1 MCULE-6244775356 [1,0,0,0,0,1|1,0,1]=4 6125 B8R1.2 NC[C@H]1COCCO1 MCULE-6383517047 [1,0,0,0,0,1|1,0,1]=4 6126 B8R1.2 NC[C@H]1COCCO1 MCULE-9768281737 [1,0,0,0,0,1|1,0,1]=4 6127 B8R1.2 NNC1CCCOC1 MCULE-3363963508 [1,0,0,0,0,1|2,0,0]=4 6128 B8R1.2 NNC1CCCOC1 MCULE-4328194619 [1,0,0,0,0,1|2,0,0]=4 6129 B8R1.2 NNC1CCCOC1 MCULE-6284470956 [1,0,0,0,0,1|2,0,0]=4 6130 B8R1.2 NN[C@H]1CCCOC1 MCULE-1777058599 [1,0,0,0,0,1|2,0,0]=4 6131 B8R1.2 NN[C@H]1CCCOC1 MCULE-4593180841 [1,0,0,0,0,1|2,0,0]=4 6132 B8R1.2 NOC1CCCCO1 MCULE-2818785498 [1,0,0,0,0,1|2,0,0]=4 6133 B8R1.2 O=CC1=CCCCC1 MCULE-6209420256 [1,0,0,0,0,1|1,0,1]=4 6134 B8R1.2 O=CC1=CCCOC1 MCULE-5495935874 [1,0,0,0,0,1|0,0,2]=4 6135 B8R1.2 O=CC1=CCCSC1 MCULE-9611960845 [1,0,0,0,0,1|1,0,1]=4 6136 B8R1.2 O=CC1=COCCC1 MCULE-5246467858 [1,0,0,0,0,1|0,0,1]=3 6137 B8R1.2 O=CC1=COCCO1 MCULE-4502742368 [1,0,0,0,0,1|0,0,2]=4 6138 B8R1.2 O=CC1C=CCCC1 MCULE-7360804121 [1,0,0,0,0,1|1,0,0]=3 6139 B8R1.2 O=CC1CC=CCC1 MCULE-4752119585 [1,0,0,0,0,1|1,0,1]=4 6140 B8R1.2 O=CC1CCC=CO1 MCULE-1271711654 [1,0,0,0,0,1|0,0,1]=3 6141 B8R1.2 O=CC1CCCCC1 MCULE-7345097178 [1,0,0,0,0,1|1,0,0]=3 6142 B8R1.2 O=CC1CCCCN1 MCULE-7681438476 [1,0,0,0,0,1|1,0,0]=3 6143 B8R1.2 O=CC1CCCCN1 MCULE-9370686295 [1,0,0,0,0,1|1,0,0]=3 6144 B8R1.2 O=CC1CCCCO1 MCULE-6497412510 [1,0,0,0,0,1|0,0,0]=2 6145 B8R1.2 O=CC1CCCNC1 MCULE-4037480911 [1,0,0,0,0,1|1,0,0]=3 6146 B8R1.2 O=CC1CCCNC1 MCULE-9205787069 [1,0,0,0,0,1|1,0,0]=3 6147 B8R1.2 O=CC1CCCOC1 MCULE-6841728518 [1,0,0,0,0,1|0,0,0]=2 6148 B8R1.2 O=CC1CCCSC1 MCULE-8369808876 [1,0,0,0,0,1|0,1,0]=3 6149 B8R1.2 O=CC1CCNCC1 MCULE-3856245073 [1,0,0,0,0,1|1,0,0]=3 6150 B8R1.2 O=CC1CCNCC1 MCULE-8439609130 [1,0,0,0,0,1|1,0,0]=3 6151 B8R1.2 O=CC1CCOCC1 MCULE-6884786677 [1,0,0,0,0,1|1,0,0]=3 6152 B8R1.2 O=CC1CCSCC1 MCULE-4728594373 [1,0,0,0,0,1|1,0,0]=3 6153 B8R1.2 O=CC1COCCO1 MCULE-3817488986 [1,0,0,0,0,1|0,0,0]=2 6154 B8R1.2 O=CN1CCCCC1 MCULE-3028605826 [1,0,0,0,0,1|2,0,0]=4 6155 B8R1.2 O=CN1CCNCC1 MCULE-8359044100 [1,0,0,0,0,1|2,0,0]=4 6156 B8R1.2 O=CN1CCOCC1 MCULE-2465964585 [1,0,0,0,0,1|2,0,0]=4 6157 B8R1.2 O=C[C@@H]1CCC=CO1 MCULE-1864295712 [1,0,0,0,0,1|0,0,1]=3 6158 B8R1.2 OCC1=CCCCO1 MCULE-1995059172 [1,0,0,0,0,1|0,0,2]=4 6159 B8R1.2 OCC1=NOCCC1 MCULE-7754725295 [1,0,0,0,0,1|0,0,2]=4 6160 B8R1.2 OCC1C=CCCC1 MCULE-3264381346 [1,0,0,0,0,1|1,0,1]=4 6161 B8R1.2 OCC1CC=CCO1 MCULE-1009946564 [1,0,0,0,0,1|0,0,2]=4 6162 B8R1.2 OCC1CCC=CO1 MCULE-7646685626 [1,0,0,0,0,1|0,0,2]=4 6163 B8R1.2 OCC1CCCCC1 MCULE-6571547092 [1,0,0,0,0,1|1,0,1]=4 6164 B8R1.2 OCC1CCCCN1 MCULE-1839660028 [1,0,0,0,0,1|1,0,1]=4 6165 B8R1.2 OCC1CCCCN1 MCULE-5190999833 [1,0,0,0,0,1|1,0,1]=4 6166 B8R1.2 OCC1CCCCO1 MCULE-2390789074 [1,0,0,0,0,1|0,0,1]=3 6167 B8R1.2 OCC1CCCCO1 MCULE-7483291767 [1,0,0,0,0,1|0,0,1]=3 6168 B8R1.2 OCC1CCCCS1 MCULE-8533707311 [1,0,0,0,0,1|0,1,1]=4 6169 B8R1.2 OCC1CCCNC1 MCULE-1126180349 [1,0,0,0,0,1|1,0,1]=4 6170 B8R1.2 OCC1CCCNC1 MCULE-1796388857 [1,0,0,0,0,1|1,0,1]=4 6171 B8R1.2 OCC1CCCNC1 MCULE-3885962581 [1,0,0,0,0,1|1,0,1]=4 6172 B8R1.2 OCC1CCCNC1 MCULE-9246039906 [1,0,0,0,0,1|1,0,1]=4 6173 B8R1.2 OCC1CCCOC1 MCULE-6464024960 [1,0,0,0,0,1|0,0,1]=3 6174 B8R1.2 OCC1CCCOC1 MCULE-9624599290 [1,0,0,0,0,1|0,0,1]=3 6175 B8R1.2 OCC1CCCSC1 MCULE-1730158244 [1,0,0,0,0,1|0,1,1]=4 6176 B8R1.2 OCC1CCNCC1 MCULE-3303736479 [1,0,0,0,0,1|1,0,1]=4 6177 B8R1.2 OCC1CCNCC1 MCULE-5679503328 [1,0,0,0,0,1|1,0,1]=4 6178 B8R1.2 OCC1CCNCO1 MCULE-2495139428 [1,0,0,0,0,1|0,0,1]=3 6179 B8R1.2 OCC1CCNCO1 MCULE-8567556837 [1,0,0,0,0,1|0,0,1]=3 6180 B8R1.2 OCC1CCOCC1 MCULE-8259124266 [1,0,0,0,0,1|1,0,1]=4 6181 B8R1.2 OCC1CCOCO1 MCULE-2733488185 [1,0,0,0,0,1|0,0,1]=3 6182 B8R1.2 OCC1CCSCC1 MCULE-5223983457 [1,0,0,0,0,1|1,0,1]=4 6183 B8R1.2 OCC1CNCCN1 MCULE-1401587868 [1,0,0,0,0,1|1,0,1]=4 6184 B8R1.2 OCC1CNCCN1 MCULE-7423856879 [1,0,0,0,0,1|1,0,1]=4 6185 B8R1.2 OCC1CNCCN1 MCULE-8309538868 [1,0,0,0,0,1|1,0,1]=4 6186 B8R1.2 OCC1CNCCN1 MCULE-9359285661 [1,0,0,0,0,1|1,0,1]=4 6187 B8R1.2 OCC1CNCCO1 MCULE-1938288280 [1,0,0,0,0,1|0,0,1]=3 6188 B8R1.2 OCC1CNCCO1 MCULE-7041892647 [1,0,0,0,0,1|0,0,1]=3 6189 B8R1.2 OCC1CNCCO1 MCULE-8873542150 [1,0,0,0,0,1|0,0,1]=3 6190 B8R1.2 OCC1CNCCO1 MCULE-9279337391 [1,0,0,0,0,1|0,0,1]=3 6191 B8R1.2 OCC1COCCN1 MCULE-1141875416 [1,0,0,0,0,1|1,0,1]=4 6192 B8R1.2 OCC1COCCN1 MCULE-2383049328 [1,0,0,0,0,1|1,0,1]=4 6193 B8R1.2 OCC1COCCN1 MCULE-3747324792 [1,0,0,0,0,1|1,0,1]=4 6194 B8R1.2 OCC1COCCN1 MCULE-8656197859 [1,0,0,0,0,1|1,0,1]=4 6195 B8R1.2 OCC1COCCO1 MCULE-3788845525 [1,0,0,0,0,1|0,0,1]=3 6196 B8R1.2 OCC1COCCO1 MCULE-5558091087 [1,0,0,0,0,1|0,0,1]=3 6197 B8R1.2 OCC1CSCCN1 MCULE-9615907863 [1,0,0,0,0,1|1,0,1]=4 6198 B8R1.2 OCC1OCCCO1 MCULE-6150110813 [1,0,0,0,0,1|0,0,1]=3 6199 B8R1.2 OC[C@@H]1CCCCN1 MCULE-6170192975 [1,0,0,0,0,1|1,0,1]=4 6200 B8R1.2 OC[C@@H]1CCCCN1 MCULE-7805438267 [1,0,0,0,0,1|1,0,1]=4 6201 B8R1.2 OC[C@@H]1CCCCN1 MCULE-8160671578 [1,0,0,0,0,1|1,0,1]=4 6202 B8R1.2 OC[C@@H]1CCCCO1 MCULE-5978396739 [1,0,0,0,0,1|0,0,1]=3 6203 B8R1.2 OC[C@@H]1CCCCO1 MCULE-8715909099 [1,0,0,0,0,1|0,0,1]=3 6204 B8R1.2 OC[C@@H]1CCCNC1 MCULE-1362591489 [1,0,0,0,0,1|1,0,1]=4 6205 B8R1.2 OC[C@@H]1CCCNC1 MCULE-2943211570 [1,0,0,0,0,1|1,0,1]=4 6206 B8R1.2 OC[C@@H]1CCCNC1 MCULE-8452110091 [1,0,0,0,0,1|1,0,1]=4 6207 B8R1.2 OC[C@@H]1CCCNC1 MCULE-9511978382 [1,0,0,0,0,1|1,0,1]=4 6208 B8R1.2 OC[C@@H]1CCCOC1 MCULE-5580637299 [1,0,0,0,0,1|0,0,1]=3 6209 B8R1.2 OC[C@@H]1CCCOC1 MCULE-9673827278 [1,0,0,0,0,1|0,0,1]=3 6210 B8R1.2 OC[C@@H]1CNCCN1 MCULE-3656110325 [1,0,0,0,0,1|1,0,1]=4 6211 B8R1.2 OC[C@@H]1CNCCN1 MCULE-7030471384 [1,0,0,0,0,1|1,0,1]=4 6212 B8R1.2 OC[C@@H]1CNCCN1 MCULE-7465480170 [1,0,0,0,0,1|1,0,1]=4 6213 B8R1.2 OC[C@@H]1CNCCN1 MCULE-9542102138 [1,0,0,0,0,1|1,0,1]=4 6214 B8R1.2 OC[C@@H]1CNCCO1 MCULE-5428209505 [1,0,0,0,0,1|0,0,1]=3 6215 B8R1.2 OC[C@@H]1CNCCO1 MCULE-6006812099 [1,0,0,0,0,1|0,0,1]=3 6216 B8R1.2 OC[C@@H]1CNCCO1 MCULE-6118730357 [1,0,0,0,0,1|0,0,1]=3 6217 B8R1.2 OC[C@@H]1CNCCO1 MCULE-9753568594 [1,0,0,0,0,1|0,0,1]=3 6218 B8R1.2 OC[C@@H]1COCCN1 MCULE-2260461335 [1,0,0,0,0,1|1,0,1]=4 6219 B8R1.2 OC[C@@H]1COCCN1 MCULE-7365178843 [1,0,0,0,0,1|1,0,1]=4 6220 B8R1.2 OC[C@@H]1COCCN1 MCULE-8155625467 [1,0,0,0,0,1|1,0,1]=4 6221 B8R1.2 OC[C@@H]1COCCN1 MCULE-9822056975 [1,0,0,0,0,1|1,0,1]=4 6222 B8R1.2 OC[C@@H]1COCCO1 MCULE-5847134890 [1,0,0,0,0,1|0,0,1]=3 6223 B8R1.2 OC[C@@H]1COCCO1 MCULE-6096501847 [1,0,0,0,0,1|0,0,1]=3 6224 B8R1.2 OC[C@H]1CCC=CO1 MCULE-3753346509 [1,0,0,0,0,1|0,0,2]=4 6225 B8R1.2 OC[C@H]1CCCCN1 MCULE-1585224164 [1,0,0,0,0,1|1,0,1]=4 6226 B8R1.2 OC[C@H]1CCCCN1 MCULE-2860177964 [1,0,0,0,0,1|1,0,1]=4 6227 B8R1.2 OC[C@H]1CCCCO1 MCULE-4700719427 [1,0,0,0,0,1|0,0,1]=3 6228 B8R1.2 OC[C@H]1CCCCO1 MCULE-7990169259 [1,0,0,0,0,1|0,0,1]=3 6229 B8R1.2 OC[C@H]1CCCNC1 MCULE-3504380705 [1,0,0,0,0,1|1,0,1]=4 6230 B8R1.2 OC[C@H]1CCCNC1 MCULE-6518143765 [1,0,0,0,0,1|1,0,1]=4 6231 B8R1.2 OC[C@H]1CCCNC1 MCULE-6752674060 [1,0,0,0,0,1|1,0,1]=4 6232 B8R1.2 OC[C@H]1CCCNC1 MCULE-9392193352 [1,0,0,0,0,1|1,0,1]=4 6233 B8R1.2 OC[C@H]1CCCOC1 MCULE-8066618329 [1,0,0,0,0,1|0,0,1]=3 6234 B8R1.2 OC[C@H]1CCCOC1 MCULE-8831105119 [1,0,0,0,0,1|0,0,1]=3 6235 B8R1.2 OC[C@H]1CNCCN1 MCULE-2062612556 [1,0,0,0,0,1|1,0,1]=4 6236 B8R1.2 OC[C@H]1CNCCN1 MCULE-3003505442 [1,0,0,0,0,1|1,0,1]=4 6237 B8R1.2 OC[C@H]1CNCCN1 MCULE-3400481255 [1,0,0,0,0,1|1,0,1]=4 6238 B8R1.2 OC[C@H]1CNCCN1 MCULE-5683382374 [1,0,0,0,0,1|1,0,1]=4 6239 B8R1.2 OC[C@H]1CNCCN1 MCULE-8795905011 [1,0,0,0,0,1|1,0,1]=4 6240 B8R1.2 OC[C@H]1CNCCO1 MCULE-2083087681 [1,0,0,0,0,1|0,0,1]=3 6241 B8R1.2 OC[C@H]1CNCCO1 MCULE-2399844881 [1,0,0,0,0,1|0,0,1]=3 6242 B8R1.2 OC[C@H]1CNCCO1 MCULE-5372536833 [1,0,0,0,0,1|0,0,1]=3 6243 B8R1.2 OC[C@H]1CNCCO1 MCULE-9994722027 [1,0,0,0,0,1|0,0,1]=3 6244 B8R1.2 OC[C@H]1COCCN1 MCULE-2570187475 [1,0,0,0,0,1|1,0,1]=4 6245 B8R1.2 OC[C@H]1COCCN1 MCULE-5479794518 [1,0,0,0,0,1|1,0,1]=4 6246 B8R1.2 OC[C@H]1COCCN1 MCULE-5550353523 [1,0,0,0,0,1|1,0,1]=4 6247 B8R1.2 OC[C@H]1COCCN1 MCULE-6091772249 [1,0,0,0,0,1|1,0,1]=4 6248 B8R1.2 OC[C@H]1COCCO1 MCULE-1373070349 [1,0,0,0,0,1|0,0,1]=3 6249 B8R1.2 OC[C@H]1COCCO1 MCULE-9271539014 [1,0,0,0,0,1|0,0,1]=3 6250 B8R1.2 ONC1CCCCC1 MCULE-7854482550 [1,0,0,0,0,1|2,0,0]=4 6251 B8R1.2 O[NH2+]C1CCCCC1 MCULE-5578731568 [1,0,0,0,0,1|2,0,0]=4 6252 B8R1.2 SCC1CCCOC1 MCULE-1197721149 [1,0,0,0,0,1|0,1,1]=4 6253 B10R1.18 CC(=O)CC1CCCCC1 MCULE-4557008527 [0,0,0,0,0,2|2,0,0]=4 6254 B10R1.18 CC(=O)CC1CCCCN1 MCULE-1827771795 [0,0,0,0,0,2|2,0,0]=4 6255 B10R1.18 CC(=O)CC1CCCCN1 MCULE-9317294757 [0,0,0,0,0,2|2,0,0]=4 6256 B10R1.18 CC(=O)CC1CCCCO1 MCULE-1058487646 [0,0,0,0,0,2|1,0,0]=3 6257 B10R1.18 CC(=O)CC1CCCOC1 MCULE-4781249046 [0,0,0,0,0,2|1,0,0]=3 6258 B10R1.18 CC(=O)CC1CCNCC1 MCULE-3381787603 [0,0,0,0,0,2|2,0,0]=4 6259 B10R1.18 CC(=O)CC1CCNCC1 MCULE-3485224360 [0,0,0,0,0,2|2,0,0]=4 6260 B10R1.18 CC(=O)CC1CCOCC1 MCULE-6845890561 [0,0,0,0,0,2|2,0,0]=4 6261 B10R1.18 CC(=O)CC1COCCN1 MCULE-5675632157 [0,0,0,0,0,2|2,0,0]=4 6262 B10R1.18 CC(=O)CC1COCCN1 MCULE-9995133275 [0,0,0,0,0,2|2,0,0]=4 6263 B10R1.18 CC(=O)C[C@H]1CCCCN1 MCULE-2330430389 [0,0,0,0,0,2|2,0,0]=4 6264 B10R1.18 CC(=O)NC1CCCCC1 MCULE-8353778142 [0,0,0,0,0,2|2,0,0]=4 6265 B10R1.18 CC(=O)NC1CCCNC1 MCULE-2923451430 [0,0,0,0,0,2|2,0,0]=4 6266 B10R1.18 CC(=O)NC1CCCNC1 MCULE-7850537912 [0,0,0,0,0,2|2,0,0]=4 6267 B10R1.18 CC(=O)NC1CCNCC1 MCULE-7572445106 [0,0,0,0,0,2|2,0,0]=4 6268 B10R1.18 CC(=O)NC1CCNCC1 MCULE-8162462660 [0,0,0,0,0,2|2,0,0]=4 6269 B10R1.18 CC(=O)NC1CCOCC1 MCULE-8194699174 [0,0,0,0,0,2|2,0,0]=4 6270 B10R1.18 CC(=O)N[C@@H]1CCCNC1 MCULE-3102769783 [0,0,0,0,0,2|2,0,0]=4 6271 B10R1.18 CC(=O)N[C@@H]1CCCNC1 MCULE-4313494103 [0,0,0,0,0,2|2,0,0]=4 6272 B10R1.18 CC(=O)N[C@H]1CCCNC1 MCULE-1582624021 [0,0,0,0,0,2|2,0,0]=4 6273 B10R1.18 CC(=O)N[C@H]1CCCNC1 MCULE-7588247669 [0,0,0,0,0,2|2,0,0]=4 6274 B10R1.18 CC(=O)OC1C=CCCC1 MCULE-7559627891 [0,0,0,0,0,2|2,0,0]=4 6275 B10R1.18 CC(=O)OC1CCCCC1 MCULE-8221153491 [0,0,0,0,0,2|2,0,0]=4 6276 B10R1.18 CC(=O)OC1CCCCS1 MCULE-7999769363 [0,0,0,0,0,2|1,1,0]=4 6277 B10R1.18 CC(=O)OC1CCCNC1 MCULE-1733458491 [0,0,0,0,0,2|2,0,0]=4 6278 B10R1.18 CC(=O)OC1CCCNC1 MCULE-4433179343 [0,0,0,0,0,2|2,0,0]=4 6279 B10R1.18 CC(=O)OC1CCNCC1 MCULE-3223270695 [0,0,0,0,0,2|2,0,0]=4 6280 B10R1.18 CC(=O)OC1CCNCC1 MCULE-4522205472 [0,0,0,0,0,2|2,0,0]=4 6281 B10R1.18 CC(=O)OC1CCNCC1 MCULE-4714651381 [0,0,0,0,0,2|2,0,0]=4 6282 B10R1.18 NC(=O)CC1CCCCC1 MCULE-4951525688 [0,0,0,0,0,2|2,0,0]=4 6283 B10R1.18 NC(=O)CC1CCCCN1 MCULE-2185479052 [0,0,0,0,0,2|2,0,0]=4 6284 B10R1.18 NC(=O)CC1CCCCN1 MCULE-4538477610 [0,0,0,0,0,2|2,0,0]=4 6285 B10R1.18 NC(=O)CC1CCCNC1 MCULE-9261260462 [0,0,0,0,0,2|2,0,0]=4 6286 B10R1.18 NC(=O)CC1CCCNC1 MCULE-9756580933 [0,0,0,0,0,2|2,0,0]=4 6287 B10R1.18 NC(=O)CC1CCNCC1 MCULE-4391382932 [0,0,0,0,0,2|2,0,0]=4 6288 B10R1.18 NC(=O)CC1CCNCC1 MCULE-4639158092 [0,0,0,0,0,2|2,0,0]=4 6289 B10R1.18 NC(=O)CC1CCOCC1 MCULE-6220113088 [0,0,0,0,0,2|2,0,0]=4 6290 B10R1.18 NC(=O)CC1CNCCO1 MCULE-2394638010 [0,0,0,0,0,2|1,0,0]=3 6291 B10R1.18 NC(=O)CC1COCCN1 MCULE-1907387140 [0,0,0,0,0,2|2,0,0]=4 6292 B10R1.18 NC(=O)CC1COCCN1 MCULE-6398693859 [0,0,0,0,0,2|2,0,0]=4 6293 B10R1.18 NC(=O)NC1CCCCC1 MCULE-8036346010 [0,0,0,0,0,2|2,0,0]=4 6294 B10R1.18 NC(=O)NC1CCCNC1 MCULE-6949169935 [0,0,0,0,0,2|2,0,0]=4 6295 B10R1.18 NC(=O)NC1CCCNC1 MCULE-7043674090 [0,0,0,0,0,2|2,0,0]=4 6296 B10R1.18 NC(=O)NC1CCNCC1 MCULE-6399383870 [0,0,0,0,0,2|2,0,0]=4 6297 B10R1.18 NC(=O)NC1CCNCC1 MCULE-6486575063 [0,0,0,0,0,2|2,0,0]=4 6298 B10R1.18 NC(=O)NC1CCOCC1 MCULE-4139742761 [0,0,0,0,0,2|2,0,0]=4 6299 B10R1.18 NC(=O)OC1CCCCC1 MCULE-3235010863 [0,0,0,0,0,2|2,0,0]=4 6300 B10R1.18 NC(=O)OC1CCOCC1 MCULE-5947388770 [0,0,0,0,0,2|2,0,0]=4 6301 B10R1.18 O=C(Cl)CC1CCCCC1 MCULE-2220383860 [0,0,0,0,0,2|2,0,0]=4 6302 B10R1.18 O=C(Cl)CC1CCOCC1 MCULE-6068907888 [0,0,0,0,0,2|2,0,0]=4 6303 B10R1.18 O=C(Cl)OC1CCCCC1 MCULE-4011557961 [0,0,0,0,0,2|2,0,0]=4 6304 B10R1.18 O=C(Cl)OC1CCOCC1 MCULE-5361190443 [0,0,0,0,0,2|2,0,0]=4 6305 B10R1.18 O=C(O)C=C1CCCCC1 MCULE-2830279446 [0,0,0,0,0,2|1,0,1]=4 6306 B10R1.18 O=C(O)C=C1CCNCC1 MCULE-2946232230 [0,0,0,0,0,2|1,0,1]=4 6307 B10R1.18 O=C(O)C=C1CCNCC1 MCULE-9183556093 [0,0,0,0,0,2|1,0,1]=4 6308 B10R1.18 O=C(O)C=C1CCOCC1 MCULE-2596143817 [0,0,0,0,0,2|1,0,1]=4 6309 B10R1.18 O=C(O)C=C1CCSCC1 MCULE-3222993494 [0,0,0,0,0,2|1,0,1]=4 6310 B10R1.18 O=C(O)CC1=CCCCC1 MCULE-9909477927 [0,0,0,0,0,2|1,0,1]=4 6311 B10R1.18 O=C(O)CC1=CCOCC1 MCULE-9800538477 [0,0,0,0,0,2|1,0,1]=4 6312 B10R1.18 O=C(O)CC1C=CCCC1 MCULE-3207533436 [0,0,0,0,0,2|1,0,0]=3 6313 B10R1.18 O=C(O)CC1CC=CCC1 MCULE-3427584067 [0,0,0,0,0,2|1,0,1]=4 6314 B10R1.18 O=C(O)CC1CCCCC1 MCULE-3370925166 [0,0,0,0,0,2|1,0,0]=3 6315 B10R1.18 O=C(O)CC1CCCCN1 MCULE-7593127940 [0,0,0,0,0,2|1,0,0]=3 6316 B10R1.18 O=C(O)CC1CCCCN1 MCULE-7653711252 [0,0,0,0,0,2|1,0,0]=3 6317 B10R1.18 O=C(O)CC1CCCCO1 MCULE-2711682647 [0,0,0,0,0,2|0,0,0]=2 6318 B10R1.18 O=C(O)CC1CCCNC1 MCULE-3254470591 [0,0,0,0,0,2|1,0,0]=3 6319 B10R1.18 O=C(O)CC1CCCNC1 MCULE-7958803985 [0,0,0,0,0,2|1,0,0]=3 6320 B10R1.18 O=C(O)CC1CCCOC1 MCULE-5877605158 [0,0,0,0,0,2|0,0,0]=2 6321 B10R1.18 O=C(O)CC1CCNCC1 MCULE-1130327966 [0,0,0,0,0,2|1,0,0]=3 6322 B10R1.18 O=C(O)CC1CCNCC1 MCULE-2100213856 [0,0,0,0,0,2|1,0,0]=3 6323 B10R1.18 O=C(O)CC1CCOCC1 MCULE-7878329119 [0,0,0,0,0,2|1,0,0]=3 6324 B10R1.18 O=C(O)CC1CCSCC1 MCULE-3567762107 [0,0,0,0,0,2|1,0,0]=3 6325 B10R1.18 O=C(O)CC1CNCCN1 MCULE-5141588986 [0,0,0,0,0,2|1,0,0]=3 6326 B10R1.18 O=C(O)CC1CNCCO1 MCULE-3058504133 [0,0,0,0,0,2|0,0,0]=2 6327 B10R1.18 O=C(O)CC1CNCCO1 MCULE-3387061328 [0,0,0,0,0,2|0,0,0]=2 6328 B10R1.18 O=C(O)CC1CNCCO1 MCULE-4327756750 [0,0,0,0,0,2|0,0,0]=2 6329 B10R1.18 O=C(O)CC1CNCCO1 MCULE-4883251317 [0,0,0,0,0,2|0,0,0]=2 6330 B10R1.18 O=C(O)CC1COCCN1 MCULE-4486190659 [0,0,0,0,0,2|1,0,0]=3 6331 B10R1.18 O=C(O)CC1COCCN1 MCULE-8010316572 [0,0,0,0,0,2|1,0,0]=3 6332 B10R1.18 O=C(O)CC1COCCO1 MCULE-8632741098 [0,0,0,0,0,2|0,0,0]=2 6333 B10R1.18 O=C(O)CC1CSCCS1 MCULE-4793456872 [0,0,0,0,0,2|0,1,0]=3 6334 B10R1.18 O=C(O)CC1OCCCO1 MCULE-1471723881 [0,0,0,0,0,2|0,0,0]=2 6335 B10R1.18 O=C(O)CN1CCCCC1 MCULE-9137136186 [0,0,0,0,0,2|2,0,0]=4 6336 B10R1.18 O=C(O)CN1CCCCC1 MCULE-9769416161 [0,0,0,0,0,2|2,0,0]=4 6337 B10R1.18 O=C(O)CN1CCNCC1 MCULE-4945447446 [0,0,0,0,0,2|2,0,0]=4 6338 B10R1.18 O=C(O)CN1CCNCC1 MCULE-6990903527 [0,0,0,0,0,2|2,0,0]=4 6339 B10R1.18 O=C(O)CN1CCNCC1 MCULE-8811795576 [0,0,0,0,0,2|2,0,0]=4 6340 B10R1.18 O=C(O)CN1CCOCC1 MCULE-2955270234 [0,0,0,0,0,2|2,0,0]=4 6341 B10R1.18 O=C(O)CN1CCOCC1 MCULE-5710414541 [0,0,0,0,0,2|2,0,0]=4 6342 B10R1.18 O=C(O)CN1CCSCC1 MCULE-9107067895 [0,0,0,0,0,2|2,0,0]=4 6343 B10R1.18 O=C(O)CN1CCSCC1 MCULE-9299535292 [0,0,0,0,0,2|2,0,0]=4 6344 B10R1.18 O=C(O)C[C@@H]1CC=CCC1 MCULE-6316447839 [0,0,0,0,0,2|1,0,1]=4 6345 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-3905830299 [0,0,0,0,0,2|1,0,0]=3 6346 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-5277218457 [0,0,0,0,0,2|1,0,0]=3 6347 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-7510387772 [0,0,0,0,0,2|1,0,0]=3 6348 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-5325818659 [0,0,0,0,0,2|1,0,0]=3 6349 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-7001078313 [0,0,0,0,0,2|1,0,0]=3 6350 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-8120215253 [0,0,0,0,0,2|1,0,0]=3 6351 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-9602652995 [0,0,0,0,0,2|1,0,0]=3 6352 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-4498530905 [0,0,0,0,0,2|0,0,0]=2 6353 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-4549445854 [0,0,0,0,0,2|0,0,0]=2 6354 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-5055136882 [0,0,0,0,0,2|0,0,0]=2 6355 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-7244079860 [0,0,0,0,0,2|0,0,0]=2 6356 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-2046760558 [0,0,0,0,0,2|1,0,0]=3 6357 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-4473145834 [0,0,0,0,0,2|1,0,0]=3 6358 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-5100169676 [0,0,0,0,0,2|1,0,0]=3 6359 B10R1.18 O=C(O)C[C@H]1CCCCN1 MCULE-3680996115 [0,0,0,0,0,2|1,0,0]=3 6360 B10R1.18 O=C(O)C[C@H]1CCCCN1 MCULE-4674662417 [0,0,0,0,0,2|1,0,0]=3 6361 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-1302740697 [0,0,0,0,0,2|1,0,0]=3 6362 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-2509529219 [0,0,0,0,0,2|1,0,0]=3 6363 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-3753473259 [0,0,0,0,0,2|1,0,0]=3 6364 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-9619904988 [0,0,0,0,0,2|1,0,0]=3 6365 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-1832902178 [0,0,0,0,0,2|0,0,0]=2 6366 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-5015018730 [0,0,0,0,0,2|0,0,0]=2 6367 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-5838446318 [0,0,0,0,0,2|0,0,0]=2 6368 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-9119322865 [0,0,0,0,0,2|0,0,0]=2 6369 B10R1.18 O=C(O)C[C@H]1COCCN1 MCULE-8571286067 [0,0,0,0,0,2|1,0,0]=3 6370 B10R1.18 O=C(O)C[C@H]1COCCN1 MCULE-9555376320 [0,0,0,0,0,2|1,0,0]=3 6371 B10R1.18 O=C(O)NC1CCCCC1 MCULE-5645794848 [0,0,0,0,0,2|1,0,0]=3 6372 B10R1.18 O=N(=O)CC1CCCCO1 MCULE-3545576512 [0,0,0,0,0,2|1,0,1]=4 6373 B10R1.348 CC(=O)C1CCCCCC1 MCULE-9324503120 [0,0,0,0,0,2|2,0,0]=4 6374 B10R1.348 NC(=O)C1CCCCCC1 MCULE-2005648941 [0,0,0,0,0,2|2,0,0]=4 6375 B10R1.348 NC(=O)C1CCCCNC1 MCULE-6748059498 [0,0,0,0,0,2|2,0,0]=4 6376 B10R1.348 NC(=O)C1CCCCNC1 MCULE-8697140088 [0,0,0,0,0,2|2,0,0]=4 6377 B10R1.348 NC(=O)C1CNCCOC1 MCULE-3555049909 [0,0,0,0,0,2|1,0,0]=3 6378 B10R1.348 O=C(Cl)C1CCCCCC1 MCULE-4659434885 [0,0,0,0,0,2|2,0,0]=4 6379 B10R1.348 O=C(O)C1=CCCCCC1 MCULE-5438079704 [0,0,0,0,0,2|1,0,1]=4 6380 B10R1.348 O=C(O)C1=CCCOCC1 MCULE-6315041103 [0,0,0,0,0,2|0,0,2]=4 6381 B10R1.348 O=C(O)C1CCC=CCC1 MCULE-6767000432 [0,0,0,0,0,2|1,0,0]=3 6382 B10R1.348 O=C(O)C1CCCCCC1 MCULE-7903672891 [0,0,0,0,0,2|1,0,0]=3 6383 B10R1.348 O=C(O)C1CCCCCN1 MCULE-2741684183 [0,0,0,0,0,2|1,0,0]=3 6384 B10R1.348 O=C(O)C1CCCCCN1 MCULE-7374703751 [0,0,0,0,0,2|1,0,0]=3 6385 B10R1.348 O=C(O)C1CCCCNC1 MCULE-3392190626 [0,0,0,0,0,2|1,0,0]=3 6386 B10R1.348 O=C(O)C1CCCCNC1 MCULE-7795043703 [0,0,0,0,0,2|1,0,0]=3 6387 B10R1.348 O=C(O)C1CCCNCC1 MCULE-7690110773 [0,0,0,0,0,2|1,0,0]=3 6388 B10R1.348 O=C(O)C1CCCNCC1 MCULE-9766781803 [0,0,0,0,0,2|1,0,0]=3 6389 B10R1.348 O=C(O)C1CCCOCC1 MCULE-9318516869 [0,0,0,0,0,2|0,0,0]=2 6390 B10R1.348 O=C(O)C1CNCCCN1 MCULE-3558230210 [0,0,0,0,0,2|1,0,0]=3 6391 B10R1.348 O=C(O)C1CNCCCN1 MCULE-6835715048 [0,0,0,0,0,2|1,0,0]=3 6392 B10R1.348 O=C(O)C1CNCCCO1 MCULE-2282415374 [0,0,0,0,0,2|0,0,0]=2 6393 B10R1.348 O=C(O)C1CNCCCO1 MCULE-3064687044 [0,0,0,0,0,2|0,0,0]=2 6394 B10R1.348 O=C(O)C1COCCOC1 MCULE-7686530449 [0,0,0,0,0,2|0,0,0]=2 6395 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2016813857 [0,0,0,0,0,2|1,0,0]=3 6396 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2504826586 [0,0,0,0,0,2|1,0,0]=3 6397 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-4939523441 [0,0,0,0,0,2|1,0,0]=3 6398 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-8497154031 [0,0,0,0,0,2|1,0,0]=3 6399 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-1709248067 [0,0,0,0,0,2|1,0,0]=3 6400 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4607599990 [0,0,0,0,0,2|1,0,0]=3 6401 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4947785395 [0,0,0,0,0,2|1,0,0]=3 6402 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-8502245212 [0,0,0,0,0,2|1,0,0]=3 6403 B10R1.348 O=C(O)[C@H]1CCCNCC1 MCULE-2658567129 [0,0,0,0,0,2|1,0,0]=3 6404 B10R1.66 CC(=O)CCC1CCCC1 MCULE-9602514524 [0,0,0,0,0,2|2,0,0]=4 6405 B10R1.66 CC(=O)NCC1CCCN1 MCULE-7607447093 [0,0,0,0,0,2|2,0,0]=4 6406 B10R1.66 CC(=O)NCC1CCCN1 MCULE-9543275549 [0,0,0,0,0,2|2,0,0]=4 6407 B10R1.66 CC(=O)NCC1CCCO1 MCULE-2959865168 [0,0,0,0,0,2|1,0,0]=3 6408 B10R1.66 CC(=O)NC[C@@H]1CCCN1 MCULE-5496183974 [0,0,0,0,0,2|2,0,0]=4 6409 B10R1.66 CC(=O)OCC1CCCO1 MCULE-7611136571 [0,0,0,0,0,2|1,0,0]=3 6410 B10R1.66 CC(O)CCC1CCCO1 MCULE-9471233943 [0,0,0,0,0,2|1,0,1]=4 6411 B10R1.66 N=C(N)NCC1CCCO1 MCULE-6260783933 [0,0,0,0,0,2|2,0,0]=4 6412 B10R1.66 N=C(N)NCC1CCCO1 MCULE-6720947181 [0,0,0,0,0,2|2,0,0]=4 6413 B10R1.66 N=C(N)NCC1CCCO1 MCULE-9518137890 [0,0,0,0,0,2|2,0,0]=4 6414 B10R1.66 N=C(N)SCC1CCCO1 MCULE-7278581303 [0,0,0,0,0,2|2,0,0]=4 6415 B10R1.66 N=C(N)SCC1CCCO1 MCULE-9976461555 [0,0,0,0,0,2|2,0,0]=4 6416 B10R1.66 NC(=O)CCC1CCCC1 MCULE-6308384459 [0,0,0,0,0,2|2,0,0]=4 6417 B10R1.66 NC(=O)CNC1CCCC1 MCULE-5401113380 [0,0,0,0,0,2|2,0,0]=4 6418 B10R1.66 NC(=O)CNC1CCCC1 MCULE-8595660552 [0,0,0,0,0,2|2,0,0]=4 6419 B10R1.66 NC(=O)COC1CCCC1 MCULE-6280655419 [0,0,0,0,0,2|2,0,0]=4 6420 B10R1.66 NC(=O)NCC1CCCN1 MCULE-3595646758 [0,0,0,0,0,2|2,0,0]=4 6421 B10R1.66 NC(=O)NCC1CCCO1 MCULE-5540789879 [0,0,0,0,0,2|1,0,0]=3 6422 B10R1.66 NC(=S)NCC1CCCO1 MCULE-1845300796 [0,0,0,0,0,2|1,1,0]=4 6423 B10R1.66 NC(=S)NC[C@H]1CCCO1 MCULE-3549920474 [0,0,0,0,0,2|1,1,0]=4 6424 B10R1.66 O=C(Cl)C=CC1CCCC1 MCULE-3150169908 [0,0,0,0,0,2|2,0,0]=4 6425 B10R1.66 O=C(Cl)CCC1CCCC1 MCULE-6098498258 [0,0,0,0,0,2|2,0,0]=4 6426 B10R1.66 O=C(Cl)OCC1CCCO1 MCULE-9360559044 [0,0,0,0,0,2|1,0,0]=3 6427 B10R1.66 O=C(O)/C=C/C1CCCC1 MCULE-5196632480 [0,0,0,0,0,2|1,0,0]=3 6428 B10R1.66 O=C(O)C#CC1CCCO1 MCULE-1325340304 [0,0,0,0,0,2|0,0,0]=2 6429 B10R1.66 O=C(O)C#CC1CCOC1 MCULE-8365235824 [0,0,0,0,0,2|2,0,0]=4 6430 B10R1.66 O=C(O)C=CC1CCCC1 MCULE-4492328269 [0,0,0,0,0,2|1,0,0]=3 6431 B10R1.66 O=C(O)C=CC1CCCO1 MCULE-7330043473 [0,0,0,0,0,2|0,0,0]=2 6432 B10R1.66 O=C(O)C=CC1CCOC1 MCULE-5170193830 [0,0,0,0,0,2|2,0,0]=4 6433 B10R1.66 O=C(O)CCC1CCCC1 MCULE-4583118303 [0,0,0,0,0,2|1,0,0]=3 6434 B10R1.66 O=C(O)CCC1CCCN1 MCULE-2613608732 [0,0,0,0,0,2|1,0,0]=3 6435 B10R1.66 O=C(O)CCC1CCCN1 MCULE-8814917549 [0,0,0,0,0,2|1,0,0]=3 6436 B10R1.66 O=C(O)CCC1CCCO1 MCULE-4111498968 [0,0,0,0,0,2|0,0,0]=2 6437 B10R1.66 O=C(O)CCC1CCNC1 MCULE-8082069026 [0,0,0,0,0,2|2,0,0]=4 6438 B10R1.66 O=C(O)CCC1CCNC1 MCULE-8359539011 [0,0,0,0,0,2|2,0,0]=4 6439 B10R1.66 O=C(O)CCC1CCOC1 MCULE-9339795680 [0,0,0,0,0,2|2,0,0]=4 6440 B10R1.66 O=C(O)CCC1OCCO1 MCULE-1077920259 [0,0,0,0,0,2|1,0,0]=3 6441 B10R1.66 O=C(O)CCN1CCCC1 MCULE-4735526690 [0,0,0,0,0,2|2,0,0]=4 6442 B10R1.66 O=C(O)CCN1CCCC1 MCULE-6724732496 [0,0,0,0,0,2|2,0,0]=4 6443 B10R1.66 O=C(O)CCN1CCCO1 MCULE-4658280001 [0,0,0,0,0,2|1,0,0]=3 6444 B10R1.66 O=C(O)CCN1CCCO1 MCULE-5549624995 [0,0,0,0,0,2|1,0,0]=3 6445 B10R1.66 O=C(O)CC[C@@H]1CCCN1 MCULE-9918992229 [0,0,0,0,0,2|1,0,0]=3 6446 B10R1.66 O=C(O)CC[C@@H]1CCCO1 MCULE-8942407071 [0,0,0,0,0,2|0,0,0]=2 6447 B10R1.66 O=C(O)CC[C@H]1CCCO1 MCULE-8877470669 [0,0,0,0,0,2|0,0,0]=2 6448 B10R1.66 O=C(O)CNC1=NCCC1 MCULE-9201187486 [0,0,0,0,0,2|1,0,1]=4 6449 B10R1.66 O=C(O)CNC1CCCC1 MCULE-2656159228 [0,0,0,0,0,2|1,0,0]=3 6450 B10R1.66 O=C(O)CNC1CCCC1 MCULE-9561013929 [0,0,0,0,0,2|1,0,0]=3 6451 B10R1.66 O=C(O)COC1CCCC1 MCULE-2079008170 [0,0,0,0,0,2|1,0,0]=3 6452 B10R1.66 O=C(O)COC1CCOC1 MCULE-9235017197 [0,0,0,0,0,2|2,0,0]=4 6453 B10R1.66 O=C(O)CSC1CCCC1 MCULE-7601914378 [0,0,0,0,0,2|1,0,0]=3