0 B10R1.64 CC(=O)NC1CCCC1O 59e0220d30c5d89a7bc774bdd7119d12 [0,0,0,0,0,0|1,0,2]=3 1 B10R1.64 CC(=O)NC1CCNC1=O 91f985aecf43711820ab6585e8a2eed9 [0,0,0,0,0,0|1,0,0]=1 2 B10R1.64 CC(=O)NC1CCSC1=O 8b0506933b40ed05ad0ceead72710736 [0,0,0,0,0,0|0,0,0]=0 3 B10R1.64 CC(=O)NC1COCC1O 1a5e5c377c9238227fe77ea7313a6fd1 [0,0,0,0,0,0|2,0,2]=4 4 B10R1.64 CC(=O)NC1CONC1=O d2114630338d2ba1fe8cb952c0f7332c [0,0,0,0,0,0|2,0,0]=2 5 B10R1.64 CC(=O)N[C@@H]1CCC[C@@H]1O 8cb67225b4b66d60c05cf19cee1f81da [0,0,0,0,0,0|1,0,2]=3 6 B10R1.64 CC(=O)N[C@@H]1CCC[C@H]1O b09f4c2f2b9433d14ce51c1d506ae9e8 [0,0,0,0,0,0|1,0,2]=3 7 B10R1.64 CC(=O)N[C@@H]1CCNC1=O af454812b9c50fc2eb9620282c13b7aa [0,0,0,0,0,0|1,0,0]=1 8 B10R1.64 CC(=O)N[C@@H]1CCOC1=O e98b9d3cb0c32e3af6eee896ee8416e5 [0,0,0,0,0,0|0,1,0]=1 9 B10R1.64 CC(=O)N[C@@H]1COC[C@@H]1O c6ebac0b54a96aaf9141edb45012d222 [0,0,0,0,0,0|2,0,2]=4 10 B10R1.64 CC(=O)N[C@@H]1COC[C@H]1O 52698b8decd657fc36fe7aa6d7e0bd58 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.64 CC(=O)N[C@@H]1CONC1=O 0c096b24a2b0f94921ee0ce84d202a0b [0,0,0,0,0,0|2,0,0]=2 12 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O e6a6e3adb2cb556e3a04e433a4ca013c [0,0,0,0,0,0|1,0,2]=3 13 B10R1.64 CC(=O)N[C@H]1CCC[C@H]1O d54340e665e803c30264a16ad0e57d91 [0,0,0,0,0,0|1,0,2]=3 14 B10R1.64 CC(=O)N[C@H]1CCNC1=O d4040bb24904e1dbbd497da369c9d637 [0,0,0,0,0,0|1,0,0]=1 15 B10R1.64 CC(=O)N[C@H]1CCOC1=O 07dbe47502c5d27a5b9276bf995d7763 [0,0,0,0,0,0|0,1,0]=1 16 B10R1.64 CC(=O)N[C@H]1COC[C@@H]1O 3a444067d676280527715c676a6b0050 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.64 CC(=O)N[C@H]1COC[C@H]1F 2603c213afe84145962cdf4113a64ca2 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.64 CC(=O)N[C@H]1COC[C@H]1O 7ed45dfcf9691d99de36d476b625a6f5 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.64 CC(=O)N[C@H]1CONC1=O f8cabd03c65de5ab863293928cc37c89 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.64 CC(=O)Nc1ccsc1C fea9f66d0431adcdc3ac97999f91179d [0,0,0,0,0,0|1,0,3]=4 21 B10R1.64 CC(C)NC1CCNC1=O aae1ac8a6b9fe4f556055907522d820c [0,0,0,0,0,0|2,0,1]=3 22 B10R1.64 CC(C)NC1CCSC1=O fbedbb642687a775de3f7a38e69119d1 [0,0,0,0,0,0|1,0,1]=2 23 B10R1.64 CC(C)NC1CONC1=O f4ac0822770154cd35cfa62e66bd2549 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.64 CC(C)N[C@@H]1CCNC1=O 5ab4e49608ab787bb03ef0261076a6b8 [0,0,0,0,0,0|2,0,1]=3 25 B10R1.64 CC(C)N[C@@H]1CCOC1=O 51402a00ffe477f3928b1ed398c4fc90 [0,0,0,0,0,0|1,1,1]=3 26 B10R1.64 CC(C)N[C@@H]1CONC1=O 1b20590e84d76c7b77ccc0ad28c57f24 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.64 CC(C)N[C@H]1CCNC1=O 1865808868a610bef784c6b3187e8fea [0,0,0,0,0,0|2,0,1]=3 28 B10R1.64 CC(C)N[C@H]1CCOC1=O adbf9cb03fa205907dae26939f66abf5 [0,0,0,0,0,0|1,1,1]=3 29 B10R1.64 CC(C)N[C@H]1CONC1=O dc84c82805fd5704c3dfce31a9062a10 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.64 CC(C)OC1CCCC1=O 176d4244a0b520916d43cdbf554926d8 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.64 CC(C)OC1CCNC1=O fdfa92604bf82a85564bfaec5b70dcf3 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.64 CC(C)O[C@@H]1CCNC1=O 66d72228296e9d4f576360ba450a8c97 [0,0,0,0,0,0|3,0,1]=4 33 B10R1.64 CC(C)O[C@H]1CCNC1=O a4dd98e8752d3bc0df5cb495ef1aa7ad [0,0,0,0,0,0|3,0,1]=4 34 B9R1.13 CC(=O)NC1CC=CC1 eddd22349be0e5ee4314ae712cf3f748 [1,0,0,0,0,0|1,0,2]=4 35 B9R1.13 CC(=O)NC1CCCC1 a2d6bc9cfdeb39e26a278a42ee1d6324 [1,0,0,0,0,0|1,0,1]=3 36 B9R1.13 CC(=O)NC1CCOC1 c5177dfe9e6c084a2da585e140eb24a0 [1,0,0,0,0,0|0,1,1]=3 37 B9R1.13 CC(=O)NC1CCSC1 730ac5b1a87c9b477c5040aed194c284 [1,0,0,0,0,0|0,0,1]=2 38 B9R1.13 CC(=O)N[C@@H]1CCOC1 a0946b6158cd267ecce33909819f831a [1,0,0,0,0,0|0,1,1]=3 39 B9R1.13 CC(=O)N[C@H]1CCOC1 1f47913b87a63d932081a27afac44166 [1,0,0,0,0,0|0,1,1]=3 40 B9R1.13 CC(=O)Nc1ccsc1 b43c291cb5d72b5ddddbae12e8c0d0d9 [1,0,0,0,0,0|0,0,3]=4 41 B9R1.13 CC(=O)Nc1cnsc1 8b2781f9f5cf5ee989ebb6568d34bd93 [1,0,0,0,0,0|1,0,2]=4 42 B9R1.13 CC(=O)Nc1cscn1 40e369b2af88cefbcc061c4b162a2ec0 [1,0,0,0,0,0|1,0,2]=4 43 B9R1.13 CC(C)NC1CCSC1 3f76cc8aaeed942f4177b526b52af5ab [1,0,0,0,0,0|1,0,2]=4 44 B9R1.33 CCNC1CCNC1=O 7ca8029da61d3d4038e53b166243ebeb [1,0,0,0,0,0|1,0,1]=3 45 B9R1.33 CCNC1CCSC1=O b170125bf493751e42532dd86c219256 [1,0,0,0,0,0|0,0,1]=2 46 B9R1.33 CCNC1CONC1=O d8916a3b97038fb92765b79c0c2fa307 [1,0,0,0,0,0|2,0,1]=4 47 B9R1.33 CCN[C@@H]1CCNC1=O b778b480924bfa692e02248b56fb56cd [1,0,0,0,0,0|1,0,1]=3 48 B9R1.33 CCN[C@@H]1CCOC1=O 74b3897799f45738d0bb44924384c10e [1,0,0,0,0,0|0,1,1]=3 49 B9R1.33 CCN[C@@H]1CONC1=O e20045b5ef59313798e9b6a92cce0e1a [1,0,0,0,0,0|2,0,1]=4 50 B9R1.33 CCN[C@H]1CCNC1=O 659170641ab39dc9cbd8871033438dcc [1,0,0,0,0,0|1,0,1]=3 51 B9R1.33 CCN[C@H]1CCOC1=O 5ec21f69d9ce47df74aa6d4e2b7c83d0 [1,0,0,0,0,0|0,1,1]=3 52 B9R1.33 CCN[C@H]1CONC1=O 12c871b200af3033c6d6052f529438ff [1,0,0,0,0,0|2,0,1]=4 53 B9R1.33 CCOC1CCCC1=O 19fd59f8b378305519536cfc5c950157 [1,0,0,0,0,0|2,0,1]=4 54 B9R1.33 CCOC1CCNC1=O 8fdacff95d4ce2d1c3d495fa66f75dd5 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.33 CCO[C@@H]1CCNC1=O d615de1523fb9db14752de0db1c501b4 [1,0,0,0,0,0|2,0,1]=4 56 B9R1.33 CCO[C@H]1CCNC1=O 5eaae9c583183b85f65e479b22e5ff87 [1,0,0,0,0,0|2,0,1]=4 57 B9R1.33 N#CNC1CCCC1=O 4766ca674fd24fd209e30ce8fb66d461 [1,0,0,0,0,0|2,0,1]=4 58 B9R1.33 N#CNC1CCNC1=O 877c7defc50b31a1532c088fe2d3c915 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.33 O=C1NCCC1NCF e934d4b546df5e1c21b2abb87c40be93 [1,0,0,0,0,0|2,0,1]=4 60 B9R1.33 O=C1NCCC1NCO f89457b8b6195d5e1e378aab9b707899 [1,0,0,0,0,0|1,0,2]=4 61 B9R1.33 O=C1NCC[C@@H]1NCF aa36b634ddd34b967ad5a52483739117 [1,0,0,0,0,0|2,0,1]=4 62 B9R1.33 O=C1NCC[C@@H]1NCO 8e6a4f04c55a75e390a6856d15c97bad [1,0,0,0,0,0|1,0,2]=4 63 B9R1.33 O=C1NCC[C@H]1NCF d2e1dbc662f1cc4ae8e5908e2cede490 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.33 O=C1NCC[C@H]1NCO d03ec1da6f87c1b1f9b15a44bc1d78ad [1,0,0,0,0,0|1,0,2]=4 65 B9R1.33 O=C1OCC[C@@H]1NCF e1dd4e315ccdd3ee423490069e903050 [1,0,0,0,0,0|1,1,1]=4 66 B9R1.33 O=C1OCC[C@@H]1NCO fd71f95ebb01bbdbbb2ef25d589937b3 [1,0,0,0,0,0|0,1,2]=4 67 B9R1.33 O=C1OCC[C@H]1NCF f31145c15fd3ca3d3a6551d0366095af [1,0,0,0,0,0|1,1,1]=4 68 B9R1.33 O=C1OCC[C@H]1NCO e4d04d631c6f331f98f78546df6deaf9 [1,0,0,0,0,0|0,1,2]=4 69 B9R1.33 O=C1SCCC1NCF ba2963085da0901be8e733658eebcd1e [1,0,0,0,0,0|1,0,1]=3 70 B9R1.33 O=C1SCCC1NCO 971434990856107bfee853a9f2299987 [1,0,0,0,0,0|0,0,2]=3 71 B9R1.33 O=CNC1CCNC1=O f13cd4f76e5cd2a08023d7d7a7742536 [1,0,0,0,0,0|1,0,0]=2 72 B9R1.33 O=CNC1CCSC1=O 987cb3cf2fb108b6bbd6b68aba24cf91 [1,0,0,0,0,0|0,0,0]=1 73 B9R1.33 O=CNC1CONC1=O 64374102ed5254d961514ae7b3aaf42b [1,0,0,0,0,0|2,0,0]=3 74 B9R1.33 O=CN[C@@H]1CCNC1=O 9f3202c404958d99ba50cee9dfcef939 [1,0,0,0,0,0|1,0,0]=2 75 B9R1.33 O=CN[C@@H]1CCOC1=O 3c925f02e8c278e6bf7011b9f0b36e54 [1,0,0,0,0,0|0,1,0]=2 76 B9R1.33 O=CN[C@@H]1CONC1=O 24d7259f177230acfe3d6157538fe672 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.33 O=CN[C@H]1CCNC1=O bd52f8f4f5534a4b45610b528aa5bdb2 [1,0,0,0,0,0|1,0,0]=2 78 B9R1.33 O=CN[C@H]1CCOC1=O e0e2c83eea6e610346dbde5e79237504 [1,0,0,0,0,0|0,1,0]=2 79 B9R1.33 O=CN[C@H]1CONC1=O de81c71f303c95c043d88a145d49956a [1,0,0,0,0,0|2,0,0]=3 80 B11R1.57 CC(=O)N[C@H]1CCC[C@H]1C#N b6637edea503f8cc8d7badacf15e03c1 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.57 CC(=O)N[C@H]1CCC[C@H]1CO a01a5b4ecb6f8524b3e56b92ecdec507 [0,1,0,0,0,0|1,0,2]=4 82 B11R1.57 CC(=O)Nc1ccsc1C=O 0aef41df3934568f1977a43c6f28f0e2 [0,1,0,0,0,0|0,0,3]=4 83 B11R1.57 CC[C@@H]1CCC[C@H]1NC(=O)C 3e0e1d15d776c3dcd038aea6de3e4dfb [0,1,0,0,0,0|2,0,1]=4 84 B11R1.57 COC1CCCC1NC(=O)C 8da7fbc7ec54ef4f28a2ee6769a7a8cf [0,1,0,0,0,0|1,0,2]=4 85 B11R1.57 CO[C@@H]1CCC[C@@H]1NC(=O)C 38043d3afc7f72488101da25572db660 [0,1,0,0,0,0|1,0,2]=4 86 B11R1.57 CO[C@@H]1CCC[C@H]1NC(=O)C 4db371906024f4bac2c8b094a6772760 [0,1,0,0,0,0|1,0,2]=4 87 B11R1.57 CO[C@H]1CCC[C@@H]1NC(=O)C 4d51e586caacf78fcf1ab76d6db4a3ed [0,1,0,0,0,0|1,0,2]=4 88 B11R1.88 CC(=O)NC1(CCNC1=O)C 20bfbd98db13515ad60a3fa6f3ef3593 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.88 CC(C)NC1(CCNC1=O)C 34f60059a8889277cd643beb1981e383 [0,1,0,0,0,0|2,0,1]=4 90 B11R1.89 CC(=O)N(C)[C@@H]1CCC[C@@H]1O 619a45a8a8fc176c2f35b1ba76ba56d6 [0,1,0,0,0,0|1,0,2]=4 91 B11R1.89 CC(=O)N(C)[C@@H]1CCC[C@H]1O 37b31e5ed53e60dd80f95519f7d15765 [0,1,0,0,0,0|1,0,2]=4 92 B11R1.89 CC(=O)N(C)[C@H]1CCC[C@H]1O 279910fd8c86c775cb8d53c6c1309760 [0,1,0,0,0,0|1,0,2]=4 93 B11R1.105 CC(C)(C)NC1CCNC1=O f37e0197ef8bd51ea6113754f18d83e9 [0,1,0,0,0,0|2,0,1]=4 94 B11R1.228 C#CC(=O)NC1CCNC1=O 73a99a702230fa4360cad807de7da3d6 [0,1,0,0,0,0|1,0,1]=3 95 B11R1.228 C#CC(=O)NC1CCSC1=O af190b1f7870a8b0b34d09ce240ad0e0 [0,1,0,0,0,0|0,0,1]=2 96 B11R1.228 C#CC(=O)NC1CONC1=O c6a975f539b4177f7a48c8e45e541f80 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.228 C#CC(=O)N[C@@H]1CCNC1=O df9bfd7a4ebe2b2e2fb6dbc1d738ddcd [0,1,0,0,0,0|1,0,1]=3 98 B11R1.228 C#CC(=O)N[C@@H]1CCOC1=O c4ab316c26cab616662b258cb818e767 [0,1,0,0,0,0|0,1,1]=3 99 B11R1.228 C#CC(=O)N[C@@H]1CONC1=O 194c85efef8d63ead7d233824bee1c20 [0,1,0,0,0,0|2,0,1]=4 100 B11R1.228 C#CC(=O)N[C@H]1CCNC1=O 26fcf3c0b90013bad5bc8355dd98ef9e [0,1,0,0,0,0|1,0,1]=3 101 B11R1.228 C#CC(=O)N[C@H]1CCOC1=O 3f46fbf91926e48a5469b51865928d3e [0,1,0,0,0,0|0,1,1]=3 102 B11R1.228 C#CC(=O)N[C@H]1CONC1=O 50faaa2ff52ffc6ee72b3fe57d6bf480 [0,1,0,0,0,0|2,0,1]=4 103 B11R1.228 C#CC(C)NC1CCCC1=O f7edbc0a2b1a51c74794abac2269aa16 [0,1,0,0,0,0|2,0,1]=4 104 B11R1.228 C#CC(C)NC1CCNC1=O aeec53b72be2cc7b737d53b8fcb664d8 [0,1,0,0,0,0|2,0,1]=4 105 B11R1.228 C#CC(C)NC1CCSC1=O 84f86ff0ac6c7827aefcc79a6d237aaf [0,1,0,0,0,0|1,0,1]=3 106 B11R1.228 C#CC(C)N[C@@H]1CCNC1=O dbd9dfbe038f586b15d3acfb943c11c7 [0,1,0,0,0,0|2,0,1]=4 107 B11R1.228 C#CC(C)N[C@H]1CCNC1=O 92482c1d335fe67d5605c47220a7960b [0,1,0,0,0,0|2,0,1]=4 108 B11R1.228 C#C[C@@H](C)NC1CCCC1=O e7bcb0c5d33d8a2c7eddd165beef459e [0,1,0,0,0,0|2,0,1]=4 109 B11R1.228 C#C[C@@H](C)NC1CCNC1=O a6d7c67883c1a7857ccc6e21b5dba6e1 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.228 C#C[C@H](C)NC1CCCC1=O 916a81a1c46e30ae235c2b1c4c535ca7 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.228 C#C[C@H](C)NC1CCNC1=O 6c7eee6e2c34e6f245232965b0026b17 [0,1,0,0,0,0|2,0,1]=4 112 B11R1.228 C=C(C=O)OC1CCCC1=O 2c3beab9d892e3ee8b71ab0ddb6de5fe [0,1,0,0,0,0|2,0,1]=4 113 B11R1.228 C=C(C=O)OC1CCNC1=O 62929e4ccca51f4b322c621a439cc10b [0,1,0,0,0,0|2,0,1]=4 114 B11R1.228 C=CC(=O)NC1CCNC1=O a293623b7e52a1dd23e5a02ef4c3e006 [0,1,0,0,0,0|1,0,1]=3 115 B11R1.228 C=CC(=O)NC1CCSC1=O dae8d0eac1ec10fd9cfef5a98baaed26 [0,1,0,0,0,0|0,0,1]=2 116 B11R1.228 C=CC(=O)NC1CONC1=O 9d9e9a7daa63f22d2c6fb9a79a1c160a [0,1,0,0,0,0|2,0,1]=4 117 B11R1.228 C=CC(=O)N[C@@H]1CCNC1=O 1e9d419489d567e8bf7ee15550f4a48b [0,1,0,0,0,0|1,0,1]=3 118 B11R1.228 C=CC(=O)N[C@@H]1CCOC1=O b0beecf5f5c5a8cf57a688e808c24c3e [0,1,0,0,0,0|0,1,1]=3 119 B11R1.228 C=CC(=O)N[C@@H]1CONC1=O dd09fb09b6d0db7e1c768f6083f98b16 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.228 C=CC(=O)N[C@H]1CCNC1=O 8df2b862a3aa500e62ea11d10563bd8e [0,1,0,0,0,0|1,0,1]=3 121 B11R1.228 C=CC(=O)N[C@H]1CCOC1=O c1fd10bd87c0bcc52b3a1ebb86b0a18e [0,1,0,0,0,0|0,1,1]=3 122 B11R1.228 C=CC(=O)N[C@H]1CONC1=O 74eec2ca4eecf89cfb5b68353933210f [0,1,0,0,0,0|2,0,1]=4 123 B11R1.228 C=CC(C)NC1CCCC1=O bdca68df9dd5f5cab790898312c6b2b1 [0,1,0,0,0,0|2,0,1]=4 124 B11R1.228 C=CC(C)NC1CCNC1=O a0687460a5df4336414cd41a9d831e92 [0,1,0,0,0,0|2,0,1]=4 125 B11R1.228 C=CC(C)NC1CCOC1=O 5097e20d274987269154779bfccb177a [0,1,0,0,0,0|1,1,1]=4 126 B11R1.228 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CC(C=O)NC1CONC1=O bdedc61e2f01764af7ce25010f039b92 [0,1,0,0,0,0|2,0,1]=4 138 B11R1.228 CC(C=O)N[C@@H]1CCNC1=O 679bfa8c432609a10b339dc3e8c0802f [0,1,0,0,0,0|1,0,1]=3 139 B11R1.228 CC(C=O)N[C@@H]1CCOC1=O 89ad9a674fe3ca87805f53ac7072df76 [0,1,0,0,0,0|0,1,1]=3 140 B11R1.228 CC(C=O)N[C@@H]1CONC1=O 4baea0ea45ba6b801925a987b51f1dba [0,1,0,0,0,0|2,0,1]=4 141 B11R1.228 CC(C=O)N[C@H]1CCNC1=O 8710d8859ae952cce232a6baac77fbef [0,1,0,0,0,0|1,0,1]=3 142 B11R1.228 CC(C=O)N[C@H]1CCOC1=O f2b1b6ab0fbfd0aa9376dac8461713c0 [0,1,0,0,0,0|0,1,1]=3 143 B11R1.228 CC(C=O)N[C@H]1CONC1=O 2c056313e6b0e098016317829c2aba03 [0,1,0,0,0,0|2,0,1]=4 144 B11R1.228 CC(C=O)OC1CCCC1=O 160100c79336bc86d4579d555314387e [0,1,0,0,0,0|2,0,1]=4 145 B11R1.228 CC(C=O)OC1CCNC1=O 51b6759e5a0e74ee1f102f092541e69f [0,1,0,0,0,0|2,0,1]=4 146 B11R1.228 CC(C=O)OC1CCOC1=O f4b417f84b7ce67bd4f43f6c105a071d [0,1,0,0,0,0|1,1,1]=4 147 B11R1.228 CC(C=O)O[C@@H]1CCNC1=O 5d7517c5c142b700f87057085d047cb5 [0,1,0,0,0,0|2,0,1]=4 148 B11R1.228 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B11R1.228 O=C(CF)NC1CCCC1O 0e87f952c3ec7cc9467666f766c70717 [0,1,0,0,0,0|1,0,2]=4 214 B11R1.228 O=C(CF)NC1CCNC1=O 173d9955693aa3628684f4c86adfee50 [0,1,0,0,0,0|1,0,0]=2 215 B11R1.228 O=C(CF)NC1CCSC1=O fc8865ca219800a9ab1a963ef60e8047 [0,1,0,0,0,0|0,0,0]=1 216 B11R1.228 O=C(CF)NC1CONC1=O 4757d732ab8d1299a178b833c05df816 [0,1,0,0,0,0|2,0,0]=3 217 B11R1.228 O=C(CF)N[C@@H]1CCC[C@@H]1O 0665943acf5c8b951b1d1150f6a049c3 [0,1,0,0,0,0|1,0,2]=4 218 B11R1.228 O=C(CF)N[C@@H]1CCC[C@H]1O 16f93bb254317539f696164f33e7d30a [0,1,0,0,0,0|1,0,2]=4 219 B11R1.228 O=C(CF)N[C@@H]1CCNC1=O 71707e38f5b04dc75599bda5548db80e [0,1,0,0,0,0|1,0,0]=2 220 B11R1.228 O=C(CF)N[C@@H]1CONC1=O 6d37201f476e6fcbb916d7461495eb7e [0,1,0,0,0,0|2,0,0]=3 221 B11R1.228 O=C(CF)N[C@H]1CCC[C@@H]1O e48549817d8585a2a7a0166f76d17f52 [0,1,0,0,0,0|1,0,2]=4 222 B11R1.228 O=C(CF)N[C@H]1CCC[C@H]1O 7edb59cd412df9b3dde695dcb3256fc4 [0,1,0,0,0,0|1,0,2]=4 223 B11R1.228 O=C(CF)N[C@H]1CCNC1=O 177f29b9f0cb76ce5cd9f805b13d1525 [0,1,0,0,0,0|1,0,0]=2 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B11R1.228 O=CC(=O)N[C@@H]1CCOC1=O dabe7583be67b69a7d4e66da11e34c30 [0,1,0,0,0,0|0,1,1]=3 247 B11R1.228 O=CC(=O)N[C@@H]1CONC1=O 3a3bf553bc227ac99bd5b08480f3efa5 [0,1,0,0,0,0|2,0,1]=4 248 B11R1.228 O=CC(=O)N[C@H]1CCNC1=O a0bdca6b49b67c43e3bc36bdcb324b5d [0,1,0,0,0,0|1,0,1]=3 249 B11R1.228 O=CC(=O)N[C@H]1CCOC1=O 09d3f210fa00cde14ecf10d872879e0d [0,1,0,0,0,0|0,1,1]=3 250 B11R1.228 O=CC(=O)N[C@H]1CONC1=O bd8cbdf9896ef41b0240fcc1d6e89135 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.234 CC(=O)NC1CCCC1(C)C 488c8c4aa656f613bcfbfb94fac6d1ff [0,1,0,0,0,0|2,0,1]=4 252 B11R1.234 CC(=O)NC1CCCC1(C)O 50eba4a2a50b10ff405e1bfc79290142 [0,1,0,0,0,0|1,0,2]=4 253 B11R1.234 CC(=O)NC1CCCC1(F)F a4096d6989741acc89cd98fcda204d75 [0,1,0,0,0,0|2,0,1]=4 254 B11R1.234 CC(=O)NC1CCOC1(C)C 3a16f5e7301b39c058a36ad2f73cb761 [0,1,0,0,0,0|1,1,1]=4 255 B11R1.234 CC(=O)N[C@@H]1CCC[C@@]1(C)O a4c092125a8d95704297a3706fd2a41b [0,1,0,0,0,0|1,0,2]=4 256 B11R1.234 CC(=O)N[C@H]1CCC[C@]1(C)O a48953122923c9d75a9ad10e7cea04d4 [0,1,0,0,0,0|1,0,2]=4 257 B11R1.313 CC(C)NC1CCN(C1=O)C d82a1c6a2c16a310e93663823e58482e [0,1,0,0,0,0|2,0,1]=4 258 B11R1.313 CC(C)NC1CCN(C1=O)O 8222c679b6c57df462179f1895fc0491 [0,1,0,0,0,0|2,0,1]=4 259 B11R1.313 CC(C)N[C@@H]1CCN(C1=O)C 37f5dca8358d28f9f12b9792c0526101 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.313 CC(C)N[C@@H]1CCN(C1=O)O 9951832f81ca50ca20d40ec770e1bfbd [0,1,0,0,0,0|2,0,1]=4 261 B11R1.313 CC(C)N[C@H]1CCN(C1=O)C 61751ddaae6a6c79819d2988657d0958 [0,1,0,0,0,0|2,0,1]=4 262 B11R1.495 CC(=O)N[C@@H]1C(=O)NC[C@H]1O 045545dd0c66f6ecd26de74c8d75c78b [0,1,0,0,0,0|1,0,0]=2 263 B11R1.495 CC(C)N[C@@H]1C(=O)NC[C@H]1O f2054937c8a9d2cb0de68e76f447e791 [0,1,0,0,0,0|2,0,1]=4 264 B11R1.645 CC(=O)NC1CC(=O)NC1=O 082702ebc1905779dc6365a7a32617b6 [0,1,0,0,0,0|1,0,1]=3 265 B11R1.645 CC(=O)N[C@@H]1CC(=O)NC1=O 24b97919291453a114b83e58aea17281 [0,1,0,0,0,0|1,0,1]=3 266 B11R1.645 CC(=O)N[C@H]1CC(=O)NC1=O eeadf490b4bc42ea46ae3b54079a7084 [0,1,0,0,0,0|1,0,1]=3 267 B9R0.2 C#CCCCCNC(=O)C 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0d2ce7c0ebccca7ce340f634fa8c3eb5 [0,0,1,0,0,0|3,0,0]=4 280 B9R0.2 CC(=O)NCCCCC#N 480c9a37c58edee24bbae98d4ead4810 [0,0,1,0,0,0|2,0,1]=4 281 B9R0.2 CC(=O)NCCCCCCl 9810fdb3b44bef22ae3578265fbb7e47 [0,0,1,0,0,0|2,0,1]=4 282 B9R0.2 CC(=O)NCCCCCO 6528e540cd36869e25e869b54ef6b7c3 [0,0,1,0,0,0|1,0,2]=4 283 B9R0.2 CC(=O)NCCCNC#N e97febbf87d50303e045b4d7ba4fee80 [0,0,1,0,0,0|2,0,1]=4 284 B9R0.2 CC(=O)NCCCNC=O 5fbc3ba2791f885f7e7155f5fab225dd [0,0,1,0,0,0|1,0,0]=2 285 B9R0.2 CC(=O)NCCCNCF 62bca42e02ab81a45e4ff0c6351abf93 [0,0,1,0,0,0|2,0,1]=4 286 B9R0.2 CC(=O)NCCCNCO 328911bf7c359f53194dbd7fe75621ee [0,0,1,0,0,0|1,0,2]=4 287 B9R0.2 CC(=O)NCCCOCF d7af484a45d939e567ed9be2fdfcef29 [0,0,1,0,0,0|1,1,1]=4 288 B9R0.2 CC(=O)NCCNCC=O fb7b8d1cfd0556a7fb93d0ed1460f299 [0,0,1,0,0,0|2,0,0]=3 289 B9R0.2 CC(=O)NCCOCC=O c892a19c2819f0f7d72506ae5c84fa91 [0,0,1,0,0,0|2,0,0]=3 290 B9R0.2 CC(=O)NCOC/C=C/Cl e6fbbdf125ba24bed26c5ce0393f3b6f [0,0,1,0,0,0|3,0,0]=4 291 B9R0.2 CC(=O)NCOC/C=C\Cl 0e2f157365ef03f0a5150a37a77f36d1 [0,0,1,0,0,0|3,0,0]=4 292 B9R0.2 CC(=O)NCOCCC=O cfaee0e8255546514b3b86f54b6379bc [0,0,1,0,0,0|2,0,0]=3 293 B9R0.2 CC(=O)NCOCSC#N e0a57daac1443067aa3d4147b08b10c6 [0,0,1,0,0,0|2,0,1]=4 294 B9R0.2 CC(=O)OCCOCC=O 50de9809b657b57c3e7b1c5e62714176 [0,0,1,0,0,0|3,0,0]=4 295 B9R0.2 CC(=O)OCOCCC=O 43928999cc7dc7f483ee6ebbcfb96c99 [0,0,1,0,0,0|3,0,0]=4 296 B9R0.2 CCCCCCNC(=O)C 39216d9115deaeddca0efb3bbde5d8cb [0,0,1,0,0,0|2,0,1]=4 297 B9R0.2 CCNCCCNC(=O)C 81f3181e8e4443de7d578da2748320f4 [0,0,1,0,0,0|2,0,1]=4 298 B9R0.2 CCOCCCNC(=O)C c5dadd69f1df46bcde7d3d147d2b830b [0,0,1,0,0,0|1,1,1]=4 299 B9R0.2 COCCCCNC(=O)C 4f652cda1775947bb169784843d0beab [0,0,1,0,0,0|3,0,0]=4 300 B9R0.2 CSCCCCNC(=O)C fe724d5efdffb6641eb31ec001ed77cf [0,0,1,0,0,0|3,0,0]=4 301 B9R0.2 NC(=O)CCCCNC=O 3e503141f2993c5300de2e080e6cd43c [0,0,1,0,0,0|3,0,0]=4 302 B9R0.2 NC(=O)NCCOCC=O 9f85f6a9f9356c537df73c3d82a6c056 [0,0,1,0,0,0|3,0,0]=4 303 B9R0.2 NC(=O)NCOCCC=O f71801e5aebfae921ec016326386dc64 [0,0,1,0,0,0|3,0,0]=4 304 B9R0.14 CC(=O)NC(CO)CCO 2ca85a82cbe9cc591bc306e37053f306 [0,0,1,0,0,0|0,1,2]=4 305 B9R0.14 CC(=O)N[C@@H](CO)CCO 120a9546a4368a319df273961922dccd [0,0,1,0,0,0|0,1,2]=4 306 B9R0.14 CCCC(CO)NC(=O)C f3bf17abc83f73293b80dc3dfcb282f9 [0,0,1,0,0,0|1,0,2]=4 307 B9R0.14 CCC[C@@H](CO)NC(=O)C 1f7828ff873e7c1f12c0daf2d17463c6 [0,0,1,0,0,0|1,0,2]=4 308 B9R0.14 CCC[C@H](CO)NC(=O)C da4d526e59be455b3e6f6ae6f972462b [0,0,1,0,0,0|1,0,2]=4 309 B9R0.23 CCC(C)C(C)NC(=O)C c6415ea83b7186fa422502fb21dba14b [0,0,1,0,0,0|2,0,1]=4 310 B9R0.23 CNC(=O)C(C)NC(=O)C 20dcd5ed09ea0b27a914b41bad316179 [0,0,1,0,0,0|1,0,0]=2 311 B9R0.23 CNC(=O)C(C)NC(C)C 65730d825f5aa2039cafe89553f0261e [0,0,1,0,0,0|2,0,1]=4 312 B9R0.39 CC(=O)NC(C#N)C(=O)N 247e5e2d374395b6bd8d03db0be531f4 [0,0,1,0,0,0|2,0,1]=4 313 B9R0.39 CC(=O)NC(CO)C(=O)N b1be17e2cc3eec340c1a5e7bfe0b60fc [0,0,1,0,0,0|2,0,0]=3 314 B9R0.39 CC(=O)N[C@@H](CO)C(=O)N 9013b5089d8bde9709af251a0f900641 [0,0,1,0,0,0|2,0,0]=3 315 B9R0.39 CCC(NC(=O)C)C(=O)N ced64f62e518b676f2ab6392de3182cf [0,0,1,0,0,0|1,0,0]=2 316 B9R0.39 CCC(NC(=O)C)C(C)C 253d178d4b990459a13ddcfb33937234 [0,0,1,0,0,0|2,0,1]=4 317 B9R0.39 CCC(NC(C)C)C(=O)N abcd3d2ef4a3fa1141e4f742570a9e4e [0,0,1,0,0,0|2,0,1]=4 318 B9R0.39 CCC(NC(C)C)C(=O)O d1e2ab254f28f635f62d6836cb2971ca [0,0,1,0,0,0|1,1,1]=4 319 B9R0.39 CC[C@@H](NC(=O)C)[C@@H](C)O 921739c4a8a492f7cfef35d0bff38d7e [0,0,1,0,0,0|1,0,2]=4 320 B9R0.39 CC[C@@H](NC(=O)C)[C@H](C)O 201113a7b2ad8782f3c591af74095c66 [0,0,1,0,0,0|1,0,2]=4 321 B9R0.39 CC[C@@H](NC(C)C)C(=O)O 74f2971df7036370e0da2bb233c67656 [0,0,1,0,0,0|1,1,1]=4 322 B9R0.39 CC[C@H](NC(=O)C)C(=O)N 50b31a3ccc5975b35fc105a566b31dfa [0,0,1,0,0,0|1,0,0]=2 323 B9R0.39 CC[C@H](NC(=O)C)[C@@H](C)O 7ad059423e88b28831a5095f24ca1743 [0,0,1,0,0,0|1,0,2]=4 324 B9R0.39 CC[C@H](NC(C)C)C(=O)N 4a970c7a5270e9ab4ceda05912ee5514 [0,0,1,0,0,0|2,0,1]=4 325 B9R0.39 CC[C@H](NC(C)C)C(=O)O 1465e55476e138472b94d4661e4437b0 [0,0,1,0,0,0|1,1,1]=4 326 B9R0.48 CC(=O)NCC(=O)NC#N 04a5a65186f77a7dffb48bc6eccfeaea [0,0,1,0,0,0|2,0,1]=4 327 B9R0.48 CCCC(=O)NCC(=O)C 2da9b0181737be2a6f0a306a2b6bdda4 [0,0,1,0,0,0|3,0,0]=4 328 B9R0.48 CCCC(O)CNC(=O)C 5b570a4d674c9d38425ae4777e887a42 [0,0,1,0,0,0|1,0,2]=4 329 B9R0.48 CCNC(=O)CNC(=O)C 57792c8153adb6e80259374ddd295748 [0,0,1,0,0,0|1,0,0]=2 330 B9R0.48 CCNC(=O)CNC(C)C e4859b939cf74625a255ec0cb59c0de7 [0,0,1,0,0,0|2,0,1]=4 331 B9R0.48 CCOC(=O)CNC(=O)C eefea8b66cbae53eb0645dbc6dff51ca [0,0,1,0,0,0|0,1,0]=2 332 B9R0.48 CCOC(=O)CNC(C)C 80d7999aed865ea280b457aaf3d32f53 [0,0,1,0,0,0|1,1,1]=4 333 B9R0.48 CCOC(C)CNC(=O)C 217fca33332c664f1a507b96c62f402a [0,0,1,0,0,0|1,1,1]=4 334 B11R2.115 O=C1NCCC1NC2CC2 0b189ff85a8707bfa7c53921e79001a7 [0,0,0,1,0,0|2,0,1]=4 335 B11R2.115 O=C1NCC[C@@H]1NC2CC2 94a7742457ecc6bc117c93281529b35e [0,0,0,1,0,0|2,0,1]=4 336 B11R2.115 O=C1NCC[C@H]1NC2CC2 5109defbe8647553e25101913f2b74bf [0,0,0,1,0,0|2,0,1]=4 337 B11R2.814 CC(=O)N1CC2C1CCC2 b66cf4cc41f614540ee6f24fdee08dfd [0,0,0,1,0,0|2,0,1]=4 338 B11R2.814 CC(=O)N1C[C@H]2[C@@H]1CCC2 f5a3d79dc235cd39c2fa6c2c93ea603f [0,0,0,1,0,0|2,0,1]=4 339 B9R1.41 CC(=O)N1CCSC1C 13a90b79e1eaed8ff645ef446550c0e3 [0,0,0,0,1,0|2,0,1]=4 340 B9R1.67 CC(=O)NC1CCC1F 55e0226d065f98903a565e96ead37deb [0,0,0,0,1,0|1,0,1]=3 341 B9R1.67 CC(=O)NC1CCC1O d5d791e34b0dd746abea58e641e7eb71 [0,0,0,0,1,0|0,0,2]=3 342 B9R1.67 CC(=O)NC1COC1C 8a920b5eb5f4182753f432fdd48c3fbd [0,0,0,0,1,0|1,1,1]=4 343 B9R1.67 CC(=O)N[C@@H]1CC[C@@H]1O 4643b690b6b53ddad1b5aeb87bd8a349 [0,0,0,0,1,0|0,0,2]=3 344 B9R1.67 CC(=O)N[C@@H]1CC[C@H]1C 5c49b9b8f08f59f55b778fc02f7c64d4 [0,0,0,0,1,0|1,0,1]=3 345 B9R1.67 CC(=O)N[C@@H]1CC[C@H]1O fba29ddb8346f550c0015141c61e8c98 [0,0,0,0,1,0|0,0,2]=3 346 B9R1.67 CC(=O)N[C@H]1CC[C@@H]1O 263fe95019aba723bed92cdedf021005 [0,0,0,0,1,0|0,0,2]=3 347 B9R1.67 CC(=O)N[C@H]1CC[C@H]1C c339870f892b73bf50fa9d649fc76de5 [0,0,0,0,1,0|1,0,1]=3 348 B9R1.67 CC(=O)N[C@H]1CC[C@H]1O 2992e307b4aa4b78fb6fc80c541a013f [0,0,0,0,1,0|0,0,2]=3 349 B9R1.67 CC(=O)N[C@H]1CNC1=O 86318f253af44e89c841fa6df70b952d [0,0,0,0,1,0|1,0,0]=2 350 B9R1.67 CC(C)N[C@H]1CNC1=O 3974b22a7367872daaa4f688eda0456a [0,0,0,0,1,0|2,0,1]=4 351 B9R1.67 CC(C)OC1CCC1=O 11e32319af5fad4b832da68a85d1c646 [0,0,0,0,1,0|2,0,1]=4 352 B11R1.86 CC(=O)NC1CCCCC1C 670701ef37830c881dfd98f284b6eaef [0,0,0,0,0,1|2,0,1]=4 353 B11R1.86 CC(=O)NC1CCCCC1O bc79a4a57827afa3a4fa640017043055 [0,0,0,0,0,1|1,0,2]=4 354 B11R1.86 CC(=O)NC1CCCNC1=O 30fe4880dd193b9f9946d2a31d533b7e [0,0,0,0,0,1|1,0,0]=2 355 B11R1.86 CC(=O)NC1CCOCC1C edce8fbaf211b854c7f2ed742fd852ac [0,0,0,0,0,1|1,1,1]=4 356 B11R1.86 CC(=O)NC1CCOCC1O cb746fa02122a1c8e989262a386091b1 [0,0,0,0,0,1|0,1,2]=4 357 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1C 2bac565059009b92e61af1d1f0ba1ffd [0,0,0,0,0,1|2,0,1]=4 358 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1C 479fb6aae9438e2010ab8b66de7f20cf [0,0,0,0,0,1|2,0,1]=4 359 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1O db67c1bdd3ca05ff8229e30fa13e50d9 [0,0,0,0,0,1|1,0,2]=4 360 B11R1.86 CC(=O)N[C@@H]1CCCNC1=O 53da49ae1dae7a05a99f36bb4616f1e2 [0,0,0,0,0,1|1,0,0]=2 361 B11R1.86 CC(=O)N[C@@H]1CCOC[C@@H]1C 248ac71d47aadfd8f2eeffdc90582804 [0,0,0,0,0,1|1,1,1]=4 362 B11R1.86 CC(=O)N[C@@H]1CCOC[C@@H]1O 5251c2796e93ed258960602eafe4f324 [0,0,0,0,0,1|0,1,2]=4 363 B11R1.86 CC(=O)N[C@@H]1CCOC[C@H]1F 4f420ebee40698c307e49ee9c6af0122 [0,0,0,0,0,1|1,1,1]=4 364 B11R1.86 CC(=O)N[C@@H]1CCOC[C@H]1O 817b64886b10369169918ea81c6ac193 [0,0,0,0,0,1|0,1,2]=4 365 B11R1.86 CC(=O)N[C@@H]1COCC[C@@H]1O 5f343067535cbb6efe6f9ac8f2cfc299 [0,0,0,0,0,1|1,0,2]=4 366 B11R1.86 CC(=O)N[C@@H]1COCC[C@H]1O 869f7a7742874e07df4c6c076fc79d56 [0,0,0,0,0,1|1,0,2]=4 367 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1C 18a83c7bce0c6708eeacbe02f36aa7ad [0,0,0,0,0,1|2,0,1]=4 368 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1O cd06a0c7fdec32c28b7b1670c804df5a [0,0,0,0,0,1|1,0,2]=4 369 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1C c4b6727756a1c9df9d0de80b9b0690de [0,0,0,0,0,1|2,0,1]=4 370 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1O 3d7a6b45c93e0f7c67e70ae3e747c43c [0,0,0,0,0,1|1,0,2]=4 371 B11R1.86 CC(=O)N[C@H]1CCCNC1=O a2c0f773932cb3bec301f87f047199a8 [0,0,0,0,0,1|1,0,0]=2 372 B11R1.86 CC(=O)N[C@H]1CCOC[C@@H]1F eee6e1972846d96f5b0db9b205ce6ccc [0,0,0,0,0,1|1,1,1]=4 373 B11R1.86 CC(=O)N[C@H]1CCOC[C@@H]1O 766dd2f31551893d0f625a222f7f4efe [0,0,0,0,0,1|0,1,2]=4 374 B11R1.86 CC(=O)N[C@H]1CCOC[C@H]1C 32b6893bb7f4f962fa7d51cc42867b19 [0,0,0,0,0,1|1,1,1]=4 375 B11R1.86 CC(=O)N[C@H]1CCOC[C@H]1O fe90578a9a63664c28a2dedd612c7a5d [0,0,0,0,0,1|0,1,2]=4 376 B11R1.86 CC(=O)N[C@H]1COCC[C@@H]1O 05299134e04c83f554aa1112864b71ab [0,0,0,0,0,1|1,0,2]=4 377 B11R1.86 CC(=O)N[C@H]1COCC[C@H]1O 70b05ac012a26d313e29548ce8507da1 [0,0,0,0,0,1|1,0,2]=4 378 B11R1.86 CC(C)NC1CCCNC1=O 38de1d955226696470b81e6d9f7ed703 [0,0,0,0,0,1|2,0,1]=4 379 B11R1.86 CC(C)N[C@@H]1CCCNC1=O e9424ba23b15112a73d136e8544b3faa [0,0,0,0,0,1|2,0,1]=4 380 B11R1.86 CC(C)N[C@H]1CCCNC1=O bafcd00042fb983db32dcf9036985f65 [0,0,0,0,0,1|2,0,1]=4 381 B11R1.90 C=C(Br)CNC1CCNC1=O 4054656dfeb991cc3394a50b6fb5bb41 [0,0,0,0,0,1|2,0,1]=4 382 B11R1.90 C=C(Br)CNC1CCSC1=O aba401b5da3061eef63c7b749f88ff1f [0,0,0,0,0,1|1,0,1]=3 383 B11R1.90 C=C(Br)CN[C@@H]1CCNC1=O ab0810f06edae29bbe28c4bb6336b047 [0,0,0,0,0,1|2,0,1]=4 384 B11R1.90 C=C(Br)CN[C@@H]1CCOC1=O d22b0bd3238586cad5338e28c07cfe9f [0,0,0,0,0,1|1,1,1]=4 385 B11R1.90 C=C(Br)CN[C@H]1CCNC1=O d003bd70b27c3b1bb0775168370c09b9 [0,0,0,0,0,1|2,0,1]=4 386 B11R1.90 C=C(Br)CN[C@H]1CCOC1=O 254e9f8c3632bdc667ce59b0e1e84f53 [0,0,0,0,0,1|1,1,1]=4 387 B11R1.90 C=C(C)CNC1CCCC1=O 843237a27a7e66b0eb14706daaba1b94 [0,0,0,0,0,1|2,0,0]=3 388 B11R1.90 C=C(C)CNC1CCNC1=O e10c867e40ea7383bd025101b11d4016 [0,0,0,0,0,1|2,0,0]=3 389 B11R1.90 C=C(C)CNC1CCSC1=O 2d8555bcc46588511deac9dc0794dc29 [0,0,0,0,0,1|1,0,0]=2 390 B11R1.90 C=C(C)CNC1CONC1=O 02abbf974ce17c24d53f367f0016786a [0,0,0,0,0,1|3,0,0]=4 391 B11R1.90 C=C(C)CN[C@@H]1CCNC1=O 1769c102f92c7e11afd0ac487c5d6678 [0,0,0,0,0,1|2,0,0]=3 392 B11R1.90 C=C(C)CN[C@@H]1CCOC1=O 94f16a500c0dffdb7495f4daebca87cf [0,0,0,0,0,1|1,1,0]=3 393 B11R1.90 C=C(C)CN[C@@H]1CONC1=O 02874c0f79890838fef7b143a34162ab [0,0,0,0,0,1|3,0,0]=4 394 B11R1.90 C=C(C)CN[C@H]1CCNC1=O 3baf4552b7d805f46f2daf60b8717482 [0,0,0,0,0,1|2,0,0]=3 395 B11R1.90 C=C(C)CN[C@H]1CCOC1=O 15282f39bbae4d36216d6ea6937e2ce5 [0,0,0,0,0,1|1,1,0]=3 396 B11R1.90 C=C(C)CN[C@H]1CONC1=O 0801af4f11273d4a31e765f0d3ad10f4 [0,0,0,0,0,1|3,0,0]=4 397 B11R1.90 C=C(C)COC1CCCC1=O ae3af376dfc7ce33f07b452bc4de0575 [0,0,0,0,0,1|3,0,0]=4 398 B11R1.90 C=C(C)COC1CCNC1=O 44eee926824bdbf44f6f875e8db4ea0b [0,0,0,0,0,1|3,0,0]=4 399 B11R1.90 C=C(C)CO[C@@H]1CCNC1=O 41832efe47931264d546251bf5a864b1 [0,0,0,0,0,1|3,0,0]=4 400 B11R1.90 C=C(C)CO[C@H]1CCNC1=O dca2296b826119c038fc38df9c7eb23a [0,0,0,0,0,1|3,0,0]=4 401 B11R1.90 C=C(Cl)CNC1CCNC1=O 6e906850fdbd8a49199113bb15b52b5a [0,0,0,0,0,1|2,0,1]=4 402 B11R1.90 C=C(Cl)CNC1CCSC1=O 61117c059d9f0c82ed2c1776e01a231b [0,0,0,0,0,1|1,0,1]=3 403 B11R1.90 C=C(Cl)CN[C@@H]1CCNC1=O ee520e9d51e6cc8c267b006f9d93015f [0,0,0,0,0,1|2,0,1]=4 404 B11R1.90 C=C(Cl)CN[C@@H]1CCOC1=O c682c6f79c894725fb269cbde8d6fc9f [0,0,0,0,0,1|1,1,1]=4 405 B11R1.90 C=C(Cl)CN[C@H]1CCNC1=O 3369df19959bd52f1f1328ba22505e58 [0,0,0,0,0,1|2,0,1]=4 406 B11R1.90 C=C(Cl)CN[C@H]1CCOC1=O 2bada2aeba82f27f45761eab07bb4b1a [0,0,0,0,0,1|1,1,1]=4 407 B11R1.90 C=C(F)CNC1CCNC1=O 33898ebe7904500d5dda447a1712a2ea [0,0,0,0,0,1|2,0,1]=4 408 B11R1.90 C=C(F)CNC1CCSC1=O f650d368c44664774bd2ac1b66170667 [0,0,0,0,0,1|1,0,1]=3 409 B11R1.90 C=C(F)CN[C@@H]1CCNC1=O dfcecb80a95583adf1c82fded8a65ce3 [0,0,0,0,0,1|2,0,1]=4 410 B11R1.90 C=C(F)CN[C@@H]1CCOC1=O d765c9a0fd2477edb40e8f80f0a29bf1 [0,0,0,0,0,1|1,1,1]=4 411 B11R1.90 C=C(F)CN[C@H]1CCNC1=O c6a72218d7a9a871c7df94de94e32ceb [0,0,0,0,0,1|2,0,1]=4 412 B11R1.90 C=C(F)CN[C@H]1CCOC1=O 59b756a06fd2b133a4dfb90b435d9ded [0,0,0,0,0,1|1,1,1]=4 413 B11R1.90 CC(=O)CNC1CCCC1=O 2d08210ddfe40048bbeccaa3b4171906 [0,0,0,0,0,1|1,0,0]=2 414 B11R1.90 CC(=O)CNC1CCCC1O 472f7783b80e9cd08b560ca9f08febae [0,0,0,0,0,1|1,0,2]=4 415 B11R1.90 CC(=O)CNC1CCNC1=O dcb140377e017c4ee2cf79b57f920928 [0,0,0,0,0,1|1,0,0]=2 416 B11R1.90 CC(=O)COC1CCCC1=O 51664da57ba63bc8070648c655510765 [0,0,0,0,0,1|2,0,0]=3 417 B11R1.90 CC(=O)COC1CCNC1=O 8cf81b4b4e119bcda1e4c10672aec9e1 [0,0,0,0,0,1|2,0,0]=3 418 B11R1.90 CC(=O)NCC1CCCC1O c742412c82108bc2a7c8d8d13a8e3bff [0,0,0,0,0,1|1,0,2]=4 419 B11R1.90 CC(=O)NCC1CCCN1C 0b1bca6c0f46f7cbd974bfca60d60e98 [0,0,0,0,0,1|3,0,0]=4 420 B11R1.90 CC(=O)NCC1CCNC1=O 3e940baf09ece1ca8421729dca89cec5 [0,0,0,0,0,1|1,0,0]=2 421 B11R1.90 CC(=O)NC[C@@H]1CCCN1C 44117fe2bcc8ddb8bd974df5072f799d [0,0,0,0,0,1|3,0,0]=4 422 B11R1.90 CC(=O)NC[C@H]1CCCN1C 5974ed54a84d47be6f8cdd58624f19b0 [0,0,0,0,0,1|3,0,0]=4 423 B11R1.90 CC(C)CNC1CCCC1=O eb0c429eebc52e4c0efc082ac09befed [0,0,0,0,0,1|2,0,1]=4 424 B11R1.90 CC(C)CNC1CCNC1=O 2d0aa504a7736f0a2596836e8cba6327 [0,0,0,0,0,1|2,0,1]=4 425 B11R1.90 CC(C)CNC1CCSC1=O 397faac7f0fd0f3b6c86aca97c520b79 [0,0,0,0,0,1|1,0,1]=3 426 B11R1.90 CC(C)CN[C@@H]1CCNC1=O 5ddbfa80addc343140ae72e1273364f6 [0,0,0,0,0,1|2,0,1]=4 427 B11R1.90 CC(C)CN[C@@H]1CCOC1=O 6844e13772b964bf5cc3305a05c9f966 [0,0,0,0,0,1|1,1,1]=4 428 B11R1.90 CC(C)CN[C@H]1CCNC1=O 177523a357fb16402ed322d9b05514aa [0,0,0,0,0,1|2,0,1]=4 429 B11R1.90 CC(C)CN[C@H]1CCOC1=O 8b0b0d0cb1e212cc8595f28131824aaa [0,0,0,0,0,1|1,1,1]=4 430 B11R1.90 CC(C)NCC1CCNC1=O 374991e6977bcd69395f6dfe3d6d5039 [0,0,0,0,0,1|2,0,1]=4 431 B11R1.90 CC(O)CNC1CCCC1=O ea66dba85abbb29a4f9f5479afa5a9b6 [0,0,0,0,0,1|1,0,2]=4 432 B11R1.90 CC(O)CNC1CCNC1=O adbaa24547d4f4388d2894f741041dfb [0,0,0,0,0,1|1,0,2]=4 433 B11R1.90 CC(O)CNC1CCSC1=O 98880e43fc6b0106be2311260a9215e5 [0,0,0,0,0,1|0,0,2]=3 434 B11R1.90 CC(O)CN[C@@H]1CCNC1=O 5e184296b743d12c8b635bb9baf796d3 [0,0,0,0,0,1|1,0,2]=4 435 B11R1.90 CC(O)CN[C@@H]1CCOC1=O 1748d4960fd0814c4e8abfbb06a3fddc [0,0,0,0,0,1|0,1,2]=4 436 B11R1.90 CC(O)CN[C@H]1CCNC1=O cf38116a8ae8e7b931003bfb04a6a27e [0,0,0,0,0,1|1,0,2]=4 437 B11R1.90 CC(O)CN[C@H]1CCOC1=O 2df6eb62d42a1a93dcbba3e43c5bb183 [0,0,0,0,0,1|0,1,2]=4 438 B11R1.90 CN(C)CNC1CCNC1=O c4de3df551faa1b6878388081c5a4d91 [0,0,0,0,0,1|3,0,0]=4 439 B11R1.90 CN(C)CNC1CCSC1=O 6e8bc4ee64c2690a109360edb1c3ae7b [0,0,0,0,0,1|2,0,0]=3 440 B11R1.90 CN(C)CN[C@@H]1CCNC1=O 9738995ea79c87b5be4681588f4165ec [0,0,0,0,0,1|3,0,0]=4 441 B11R1.90 CN(C)CN[C@@H]1CCOC1=O 8504e9b05d66bf60e3d102bc59f447db [0,0,0,0,0,1|2,1,0]=4 442 B11R1.90 CN(C)CN[C@H]1CCNC1=O d09ef373ce9271b474e8f8490f567c68 [0,0,0,0,0,1|3,0,0]=4 443 B11R1.90 CN(C)CN[C@H]1CCOC1=O 64710cf20776b29ff90751b1e177f61e [0,0,0,0,0,1|2,1,0]=4 444 B11R1.90 C[C@@H](O)CNC1CCCC1=O 616a498507d74c3a6c5d1b105ef66945 [0,0,0,0,0,1|1,0,2]=4 445 B11R1.90 C[C@@H](O)CNC1CCNC1=O a9665400704bb8f5d1dd9d5de27f8b68 [0,0,0,0,0,1|1,0,2]=4 446 B11R1.90 C[C@@H](O)CNC1CCSC1=O 1e0c9b28f058cb80d4fae1835c274c32 [0,0,0,0,0,1|0,0,2]=3 447 B11R1.90 C[C@@H](O)CN[C@@H]1CCNC1=O 7dfd825c1fd5b2c7e7af7d1dfa357cc7 [0,0,0,0,0,1|1,0,2]=4 448 B11R1.90 C[C@@H](O)CN[C@H]1CCNC1=O 28845efedb012871b277c6bb1371e62c [0,0,0,0,0,1|1,0,2]=4 449 B11R1.90 C[C@H](O)CNC1CCCC1=O ee128eaf0b76a604c3c1d527550c553b [0,0,0,0,0,1|1,0,2]=4 450 B11R1.90 C[C@H](O)CNC1CCNC1=O 0f4160e82829b92c9119438cc13a20df [0,0,0,0,0,1|1,0,2]=4 451 B11R1.90 C[C@H](O)CNC1CCSC1=O 63ef95de5337938009af435ecec5e664 [0,0,0,0,0,1|0,0,2]=3 452 B11R1.90 C[C@H](O)CN[C@@H]1CCNC1=O adea33bc2facf23d5a37b24025cbb799 [0,0,0,0,0,1|1,0,2]=4 453 B11R1.90 C[C@H](O)CN[C@@H]1CCOC1=O 31b206b0a3b65ced51933ec8e5b6381f [0,0,0,0,0,1|0,1,2]=4 454 B11R1.90 C[C@H](O)CN[C@H]1CCNC1=O 2652f1d01c74e426730c807a07f033b3 [0,0,0,0,0,1|1,0,2]=4 455 B11R1.90 C[C@H](O)CN[C@H]1CCOC1=O 91b3619bdd4d8b91760e849d254cde1b [0,0,0,0,0,1|0,1,2]=4 456 B11R1.90 NC(=O)CNC1CCCC1=O 28812942c3af3292940a31eb3f059623 [0,0,0,0,0,1|2,0,0]=3 457 B11R1.90 NC(=O)CNC1CCNC1=O 6785de8bace1a10d3dcde96257046bc0 [0,0,0,0,0,1|2,0,0]=3 458 B11R1.90 NC(=O)CNC1CCSC1=O cee80ac2ea127fecc836e4761b4560f3 [0,0,0,0,0,1|1,0,0]=2 459 B11R1.90 NC(=O)CNC1CONC1=O 3236dbda21a64ab23b059d1ed22c3d83 [0,0,0,0,0,1|3,0,0]=4 460 B11R1.90 NC(=O)CN[C@@H]1CCNC1=O 690d4b8e7e39f7a85d9dfa6b7cb315c1 [0,0,0,0,0,1|2,0,0]=3 461 B11R1.90 NC(=O)CN[C@@H]1CCOC1=O be9e3873f25b253307611809220e35df [0,0,0,0,0,1|1,1,0]=3 462 B11R1.90 NC(=O)CN[C@@H]1CONC1=O e06903164ba3055dc9311203c8b7627b [0,0,0,0,0,1|3,0,0]=4 463 B11R1.90 NC(=O)CN[C@H]1CCNC1=O e258af0e3670bb2fde37d7b61ee9d8eb [0,0,0,0,0,1|2,0,0]=3 464 B11R1.90 NC(=O)CN[C@H]1CCOC1=O cee1d9612733f89e50137769bc7a23a1 [0,0,0,0,0,1|1,1,0]=3 465 B11R1.90 NC(=O)CN[C@H]1CONC1=O d6adf1b2629961928817deec15acea01 [0,0,0,0,0,1|3,0,0]=4 466 B11R1.90 NC(=O)COC1CCCC1=O 7703428569fa2112774e1ce459ed5552 [0,0,0,0,0,1|3,0,0]=4 467 B11R1.90 NC(=O)COC1CCNC1=O e3872ed26082d31e898855b99b1e8c96 [0,0,0,0,0,1|3,0,0]=4 468 B11R1.90 NC(=O)COC1CCOC1=O 83cf5ba733dfecffaeccaf7a8a5453bc [0,0,0,0,0,1|2,1,0]=4 469 B11R1.90 NC(=O)CO[C@@H]1CCNC1=O 32607e8118ffe377f61306e4f187b47e [0,0,0,0,0,1|3,0,0]=4 470 B11R1.90 NC(=O)CO[C@@H]1CCOC1=O 66a0b988655ad65d5401e8d03ffe0904 [0,0,0,0,0,1|2,1,0]=4 471 B11R1.90 NC(=O)CO[C@H]1CCNC1=O a355171c5d208de034b6c1402036be62 [0,0,0,0,0,1|3,0,0]=4 472 B11R1.90 NC(=O)CO[C@H]1CCOC1=O 4da200159817ea39cb529a7fcbb5875e [0,0,0,0,0,1|2,1,0]=4 473 B11R1.90 O=C(O)CNC1CCNC1=O f5fc00811a94690a07f20f9f8e4a3074 [0,0,0,0,0,1|2,0,0]=3 474 B11R1.90 O=C(O)CNC1CCSC1=O 5a77eb88e109142f22ff00e140610671 [0,0,0,0,0,1|1,0,0]=2 475 B11R1.90 O=C(O)CNC1CONC1=O 38116e96f9334b37a14726e3ceb99d94 [0,0,0,0,0,1|3,0,0]=4 476 B11R1.90 O=C(O)CN[C@@H]1CCNC1=O 535bb0255e7f1dcc5878c94a3d1719ff [0,0,0,0,0,1|2,0,0]=3 477 B11R1.90 O=C(O)CN[C@@H]1CCOC1=O 3b7c0d5eae3f2db488fca1cdf2bbf29f [0,0,0,0,0,1|1,1,0]=3 478 B11R1.90 O=C(O)CN[C@@H]1CONC1=O a84d817444da327e79bcf05bce866870 [0,0,0,0,0,1|3,0,0]=4 479 B11R1.90 O=C(O)CN[C@H]1CCNC1=O 80300ed09ade913a4f7c639ee3d08e24 [0,0,0,0,0,1|2,0,0]=3 480 B11R1.90 O=C(O)CN[C@H]1CCOC1=O 0d0c3e6d9b5379c1676925bb907408a8 [0,0,0,0,0,1|1,1,0]=3 481 B11R1.90 O=C(O)CN[C@H]1CONC1=O 66c886f06b1a92298984bb5446fbe909 [0,0,0,0,0,1|3,0,0]=4 482 B11R1.90 O=C(O)COC1CCCC1=O de7a2320c8b4a9fc7111197b63c3342f [0,0,0,0,0,1|3,0,0]=4 483 B11R1.90 O=C(O)COC1CCNC1=O 1fdb9e2f5091664a484f5109dc70b52f [0,0,0,0,0,1|3,0,0]=4 484 B11R1.90 O=C(O)COC1CCOC1=O 9c818de4c17e53ea81e1559da88080c3 [0,0,0,0,0,1|2,1,0]=4 485 B11R1.90 O=C(O)CO[C@@H]1CCNC1=O 7af202f62c11bdffd97521e67f86b2b8 [0,0,0,0,0,1|3,0,0]=4 486 B11R1.90 O=C(O)CO[C@@H]1CCOC1=O 3362bae430a4a61ac9b397a7dda9a36f [0,0,0,0,0,1|2,1,0]=4 487 B11R1.90 O=C(O)CO[C@H]1CCNC1=O 617f5df3720a6282f3e813ca4828e09a [0,0,0,0,0,1|3,0,0]=4 488 B11R1.90 O=C(O)CO[C@H]1CCOC1=O a11ec7af87215dcef263976fe3f7403b [0,0,0,0,0,1|2,1,0]=4 489 B11R1.90 O=C1NCCC1NC[N+](=O)[O-] 9eb840181e9846a8f1daa788d3289a46 [0,0,0,0,0,1|3,0,0]=4 490 B11R1.90 O=C1NCC[C@@H]1NC[N+](=O)[O-] 466dd52d196597b288275bc4b61b2ad2 [0,0,0,0,0,1|3,0,0]=4 491 B11R1.90 O=C1NCC[C@H]1NC[N+](=O)[O-] 57b3a62cd62f3a2eab5381671e61e3b0 [0,0,0,0,0,1|3,0,0]=4 492 B11R1.90 O=C1OCC[C@@H]1NC[N+](=O)[O-] 845519aff104794e876eea9ac1cc659b [0,0,0,0,0,1|2,1,0]=4 493 B11R1.90 O=C1OCC[C@H]1NC[N+](=O)[O-] b41045805d1c2acc9ab61a8e6f754c10 [0,0,0,0,0,1|2,1,0]=4 494 B11R1.90 O=C1SCCC1NCC(F)F 657dc88ff9b61244e7df1ab3ba071374 [0,0,0,0,0,1|2,0,1]=4 495 B11R1.90 O=C1SCCC1NC[N+](=O)[O-] 6da15a82fe289cef15b169f130cc85a3 [0,0,0,0,0,1|2,0,0]=3 496 B11R1.157 CC(=O)NC1CCCC(C1)C 2210d24c85aacb9ca5ad7d0be5468509 [0,0,0,0,0,1|2,0,1]=4 497 B11R1.157 CC(=O)NC1CCCC(C1)O 967c8e42f6277b130f66885e6b186eb9 [0,0,0,0,0,1|1,0,2]=4 498 B11R1.157 CC(=O)NC1CCCN(C1)C 34d6a502a6adfde883aef908a2ef9edd [0,0,0,0,0,1|3,0,0]=4 499 B11R1.157 CC(=O)NC1CCNC(=O)C1 cece63cd91f3a0f182e8abb2629eef3c [0,0,0,0,0,1|1,0,0]=2 500 B11R1.157 CC(=O)NC1CCOC(C1)C 0099ccc8c17d071fd81ba5664844dee7 [0,0,0,0,0,1|1,1,1]=4 501 B11R1.157 CC(=O)N[C@@H]1CCCN(C1)C c757489c05f54677c333d5d1a5094257 [0,0,0,0,0,1|3,0,0]=4 502 B11R1.157 CC(=O)N[C@@H]1CCC[C@@H](C1)O 036cedc2973fe4851309407026c34750 [0,0,0,0,0,1|1,0,2]=4 503 B11R1.157 CC(=O)N[C@@H]1CCC[C@H](C1)C 71f4655f46cf4d4862a6cce1470e6ac9 [0,0,0,0,0,1|2,0,1]=4 504 B11R1.157 CC(=O)N[C@@H]1CCC[C@H](C1)O 133d6afedfa5f62b0664ee93a2cd1962 [0,0,0,0,0,1|1,0,2]=4 505 B11R1.157 CC(=O)N[C@@H]1CCNC(=O)C1 335e4eba9eddc1fce1127cb46b756678 [0,0,0,0,0,1|1,0,0]=2 506 B11R1.157 CC(=O)N[C@@H]1CCO[C@@H](C1)C 522cc936fcd44ff7fe6fb47e9d0d3554 [0,0,0,0,0,1|1,1,1]=4 507 B11R1.157 CC(=O)N[C@@H]1CCO[C@H](C1)C d0134359fa0892a6ae31761566406572 [0,0,0,0,0,1|1,1,1]=4 508 B11R1.157 CC(=O)N[C@H]1CCCN(C1)C 7e2c23441263993d81fce59ecbac3164 [0,0,0,0,0,1|3,0,0]=4 509 B11R1.157 CC(=O)N[C@H]1CCC[C@@H](C1)O 292207cd518c12ebcc52dfe886a419f2 [0,0,0,0,0,1|1,0,2]=4 510 B11R1.157 CC(=O)N[C@H]1CCC[C@H](C1)O 39171aab208d3c96c4e74e0e531fdbfd [0,0,0,0,0,1|1,0,2]=4 511 B11R1.157 CC(=O)N[C@H]1CCNC(=O)C1 e9a4f3ae19f6761c4d77395203a68b16 [0,0,0,0,0,1|1,0,0]=2 512 B11R1.157 CC(=O)N[C@H]1CCO[C@@H](C1)C 1282e3b2a5bbe38d539f7f9cb6e56cf1 [0,0,0,0,0,1|1,1,1]=4 513 B11R1.157 CC(=O)N[C@H]1CCO[C@H](C1)C 86b839821b0a6c40bd50bead6fe2f529 [0,0,0,0,0,1|1,1,1]=4 514 B11R1.157 CC(C)NC1CCNC(=O)C1 1c39fbbce927725b3a5b8b78d1781419 [0,0,0,0,0,1|2,0,1]=4 515 B11R1.157 CC(C)N[C@@H]1CCNC(=O)C1 4e5b583f9f9000ba054d8d426dc497b8 [0,0,0,0,0,1|2,0,1]=4 516 B11R1.157 CC(C)N[C@H]1CCNC(=O)C1 4a9ac27eb55b698632d629689f7a15fa [0,0,0,0,0,1|2,0,1]=4 517 B8R0.4 C=CCCCCNC=O d1a18970ef82160dc43ff2316b351101 [1,0,1,0,0,0|2,0,0]=4 518 B8R0.4 C=COCCCNC=O c27d07096dad07383a216346b3809247 [1,0,1,0,0,0|1,1,0]=4 519 B8R0.4 O=CCOCCNC=O 4e523542aa2070455adeed404aef53bd [1,0,1,0,0,0|2,0,0]=4 520 B8R0.7 C#CCCCNC(=O)C 8bbad3dcf674b05cb5f90221808a2bb7 [1,0,1,0,0,0|1,0,1]=4 521 B8R0.7 C=CCCCNC(=O)C a96a5f1b6b5650813d22e03237823400 [1,0,1,0,0,0|1,0,0]=3 522 B8R0.7 C=CCOCNC(=O)C 9865141036101ac320553ca04e5ea416 [1,0,1,0,0,0|2,0,0]=4 523 B8R0.7 C=COCCNC(=O)C d3122f3ee5d15f554ff520f72b049913 [1,0,1,0,0,0|1,1,0]=4 524 B8R0.7 CC(=O)CCOCC=O 7d9485ec83093875068f9e670696c657 [1,0,1,0,0,0|2,0,0]=4 525 B8R0.7 CC(=O)CNCCC=O 9828f01b09fdb5fac4564520c95c63a6 [1,0,1,0,0,0|2,0,0]=4 526 B8R0.7 CC(=O)COCCC=O 67fac1685908ac3ed2e3421f7c02f4dc [1,0,1,0,0,0|2,0,0]=4 527 B8R0.7 CC(=O)NCCCC#N 4c43f07b4dd9f661d7f672a979b3f954 [1,0,1,0,0,0|1,0,1]=4 528 B8R0.7 CC(=O)NCCCCCl ca2b0e10b9c67d6c9ac8f4d9ab4c2b88 [1,0,1,0,0,0|1,0,1]=4 529 B8R0.7 CC(=O)NCCCCO 57936c738ed3f822f33ee01b6260a94e [1,0,1,0,0,0|0,0,2]=4 530 B8R0.7 CC(=O)NCCCCS c05ad9ce2696d1887a7029e678ac4e5e [1,0,1,0,0,0|0,1,1]=4 531 B8R0.7 CC(=O)NCCNC=O 4f32f9322d14cf6774bb2f41854d1526 [1,0,1,0,0,0|1,0,0]=3 532 B8R0.7 CC(=O)NCOCC=O 310db67b0a81e8cdbbbd8479bed9a419 [1,0,1,0,0,0|1,0,0]=3 533 B8R0.7 CCCCCNC(=O)C da50d5d5f7d2f7c8f9763330c7139773 [1,0,1,0,0,0|1,0,1]=4 534 B8R0.7 CCCOCNC(=O)C 6e99cd8c316495881ee605429ae8a169 [1,0,1,0,0,0|2,0,0]=4 535 B8R0.7 CCNCCNC(=O)C 826d20b3d4f7b158aa9991d8c5f577d5 [1,0,1,0,0,0|1,0,1]=4 536 B8R0.7 CCOCCNC(=O)C 364422f97eb926237421a47e55dbdc32 [1,0,1,0,0,0|0,1,1]=4 537 B8R0.7 CCSCCNC(=O)C 8c3ea9957cae597313583e7951afded4 [1,0,1,0,0,0|0,0,1]=3 538 B8R0.7 COCCCNC(=O)C 526fcf80a030c8c3912a63af41d08c51 [1,0,1,0,0,0|0,1,1]=4 539 B8R0.7 CS(=O)CCCNC=O ac978e4dec6c59820deb2d60499ba3b0 [1,0,1,0,0,0|2,0,0]=4 540 B8R0.7 CSCCCNC(=O)C f4b4c7d4d652abb45039c5639b312853 [1,0,1,0,0,0|0,0,1]=3 541 B8R0.7 CSCOCNC(=O)C 30bfc52f57e4ed91a642bf8853a3d4bb [1,0,1,0,0,0|1,0,1]=4 542 B8R0.7 NC(=O)CCCNC=O 5a008bd91d929501df5e65e014bf8d35 [1,0,1,0,0,0|2,0,0]=4 543 B8R0.7 NC(=O)NCOCC=O a8c32d16b6de07aaad1d57cc3789a0a6 [1,0,1,0,0,0|2,0,0]=4 544 B8R0.5 CC(=O)NC(C)CCO 31015bb8805fb64762d130a6b4b7d734 [1,0,1,0,0,0|0,1,1]=4 545 B8R0.5 CC(=O)N[C@@H](C)CCO 4818866c214b230552dc5531d2d7dacb [1,0,1,0,0,0|0,1,1]=4 546 B8R0.5 CC(=O)N[C@H](C)CCO d4f1175f550aed36e673eb7917598f76 [1,0,1,0,0,0|0,1,1]=4 547 B8R0.5 CCCC(C)NC(=O)C 1ed0caa6bab6b1d79a8ed0b0c0e539ad [1,0,1,0,0,0|1,0,1]=4 548 B8R0.5 CCC[C@H](C)NC(=O)C 95c9eaebbb0a0de223f5b617f08585d8 [1,0,1,0,0,0|1,0,1]=4 549 B8R0.5 COCC(C)NC(=O)C d3030be71efb57415a6640caba792cb5 [1,0,1,0,0,0|0,1,1]=4 550 B8R0.5 COC[C@@H](C)NC(=O)C e26de4ebd7327dac480ea010b3a6df2f [1,0,1,0,0,0|0,1,1]=4 551 B8R0.5 COC[C@H](C)NC(=O)C 4d6a771b34650f584286aeb4b67fe92b [1,0,1,0,0,0|0,1,1]=4 552 B8R0.16 C=C[C@@H](CO)NC(=O)C aeb66beba94c776e664bf89f304fa11b [1,0,1,0,0,0|1,1,0]=4 553 B8R0.16 CCC(CC)NC(=O)C 4ed89f720f0f05324cf79f8a98baf869 [1,0,1,0,0,0|1,0,1]=4 554 B8R0.16 CCC(CO)NC(=O)C 0fc969f502a685ac3a30dff22859fa62 [1,0,1,0,0,0|0,0,2]=4 555 B8R0.16 CC[C@@H](CO)NC(=O)C ec21a63ea250126e0e8e11da71f403ff [1,0,1,0,0,0|0,0,2]=4 556 B8R0.16 CC[C@H](CO)NC(=O)C 6d8228e87e113704ba8a910f796088e1 [1,0,1,0,0,0|0,0,2]=4 557 B8R0.3 CCNC(C)C(=O)NC 54efcfcba9f244b93d368cc4afd291fa [1,0,1,0,0,0|1,0,1]=4 558 B8R0.3 CNC(=O)C(C)NC=O 9d7117190711c5f26e5c1bdd92fe4ea2 [1,0,1,0,0,0|1,0,0]=3 559 B8R0.9 CC(=O)NCC(=O)NO 859b03f5192e57ca509f1bfda110b8fd [1,0,1,0,0,0|2,0,0]=4 560 B8R0.9 CCC(=O)NCC(=O)C 5911502c3a8395822fc4c0959647e135 [1,0,1,0,0,0|2,0,0]=4 561 B8R0.9 CCC(C)CNC(=O)C aa3f1455f544ac3656d43724f45ee4b6 [1,0,1,0,0,0|1,0,1]=4 562 B8R0.9 CCC(O)CNC(=O)C 303ca77168267846269f8e2248e6c650 [1,0,1,0,0,0|0,0,2]=4 563 B8R0.9 CC[C@@H](O)CNC(=O)C 214f1ff21aca62cdd2be0dae45336745 [1,0,1,0,0,0|0,0,2]=4 564 B8R0.9 CC[C@H](C)CNC(=O)C 7308e3222c110d542936eb43984d990d [1,0,1,0,0,0|1,0,1]=4 565 B8R0.9 CNC(=O)CNC(=O)C c907d9576897cc728ca9c254cf3b05e9 [1,0,1,0,0,0|1,0,0]=3 566 B8R0.9 COC(=O)CNC(=O)C b0f97d8003dd4b6278e13b9959e4a2e1 [1,0,1,0,0,0|0,1,0]=3 567 B8R0.23 CC(=O)NC(C)C(=O)N 69ea1b0fb4e1891bc844e1c81cd6f7ed [1,0,1,0,0,0|1,0,0]=3 568 B8R0.23 CC(=O)NC(C)C(C)C 44e61c71c404e93b61e4ebb2d17acd25 [1,0,1,0,0,0|1,0,1]=4 569 B8R0.23 CC(=O)NC(C)C(C)O 82d78b22fd9c1b1cb9a6f73c5b23c29f [1,0,1,0,0,0|0,0,2]=4 570 B8R0.23 CC(=O)N[C@@H](C)C(=O)N 1daed479b13f5a4dee80df6bef80207a [1,0,1,0,0,0|1,0,0]=3 571 B8R0.23 CC(=O)N[C@@H](C)C(C)C 020b2d58d09d222117d5a013059e1c42 [1,0,1,0,0,0|1,0,1]=4 572 B8R0.23 CC(=O)N[C@H](C)C(=O)N d4ac5a93c8007d546d5eddc7f5fb26e4 [1,0,1,0,0,0|1,0,0]=3 573 B8R0.23 CC(=O)N[C@H](C)C(C)C 1a8a59449f9523fa08b3f0d029907e07 [1,0,1,0,0,0|1,0,1]=4 574 B8R0.15 CCC(NC=O)C(=O)N fa6bca91bfe5f27c10adcdffc59e614f [1,0,1,0,0,0|1,0,0]=3 575 B8R0.15 CCNC(CC)C(=O)N 4d4bbfd758d3d1406449d11a7d12f485 [1,0,1,0,0,0|1,0,1]=4 576 B8R0.15 CCNC(CC)C(=O)O 811bed40f759e9415b190b45b938f031 [1,0,1,0,0,0|0,1,1]=4 577 B8R0.15 CCN[C@@H](CC)C(=O)N 2ecd0466ce0392cdd810df37e1818d79 [1,0,1,0,0,0|1,0,1]=4 578 B8R0.15 CCN[C@@H](CC)C(=O)O ad39164e8fc918d5e58308b586171474 [1,0,1,0,0,0|0,1,1]=4 579 B8R0.15 CCN[C@H](CC)C(=O)O f7f7d1d8bf30d5fe2da91fe96021fe3c [1,0,1,0,0,0|0,1,1]=4 580 B8R0.15 CC[C@H](NC=O)C(=O)N ff26bfc7195f92e7d6df4bcbfb0f184b [1,0,1,0,0,0|1,0,0]=3 581 B8R0.15 NC(=O)C(CO)NC=O 83b16adcaf9fe3d3c4ed5922d9078a28 [1,0,1,0,0,0|2,0,0]=4 582 B8R0.15 NC(=O)[C@H](CO)NC=O 5e6eb5e9c4948482d77cdb3e1de3dbac [1,0,1,0,0,0|2,0,0]=4 583 B8R0.1 CCNC(=O)CNC=O d640e3fac3bdd04f4eea38aa909b37a0 [1,0,1,0,0,0|1,0,0]=3 584 B8R0.1 CCNCC(=O)NCC 85e3c6c463358c2ceb6c3f3c07ea189c [1,0,1,0,0,0|1,0,1]=4 585 B8R0.1 CCNCC(=O)OCC 13e479e123264c7bc2cd9986b04b4c24 [1,0,1,0,0,0|0,1,1]=4 586 B8R0.1 CCOC(=O)CNC=O 9f57910f0884d9a30d5951af969e11f6 [1,0,1,0,0,0|0,1,0]=3 587 B8R1.8 CCNC1CCSC1 aee8ffe16d160a5605af118e8c8a851c [2,0,0,0,0,0|0,0,2]=4 588 B8R1.8 O=CNC1CCCC1 9941fb95f5bfd095412442670e9f2499 [2,0,0,0,0,0|1,0,1]=4 589 B8R1.8 O=CNC1CCOC1 e7b13204a0b810870373335ae06b13c2 [2,0,0,0,0,0|0,1,1]=4 590 B8R1.8 O=CNC1CCSC1 82c5edb5966e6ade7f67bb51f82f09ea [2,0,0,0,0,0|0,0,1]=3 591 B8R1.8 O=CN[C@@H]1CCOC1 8b6fe9f11693342d0eb8e36d1ad51ff3 [2,0,0,0,0,0|0,1,1]=4 592 B8R1.8 O=CN[C@H]1CCOC1 f295aedd4a6355b7f9c423148debde31 [2,0,0,0,0,0|0,1,1]=4 593 B10R0.4 C/C=C/CNCCNC(=O)C a905d06e54bfbbcec6b7a1016a559172 [0,1,1,0,0,0|2,0,0]=4 594 B10R0.4 C/C=C/COCCNC(=O)C 1e503e16a36656e0ef56dcabdd04d771 [0,1,1,0,0,0|2,0,0]=4 595 B10R0.4 C/C=C\CCCNCC(=O)C 4ddf0d3010e4410fe3d390d9323118d1 [0,1,1,0,0,0|2,0,0]=4 596 B10R0.4 C/C=C\CNCCNC(=O)C 1308db7f16a694dd0bd1057d0f5d0fa6 [0,1,1,0,0,0|2,0,0]=4 597 B10R0.4 C/C=C\COCCNC(=O)C 8453fddbcd044b2d9077d84f7eb18e0b [0,1,1,0,0,0|2,0,0]=4 598 B10R0.4 C=C(C)CNCCCCC=O 7f75c52ff079111333d53612c0d0c534 [0,1,1,0,0,0|2,0,0]=4 599 B10R0.4 C=CCCCCCNC(=O)C f02f227ef07d7627d48ebb8926ddb9fe [0,1,1,0,0,0|2,0,0]=4 600 B10R0.4 C=CCCCCNCC(=O)C d4656945f366a9d0818e9e76353daf2b [0,1,1,0,0,0|2,0,0]=4 601 B10R0.4 C=CCCCOCNC(=O)C 47bbb58d83a29ee1ffffe91533d403e7 [0,1,1,0,0,0|2,0,0]=4 602 B10R0.4 C=CCCNCCNC(=O)C 5825e61a3448c21e29f7503624e8833a [0,1,1,0,0,0|2,0,0]=4 603 B10R0.4 C=CCCOCCNC(=O)C d0de82dc2dbaaed500ed4ae98cecdd04 [0,1,1,0,0,0|2,0,0]=4 604 B10R0.4 C=CCNCCCNC(=O)C c570f16ed22b32af6a4d4e86dafe95ca [0,1,1,0,0,0|2,0,0]=4 605 B10R0.4 C=CCOCCCNC(=O)C 696e5c5e8a0473614afd73bb7a57647b [0,1,1,0,0,0|1,1,0]=4 606 B10R0.4 CC(=O)CCCCOCC=O 2df6a73c930107619b2607a0e979711f [0,1,1,0,0,0|1,1,0]=4 607 B10R0.4 CC(=O)CCCOCCC=O 03837868c30ee241350d840ba60401f3 [0,1,1,0,0,0|2,0,0]=4 608 B10R0.4 CC(=O)CCOCCCC=O 9149a1f574a0cb9767d812b54caf8a48 [0,1,1,0,0,0|2,0,0]=4 609 B10R0.4 CC(=O)CCOCCNC=O 1cc4d822649e8268bd37f2ae29042a1b [0,1,1,0,0,0|2,0,0]=4 610 B10R0.4 CC(=O)CCOCCOC=O 104c482006349fdbbf411cfdc9db4b72 [0,1,1,0,0,0|1,1,0]=4 611 B10R0.4 CC(=O)CNCCCCC=O 49629e63e0c1345e1b84ffb393898803 [0,1,1,0,0,0|1,0,0]=3 612 B10R0.4 CC(=O)CNCCOCC=O c0d8d44ae1dd9f83834a4b48868da8b6 [0,1,1,0,0,0|2,0,0]=4 613 B10R0.4 CC(=O)COCCCCC=O 0cd5ef4918e08b4005cacaed0a9bf732 [0,1,1,0,0,0|2,0,0]=4 614 B10R0.4 CC(=O)NCCCCNC=O 7f9daa482f34546fab8572802320de5d [0,1,1,0,0,0|1,0,0]=3 615 B10R0.4 CC(=O)NCCCNCC=O d03fb8c5422853e2c1b0971e9b682049 [0,1,1,0,0,0|1,0,0]=3 616 B10R0.4 CC(=O)NCCCOCC=O 9178d6013eac1cdf607317d287fe91b0 [0,1,1,0,0,0|0,1,0]=3 617 B10R0.4 CC(=O)NCCNC/C=C/Cl 15c1ed56b6d62601068d8439c408d1cd [0,1,1,0,0,0|2,0,0]=4 618 B10R0.4 CC(=O)NCCNC/C=C\Cl 5df82344e8299048202e39f9ff2d64e3 [0,1,1,0,0,0|2,0,0]=4 619 B10R0.4 CC(=O)NCCNC/C=C\O 7e58b4371993c174b1907401050933bf [0,1,1,0,0,0|1,0,1]=4 620 B10R0.4 CC(=O)NCCNCCC=O beb6ad68794381c11effcf4fc4970ba7 [0,1,1,0,0,0|1,0,0]=3 621 B10R0.4 CC(=O)NCCNCSC#N 0f2d90efe14d91078c863358efbf57b5 [0,1,1,0,0,0|1,0,1]=4 622 B10R0.4 CC(=O)NCCOC/C=C/Cl a88ff96de0dad82af603614b173bd64d [0,1,1,0,0,0|2,0,0]=4 623 B10R0.4 CC(=O)NCCOC/C=C\Cl 628b6228ca8e17b0e3020b804ec32e18 [0,1,1,0,0,0|2,0,0]=4 624 B10R0.4 CC(=O)NCCOCC=CCl bffd49d09d8af758ded9958050562ebc [0,1,1,0,0,0|2,0,0]=4 625 B10R0.4 CC(=O)NCCOCCC=O 188c29f6f3d2f1914d902b36f94cba9e [0,1,1,0,0,0|1,0,0]=3 626 B10R0.4 CC(=O)NCOCCCC=O 73b0e5665ba7bf95e66fdfd68b484e04 [0,1,1,0,0,0|1,0,0]=3 627 B10R0.4 CC(=O)OCCCOCC=O 5a1337eb19b98c4bde527eba50adf965 [0,1,1,0,0,0|1,1,0]=4 628 B10R0.4 CC(=O)OCCOCCC=O 7f8cd9e5207189b3997284f4721f6f72 [0,1,1,0,0,0|2,0,0]=4 629 B10R0.4 CC(=O)OCOCCCC=O 57f0d4d288a5a84d1ab4185efa00b2ec [0,1,1,0,0,0|2,0,0]=4 630 B10R0.4 CC(=O)OCOCCNC=O 5061d59f9dbb1298ae2d52a67be4391a [0,1,1,0,0,0|2,0,0]=4 631 B10R0.4 CC(=O)OCOCCOC=O f0d303c107cd0b7c8148f9ebd28167df [0,1,1,0,0,0|1,1,0]=4 632 B10R0.4 CC(=O)SCCCOCC=O b3c40a7ce485bc2fb5a23e79175abd64 [0,1,1,0,0,0|1,1,0]=4 633 B10R0.4 CC(=O)SCCOCCC=O de666372e4d08439186771c3dd16867c [0,1,1,0,0,0|2,0,0]=4 634 B10R0.4 CC=CCNCCNC(=O)C 546b57357d7b27b55f980fafd656c6f5 [0,1,1,0,0,0|2,0,0]=4 635 B10R0.4 CC=CCOCCNC(=O)C 7897bf0962cb50fa9bc36535f8098d44 [0,1,1,0,0,0|2,0,0]=4 636 B10R0.4 CCSCCCCNC(=O)C a92a124e17ab18927891ca9e4716ceb8 [0,1,1,0,0,0|1,0,1]=4 637 B10R0.4 CCSCCCNCC(=O)C e1d13e283a2d771ef21f5de250f59362 [0,1,1,0,0,0|1,0,1]=4 638 B10R0.4 CCSCCOCNC(=O)C 314e3af97768302ff4d4f1dc3f062853 [0,1,1,0,0,0|1,0,1]=4 639 B10R0.4 NC(=O)CNCCCCC=O ce1506e0410275a160c5b5779bd374d6 [0,1,1,0,0,0|2,0,0]=4 640 B10R0.4 NC(=O)NCCOCCC=O e94254b3db97f262bfa790a917eeb4c3 [0,1,1,0,0,0|2,0,0]=4 641 B10R0.4 NC(=O)NCOCCCC=O 961c1f0a457af614e38721a0cf02a334 [0,1,1,0,0,0|2,0,0]=4 642 B10R0.4 O=CCCCCNCC(=O)O afa09eb7ad93095d62a13368a3c2af83 [0,1,1,0,0,0|2,0,0]=4 643 B10R0.6 CC(=O)NC(C)COCC=O b62af7b9d236a68c9b501d841962f5dd [0,1,1,0,0,0|2,0,0]=4 644 B10R0.6 CC(=O)N[C@H](C)COCC=O 3da1947be9a9a9af67279f770f06c334 [0,1,1,0,0,0|2,0,0]=4 645 B10R0.22 CS(=O)(=O)NCCCNC=O eaa0146a78838136735925c101c1b8e1 [0,1,1,0,0,0|2,0,0]=4 646 B10R0.55 C=C(C=O)OCCNC(=O)C 50b82398b06044a7f15c3094526ad540 [0,1,1,0,0,0|2,0,0]=4 647 B10R0.55 CC(=O)NCCNC(=O)C=O 38b638ec0a3e8cb2f6dece79e8ac19e7 [0,1,1,0,0,0|2,0,0]=4 648 B10R0.55 CC(=O)NCCNC(C)C=O fef00e1940f68f58bafef7d7d4177c2a [0,1,1,0,0,0|2,0,0]=4 649 B10R0.55 CC(=O)NCCN[C@H](C)C=O 326286ca7bbae7d980a7be58c7622289 [0,1,1,0,0,0|2,0,0]=4 650 B10R0.55 CC(=O)NCCOC(C)C=O b398f1bbadce2e18728fd13fc86a7950 [0,1,1,0,0,0|2,0,0]=4 651 B10R0.55 CC(=O)NCCO[C@H](C)C=O fe0f12b7e1709d4554e525f38ca55850 [0,1,1,0,0,0|2,0,0]=4 652 B10R0.74 C=CCCCCNC(=O)CC 100c7380435002fc66a3df3f6174cb33 [0,1,1,0,0,0|2,0,0]=4 653 B10R0.74 C=CCCCCNC(=O)CF f477da776538a6662a066955ecb01e77 [0,1,1,0,0,0|2,0,0]=4 654 B10R0.74 C=CCCCCNC(=O)CO 2905b68dae9a3566578a0fac8e07b802 [0,1,1,0,0,0|2,0,0]=4 655 B10R0.74 C=CCCCCNC(=O)CS 99c91c4ebf325f8388f56f5b17ce4c5f [0,1,1,0,0,0|2,0,0]=4 656 B10R0.74 C=COCCCNC(=O)CC 559080535f254319045a5bbd14777f15 [0,1,1,0,0,0|1,1,0]=4 657 B10R0.74 C=COCCCNC(=O)CF ae3e1a4dcd92e5e63d988328b25b8344 [0,1,1,0,0,0|1,1,0]=4 658 B10R0.74 C=COCCCNC(=O)CO fb08e4cf15eab20e32a44756d2d5f98e [0,1,1,0,0,0|1,1,0]=4 659 B10R0.74 C=COCCCNC(=O)CS 3cd4ecf341176524771e51861890c3b1 [0,1,1,0,0,0|1,1,0]=4 660 B10R0.74 CCC(=O)NCCNCC=O 4fe17667087b372be7131ba919d3246a [0,1,1,0,0,0|2,0,0]=4 661 B10R0.74 CCC(=O)NCCOCC=O 072367443bd0c933e25dac832d2b5637 [0,1,1,0,0,0|2,0,0]=4 662 B10R0.74 COC(=O)CCCCNC=O 3b0149e079715ae53ff5de3a02b476ed [0,1,1,0,0,0|2,0,0]=4 663 B10R0.75 C=CCCCCN(C)C(=O)C f194631be33ab7207dee0ea4173fc61e [0,1,1,0,0,0|2,0,0]=4 664 B10R0.75 CC(=O)N(C)CCOCC=O 05e49c7ee31c7c096eb455377db44f9d [0,1,1,0,0,0|2,0,0]=4 665 B10R0.78 C=CCCC(O)CNC(=O)C a473bb6d88c2bf0568eb62604d7e380d [0,1,1,0,0,0|2,0,0]=4 666 B10R0.78 CC(=O)NCC(C)OCC=O 9baba60e241df20e357ce516d71cb96e [0,1,1,0,0,0|2,0,0]=4 667 B10R0.97 CC(=O)CCOCNC(=O)C 1350c289650a2f1c96c5d7b10fe61adf [0,1,1,0,0,0|2,0,0]=4 668 B10R0.97 CC(=O)CCOCSC(=O)N 0a5002dcf57286d9d9866ac922e96571 [0,1,1,0,0,0|2,0,0]=4 669 B10R0.97 CC(=O)CNCCNC(=O)C 761d34b344e8cb20b7c79267a98ae1a6 [0,1,1,0,0,0|2,0,0]=4 670 B10R0.97 CC(=O)CNCCSC(=O)C d423517e32849d9a34aa0896cd824449 [0,1,1,0,0,0|2,0,0]=4 671 B10R0.97 CC(=O)COCCNC(=O)C 8f6bb90c4a52be17d5cf0399e7a727b7 [0,1,1,0,0,0|2,0,0]=4 672 B10R0.97 CC(=O)COCCSC(=O)C 6841ea825e53ab00e3389e3fbb3339de [0,1,1,0,0,0|2,0,0]=4 673 B10R0.97 CC(=O)NCCCCC(=O)N f0b49d5713f49cbe84c3014215dd812a [0,1,1,0,0,0|1,0,0]=3 674 B10R0.97 CC(=O)NCCCNC(=O)C 96a47162803e6bf81b4b779a9aa41d2d [0,1,1,0,0,0|1,0,0]=3 675 B10R0.97 CC(=O)NCCCSC(C)C c9bc4609c77837c2982f65228065d46f [0,1,1,0,0,0|1,0,1]=4 676 B10R0.97 CC(=O)NCCNCC(=O)N b4be99dd26c1e47b000c7ed1b808b93c [0,1,1,0,0,0|2,0,0]=4 677 B10R0.97 CC(=O)NCCNCC(=O)O 6e5d75202d0baca9a5055b6bdbaf0499 [0,1,1,0,0,0|2,0,0]=4 678 B10R0.97 CC(=O)NCCOCC(=O)N 39dcc1749489c77be1c28d5f8a76aee8 [0,1,1,0,0,0|2,0,0]=4 679 B10R0.97 CC(=O)NCCOCC(=O)O e8f4fcda0abddeb81c1abe4d71b3d705 [0,1,1,0,0,0|2,0,0]=4 680 B10R0.97 CC(=O)NCOCCC(=O)N 2b5d599ebf5d9480764a5965cc60580c [0,1,1,0,0,0|2,0,0]=4 681 B10R0.97 CC(=O)NCOCCC(=O)O 1956da499b74a783ec3c32e1a5e7dffd [0,1,1,0,0,0|2,0,0]=4 682 B10R0.97 CC(=O)NCOCOC(=O)C 5e1d8c60fe23831006933725e0dc87a9 [0,1,1,0,0,0|1,1,0]=4 683 B10R0.97 CC(=O)NCOCSC(=O)N 14c5a560edf0151adb8bb367654bda9c [0,1,1,0,0,0|1,0,0]=3 684 B10R0.97 NC(=O)NCOCSC(=O)N 73eb04923a0d4d901192ae8274d8f16e [0,1,1,0,0,0|2,0,0]=4 685 B10R0.23 CC(C)NC(CCS)C(=O)O 298eddfacbf8da8112c5444c6c8273ea [0,1,1,0,0,0|1,0,1]=4 686 B10R0.23 CC(C)N[C@@H](CCS)C(=O)O 4fb3891c10f8bd43b9e54afa60141879 [0,1,1,0,0,0|1,0,1]=4 687 B10R0.23 CC(C)N[C@H](CCS)C(=O)O 7df1c85449d2fcf51dcaf692269fc8e3 [0,1,1,0,0,0|1,0,1]=4 688 B10R0.87 CSCCC(CO)NC(=O)C 9e18561ebee7a9396f9bd5128c675bd0 [0,1,1,0,0,0|0,0,2]=4 689 B10R0.87 CSCC[C@@H](CO)NC(=O)C 2c1e5c35361767b8bd4625160d42c2f4 [0,1,1,0,0,0|0,0,2]=4 690 B10R0.87 CSCC[C@H](CO)NC(=O)C 6eade2ad3d80da8a4569e7ffe722000f [0,1,1,0,0,0|0,0,2]=4 691 B10R0.13 CC(=O)NC(C)C(=O)N(C)C 5ec8149a270a46b4d9976efdac58088b [0,1,1,0,0,0|1,0,0]=3 692 B10R0.13 CC(=O)N[C@@H](C)C(=O)N(C)C 60cde8e64263e24ff3d75f99dad1a939 [0,1,1,0,0,0|1,0,0]=3 693 B10R0.32 CCNC(=O)[C@H](C)NC(=O)C e12fa7d18451683c96abdd9360a342c3 [0,1,1,0,0,0|1,0,0]=3 694 B10R0.32 CCOC(=O)[C@@H](C)NC(=O)C 455072983f97e75ccfacfb1015e130ab [0,1,1,0,0,0|0,1,0]=3 695 B10R0.46 C#CC(=O)NC(C)C(=O)NC 4d9ce22e6c91db4381af8736473239b6 [0,1,1,0,0,0|1,0,1]=4 696 B10R0.46 C=CC(=O)NC(C)C(=O)NC c0e30073d0daf718db68acb803fdfc23 [0,1,1,0,0,0|1,0,1]=4 697 B10R0.46 CCC(=O)NC(C)C(=O)NC 970cd6def14c595efebfb1f400dc91c4 [0,1,1,0,0,0|1,0,0]=3 698 B10R0.46 CNC(=O)C(C)NC(=O)C=O 9c595a9c9f54eeccb69ccf9964b741a5 [0,1,1,0,0,0|1,0,1]=4 699 B10R0.46 CNC(=O)C(C)NC(=O)CF 6e8fe611eb8aa3bd1ba21fc61a5877a2 [0,1,1,0,0,0|1,0,0]=3 700 B10R0.46 CNC(=O)C(C)NC(C)C=O 12d2e85b726bbe5bffc0a016fc952f41 [0,1,1,0,0,0|1,0,1]=4 701 B10R0.46 CNC(=O)C(C)N[C@H](C)C=O ab034be64e79d7fb00150e79495c5dd9 [0,1,1,0,0,0|1,0,1]=4 702 B10R0.56 CNC(=O)C(C)N(C)C(=O)C 373d6f6f9aad1f0e27ceaa0dcff31f8d [0,1,1,0,0,0|1,0,0]=3 703 B10R0.56 COC(=O)C(C)N(C)C(=O)C 51096f1f7788dcf2198a342fc4fcc24b [0,1,1,0,0,0|0,1,0]=3 704 B10R0.141 COC(=O)C(C)(C)NC(=O)C 8e240d603b1a7ed657a53e482c12cbbf [0,1,1,0,0,0|0,1,0]=3 705 B10R0.53 C#CC(=O)NC(CC)C(=O)N 6dedded7628929c743c0cdc665215fce [0,1,1,0,0,0|1,0,1]=4 706 B10R0.53 C#CC(=O)N[C@@H](CC)C(=O)N 345e1f2dc7e6092369cf581ec3d5a0fa [0,1,1,0,0,0|1,0,1]=4 707 B10R0.53 C=CC(=O)NC(CC)C(=O)N 171cbe835b6fcb7f8ed6708c7ab1c48e [0,1,1,0,0,0|1,0,1]=4 708 B10R0.53 C=CC(=O)N[C@@H](CC)C(=O)N f228865e5e53303d665b790e1f9efe27 [0,1,1,0,0,0|1,0,1]=4 709 B10R0.53 CCC(=O)NC(CC)C(=O)N 7497d020ddff19c661a056413b9f0396 [0,1,1,0,0,0|1,0,0]=3 710 B10R0.53 CCC(=O)NC(CO)C(=O)N cad6746fce10e25561019ced49df3990 [0,1,1,0,0,0|2,0,0]=4 711 B10R0.53 CCC(=O)N[C@@H](CC)C(=O)N d100116a9d5748f8c2672afb7bf508c2 [0,1,1,0,0,0|1,0,0]=3 712 B10R0.53 CCC(=O)N[C@@H](CO)C(=O)N 50bb2e592ec46fcc1161e7e7fe6049a1 [0,1,1,0,0,0|2,0,0]=4 713 B10R0.53 CCC(NC(=O)C=O)C(=O)N 89579308eb759f11f47bcd7aaab1998b [0,1,1,0,0,0|1,0,1]=4 714 B10R0.53 CCC(NC(=O)CF)C(=O)N 284a9d2127d4517fb2a4b25c8a7522b6 [0,1,1,0,0,0|1,0,0]=3 715 B10R0.53 CCC(NC(=O)CO)C(=O)N 22176bf119a31ff88e9f44778644a228 [0,1,1,0,0,0|1,0,0]=3 716 B10R0.53 CCC(NC(=O)CS)C(=O)N 0496092e2e37fb592176ce5562955936 [0,1,1,0,0,0|1,0,0]=3 717 B10R0.53 CCC(NC(C)C=O)C(=O)N da04ac1709b4fe61142b4ad7917fbe78 [0,1,1,0,0,0|1,0,1]=4 718 B10R0.53 CCC(NC(C)C=O)C(=O)O cad7837f38b0ec4b4f9905e3826f9766 [0,1,1,0,0,0|0,1,1]=4 719 B10R0.53 CCC(N[C@H](C)C=O)C(=O)N 86e27ddb31ce7454996741d65cb78082 [0,1,1,0,0,0|1,0,1]=4 720 B10R0.53 CCC(N[C@H](C)C=O)C(=O)O e2a358cc720ff32532867123a254e270 [0,1,1,0,0,0|0,1,1]=4 721 B10R0.53 CC[C@@H](NC(C)C=O)C(=O)O 14b0cd2bb6e24a59c7f25557e51afb68 [0,1,1,0,0,0|0,1,1]=4 722 B10R0.53 CC[C@@H](N[C@H](C)C=O)C(=O)O 220afe47e05625dbeeb0a164db1c9e04 [0,1,1,0,0,0|0,1,1]=4 723 B10R0.53 CC[C@H](NC(=O)C=O)C(=O)N fba6baf4972be44f605c4fd1e407d451 [0,1,1,0,0,0|1,0,1]=4 724 B10R0.53 CC[C@H](NC(=O)CF)C(=O)N d734b5b6a45724e6120b5fdc0ac96b51 [0,1,1,0,0,0|1,0,0]=3 725 B10R0.53 CC[C@H](NC(=O)CO)C(=O)N 28baa9b8bddf248c832cd95ee67fa74e [0,1,1,0,0,0|1,0,0]=3 726 B10R0.53 CC[C@H](NC(=O)CS)C(=O)N 23993dad4f84f9c880b172a9bc513758 [0,1,1,0,0,0|1,0,0]=3 727 B10R0.53 CC[C@H](NC(C)C=O)C(=O)N 9b90964a88cae90c2f19121dfaa33894 [0,1,1,0,0,0|1,0,1]=4 728 B10R0.53 CC[C@H](NC(C)C=O)C(=O)O 32c0116afb5d38396a16bf1af5914fb9 [0,1,1,0,0,0|0,1,1]=4 729 B10R0.53 CC[C@H](N[C@H](C)C=O)C(=O)N 9f60be76adeb2863aaf7e6f040cbda3e [0,1,1,0,0,0|1,0,1]=4 730 B10R0.53 CC[C@H](N[C@H](C)C=O)C(=O)O 6cf88e9850fcfcb6e8c669bfffb006ff [0,1,1,0,0,0|0,1,1]=4 731 B10R0.53 NC(=O)C(CO)NC(=O)CF 1cc81eb7a0e5b366edac2858e064766e [0,1,1,0,0,0|2,0,0]=4 732 B10R0.53 NC(=O)C(CO)NC(=O)CO 2378053e5ed862abcea73f9236293890 [0,1,1,0,0,0|2,0,0]=4 733 B10R0.53 NC(=O)C(CO)NC(=O)CS 912dbdc892de2a38023d068176e15789 [0,1,1,0,0,0|2,0,0]=4 734 B10R0.53 NC(=O)[C@H](CO)NC(=O)CF 786e525be947342ee2fa2e7cdc055466 [0,1,1,0,0,0|2,0,0]=4 735 B10R0.53 NC(=O)[C@H](CO)NC(=O)CO 6d3b09713490a4d65b0f8fdc2a9dc86f [0,1,1,0,0,0|2,0,0]=4 736 B10R0.53 NC(=O)[C@H](CO)NC(=O)CS e9979cbb2b91424e855fc222ddb3a87b [0,1,1,0,0,0|2,0,0]=4 737 B10R0.76 CCC(C(=O)N)N(C)C(=O)C 59b4b21f723513ac6585b0afcf696aeb [0,1,1,0,0,0|1,0,0]=3 738 B10R0.119 CCC(C)(NC(=O)C)C(=O)N 69de59d3ba44d8eb299a5e5780fd42a4 [0,1,1,0,0,0|1,0,0]=3 739 B10R0.162 CC(=O)N[C@H](C(=O)N)[C@@H](C)O a2a054e9300ba62589b8bf1b67b8bc21 [0,1,1,0,0,0|1,0,0]=3 740 B10R0.57 CCN(C)C(=O)CCC(=O)C 41d76f573d15a8ffab790caea255d73f [0,1,1,0,0,0|2,0,0]=4 741 B10R0.57 CCN(C)C(=O)CNC(=O)C d7ebef4bce2ff1cdc20c08972c89c30a [0,1,1,0,0,0|1,0,0]=3 742 B10R0.57 CCN(C)C(=O)CNC(=O)N 89da546f1a0d8b7196abce46cad3faf1 [0,1,1,0,0,0|2,0,0]=4 743 B10R0.57 CCN(C)C(=O)CNC(=S)C 6fca8d6bc50a33a7e7d152021e2a3bd1 [0,1,1,0,0,0|1,1,0]=4 744 B10R0.57 CCN(C)C(=O)COC(=O)C 103af15bf42fbdc78b4619b11308dcc4 [0,1,1,0,0,0|2,0,0]=4 745 B10R0.57 CCN(C)C(=O)CSC(=O)C c0845aaf55f160b9f8e080d381d77ea1 [0,1,1,0,0,0|2,0,0]=4 746 B10R0.96 CC(=O)NCC(=O)NC(C)C 6788917e5dacb6247f33ff5f08fdce6e [0,1,1,0,0,0|1,0,0]=3 747 B10R0.108 C#CC(=O)NCC(=O)NCC 424cdadb9901c1459c447c6338330ef3 [0,1,1,0,0,0|1,0,1]=4 748 B10R0.108 C#CC(=O)NCC(=O)OCC ef79f867a43d78a2f15fb95c3af9220b [0,1,1,0,0,0|0,1,1]=4 749 B10R0.108 C=CC(=O)NCC(=O)NCC d1228d28792befa2af65cb1d6678ad04 [0,1,1,0,0,0|1,0,1]=4 750 B10R0.108 C=CC(=O)NCC(=O)OCC b4983d1b3b409ce2f9a52e3e3994f669 [0,1,1,0,0,0|0,1,1]=4 751 B10R0.108 CCNC(=O)CNC(=O)C=O 4907fbf5a63ef8981ce958e5de1cc0d5 [0,1,1,0,0,0|1,0,1]=4 752 B10R0.108 CCNC(=O)CNC(=O)CC c45137700a4c423ddcc8469c7ca8dbd6 [0,1,1,0,0,0|1,0,0]=3 753 B10R0.108 CCNC(=O)CNC(=O)CF cc197fcce003ffa273af021213819154 [0,1,1,0,0,0|1,0,0]=3 754 B10R0.108 CCNC(=O)CNC(=O)CO ed14814c3c61723ad31dc8c4716bceb0 [0,1,1,0,0,0|1,0,0]=3 755 B10R0.108 CCNC(=O)CNC(=O)CS b2ab50219920135b1c0fe173ffb53df9 [0,1,1,0,0,0|1,0,0]=3 756 B10R0.108 CCNC(=O)CNC(C)C=O 9f07b75c1b7f60b0e1de288baac7365c [0,1,1,0,0,0|1,0,1]=4 757 B10R0.108 CCNC(=O)CN[C@H](C)C=O 11b658c539467fcb20e24804e44658c3 [0,1,1,0,0,0|1,0,1]=4 758 B10R0.108 CCOC(=O)CNC(=O)C=O 046320b46bdb026ef700b3546766c9cd [0,1,1,0,0,0|0,1,1]=4 759 B10R0.108 CCOC(=O)CNC(=O)CC d3d7341838c871ad43be6029bfd75589 [0,1,1,0,0,0|0,1,0]=3 760 B10R0.108 CCOC(=O)CNC(=O)CF 05790ee826d32fec9e32d5522f771775 [0,1,1,0,0,0|0,1,0]=3 761 B10R0.108 CCOC(=O)CNC(=O)CO 52a6489f086df64013337d9badd7f874 [0,1,1,0,0,0|0,1,0]=3 762 B10R0.108 CCOC(=O)CNC(=O)CS 34ec043859001343d9899146a37a1676 [0,1,1,0,0,0|0,1,0]=3 763 B10R0.108 CCOC(=O)CNC(C)C=O 66bc0f6d15476418d42cb769f731525c [0,1,1,0,0,0|0,1,1]=4 764 B10R0.108 CCOC(=O)CN[C@H](C)C=O 7053be303ce29ad6b0baa2e6a9f98e24 [0,1,1,0,0,0|0,1,1]=4 765 B10R1.23 CC(=O)N(C)C1CCCC1 37a3ae82d72cb34070af60e7d609e543 [1,1,0,0,0,0|1,0,1]=4 766 B10R1.23 CC(=O)N(C)C1CCOC1 3f6d988325151ec0aeb3f09953ed02ba [1,1,0,0,0,0|0,1,1]=4 767 B10R1.23 CC(=O)N(C)[C@@H]1CCOC1 e1b63cac123b30fade0eadedc46ab1a9 [1,1,0,0,0,0|0,1,1]=4 768 B10R1.23 CC(=O)N(C)[C@H]1CCOC1 2780d0ece9618482f901bcb9122869be [1,1,0,0,0,0|0,1,1]=4 769 B10R1.27 C#CC(=O)NC1CCSC1 b78a65acb375ac57114a2efa42bc4ac7 [1,1,0,0,0,0|0,0,2]=4 770 B10R1.27 C=CC(=O)NC1CCSC1 dfdc382d2cb01066e34a6ef670643be2 [1,1,0,0,0,0|0,0,2]=4 771 B10R1.27 CC(C=O)NC1CCSC1 4a0c373c381736e3a29b188ac36c0b7b [1,1,0,0,0,0|0,0,2]=4 772 B10R1.27 CCC(=O)NC1CCCC1 ad0e329a839e42fb4e68b66bf7fc6efa [1,1,0,0,0,0|1,0,1]=4 773 B10R1.27 CCC(=O)NC1CCOC1 87d823c2977e75e2fb89114c398fc88c [1,1,0,0,0,0|0,1,1]=4 774 B10R1.27 CCC(=O)NC1CCSC1 127f48c4e5eb5bad27859a6e7623bb0c [1,1,0,0,0,0|0,0,1]=3 775 B10R1.27 CCC(=O)N[C@@H]1CCOC1 469148a4d98c127e4133b4bff5bab61c [1,1,0,0,0,0|0,1,1]=4 776 B10R1.27 CCC(=O)N[C@H]1CCOC1 b0d0a712a6b535c8cf47044a81b431e0 [1,1,0,0,0,0|0,1,1]=4 777 B10R1.27 C[C@H](C=O)NC1CCSC1 071bf5059e060e6580cb21968c2a7e04 [1,1,0,0,0,0|0,0,2]=4 778 B10R1.27 O=C(CF)NC1CCCC1 7def253a7d58d7abaf0b2c052c6b4bd2 [1,1,0,0,0,0|1,0,1]=4 779 B10R1.27 O=C(CF)NC1CCOC1 33e5f1e70cdc764a47db4e52122e2796 [1,1,0,0,0,0|0,1,1]=4 780 B10R1.27 O=C(CF)NC1CCSC1 d1595aa6e540df3f342e0b4666d0f95e [1,1,0,0,0,0|0,0,1]=3 781 B10R1.27 O=C(CF)N[C@@H]1CCOC1 f96274d5e4278cbd07bf07d98fa9f59c [1,1,0,0,0,0|0,1,1]=4 782 B10R1.27 O=C(CF)N[C@H]1CCOC1 4ec4c61d59f9bc7525d88aa7e08510d9 [1,1,0,0,0,0|0,1,1]=4 783 B10R1.27 O=C(CO)NC1CCCC1 a2af8330b212ec9a8ca0312ee053bb08 [1,1,0,0,0,0|1,0,1]=4 784 B10R1.27 O=C(CO)NC1CCOC1 da3328a3326718ab84da48dbdce512b6 [1,1,0,0,0,0|0,1,1]=4 785 B10R1.27 O=C(CO)NC1CCSC1 434d62499df8000b95e4d641799beba3 [1,1,0,0,0,0|0,0,1]=3 786 B10R1.27 O=C(CO)N[C@@H]1CCOC1 3e1bdc77aa678067b9bc110730f6411f [1,1,0,0,0,0|0,1,1]=4 787 B10R1.27 O=C(CO)N[C@H]1CCOC1 0f500b702bc6a6a7c1ac309f8f75c5cb [1,1,0,0,0,0|0,1,1]=4 788 B10R1.27 O=C(CS)NC1CCCC1 e18c16444a3ea35ed584a201cdde414c [1,1,0,0,0,0|1,0,1]=4 789 B10R1.27 O=C(CS)NC1CCSC1 395a9897fc51469e8f07ba01ac1669eb [1,1,0,0,0,0|0,0,1]=3 790 B10R1.27 O=CC(=O)NC1CCSC1 1aee31a1ca9a5bf8229ac32d18860d70 [1,1,0,0,0,0|0,0,2]=4 791 B10R1.54 CC(=O)NC1CCC(C1)C 1662f3e59706b2e0b9c86006d2f191db [1,1,0,0,0,0|1,0,1]=4 792 B10R1.54 CC(=O)NC1CCC(C1)O 8df0ebcee037b9fdc688d44933d4c3db [1,1,0,0,0,0|1,0,1]=4 793 B10R1.54 CC(=O)NC1CCN(C1)C 28c48e89cd6b6bf72d05e376802efd43 [1,1,0,0,0,0|1,0,1]=4 794 B10R1.54 CC(=O)N[C@@H]1C=C[C@@H](C1)O 3c5d449b83a9068c632156e6fad4a84d [1,1,0,0,0,0|1,0,0]=3 795 B10R1.54 CC(=O)N[C@@H]1CCN(C1)C 26a67a7a4455401b5ab5bb81bad268e9 [1,1,0,0,0,0|1,0,1]=4 796 B10R1.54 CC(=O)N[C@@H]1CC[C@@H](C1)O bd5d5487a5426aee6c8b85f7d6a82f6d [1,1,0,0,0,0|1,0,1]=4 797 B10R1.54 CC(=O)N[C@@H]1CC[C@H](C1)O e9b3bd4a14f9308205f6e539850076b4 [1,1,0,0,0,0|1,0,1]=4 798 B10R1.54 CC(=O)N[C@H]1C=C[C@H](C1)O 5da21737f4afea7787ecde715b144bdd [1,1,0,0,0,0|1,0,0]=3 799 B10R1.54 CC(=O)N[C@H]1CCN(C1)C 68caebbe94900fefc5f90819e5042e75 [1,1,0,0,0,0|1,0,1]=4 800 B10R1.54 CC(=O)N[C@H]1CC[C@@H](C1)O 9699b4c6ebe806fb645f613f502422f4 [1,1,0,0,0,0|1,0,1]=4 801 B10R1.54 CC(=O)N[C@H]1CC[C@H](C1)O aee6acb4424af3e957060a2ce53ddcc8 [1,1,0,0,0,0|1,0,1]=4 802 B10R1.29 C#CCNC1CCSC1=O b044d9b2cc907a51c5aef0d9b516ce82 [1,1,0,0,0,0|0,0,2]=4 803 B10R1.29 C=CCNC1CCNC1=O b52ff4f80d13277b660ee5c2a11eccc4 [1,1,0,0,0,0|1,0,1]=4 804 B10R1.29 C=CCNC1CCSC1=O 6e9ffe80ce0ab62261a8191cbdb866aa [1,1,0,0,0,0|0,0,1]=3 805 B10R1.29 C=CCN[C@@H]1CCNC1=O ce96b6618fed311336c6034d1d3e9c5d [1,1,0,0,0,0|1,0,1]=4 806 B10R1.29 C=CCN[C@@H]1CCOC1=O d6154d084ee2779ad7e85a27d4df18fd [1,1,0,0,0,0|0,1,1]=4 807 B10R1.29 C=CCN[C@H]1CCNC1=O 5e2b88ef89cdbba9eaa370b61768de51 [1,1,0,0,0,0|1,0,1]=4 808 B10R1.29 C=CCN[C@H]1CCOC1=O d685f9edc04f02dcf1ac56cc7d516e32 [1,1,0,0,0,0|0,1,1]=4 809 B10R1.29 CCCNC1CCCC1=O 92270db65b4e768bf74c060f3ddca1d2 [1,1,0,0,0,0|1,0,1]=4 810 B10R1.29 CCCNC1CCNC1=O 826c3328fa4dd7dd5dd8c3d568a3408e [1,1,0,0,0,0|1,0,1]=4 811 B10R1.29 CCCNC1CCSC1=O 2f88eaf0893fc5d79036a5fe5a76847c [1,1,0,0,0,0|0,0,1]=3 812 B10R1.29 CCCN[C@@H]1CCNC1=O 881bee3ef919f2d395ee9f82cce415b2 [1,1,0,0,0,0|1,0,1]=4 813 B10R1.29 CCCN[C@@H]1CCOC1=O 093e5b8bf1b7aee96a6d4b18a27dd8a3 [1,1,0,0,0,0|0,1,1]=4 814 B10R1.29 CCCN[C@H]1CCNC1=O 28513bf65ca36f558ae2e34f11c0860c [1,1,0,0,0,0|1,0,1]=4 815 B10R1.29 CCCN[C@H]1CCOC1=O 6fb700cd323815a8f11591a44ec6a9ee [1,1,0,0,0,0|0,1,1]=4 816 B10R1.29 CCNCC1CCNC1=O cfa18f78ea048520c0930de42321c56e [1,1,0,0,0,0|1,0,1]=4 817 B10R1.29 COCNC1CCNC1=O 02daaeb9ec282d6d8fb25d9b3a1f9bc8 [1,1,0,0,0,0|1,0,1]=4 818 B10R1.29 COCNC1CCSC1=O 576fdd8a7cfece9baa64c9406b50b4a5 [1,1,0,0,0,0|0,0,1]=3 819 B10R1.29 COCN[C@@H]1CCNC1=O baecdaa8353b74be9191a4bbb2ea1e6e [1,1,0,0,0,0|1,0,1]=4 820 B10R1.29 COCN[C@@H]1CCOC1=O f59fcd74007bcd1d5cc732269819219f [1,1,0,0,0,0|0,1,1]=4 821 B10R1.29 COCN[C@H]1CCNC1=O cb0b817db6741d657f9fc2f102d02169 [1,1,0,0,0,0|1,0,1]=4 822 B10R1.29 COCN[C@H]1CCOC1=O fd7bc00ec12dae14b5676db5b711c45d [1,1,0,0,0,0|0,1,1]=4 823 B10R1.29 CSCNC1CCNC1=O fc260eb279666942501d4990e3b7e00a [1,1,0,0,0,0|1,0,1]=4 824 B10R1.29 CSCNC1CCSC1=O 57208c3bbc9003ceaa317600a9a5d4f4 [1,1,0,0,0,0|0,0,1]=3 825 B10R1.29 CSCN[C@@H]1CCNC1=O 97ac26a41e418fdbf88d5ef5b02231aa [1,1,0,0,0,0|1,0,1]=4 826 B10R1.29 CSCN[C@@H]1CCOC1=O e33612666f7375193a5b091e62a82c44 [1,1,0,0,0,0|0,1,1]=4 827 B10R1.29 CSCN[C@H]1CCNC1=O d78fd99402fa5137e41f063732cd9cde [1,1,0,0,0,0|1,0,1]=4 828 B10R1.29 CSCN[C@H]1CCOC1=O 6f470a401f898acd687d28b8feb595e6 [1,1,0,0,0,0|0,1,1]=4 829 B10R1.29 N#CCNC1CCSC1=O 01f75aada50ebc4aa01bc4d0bba249da [1,1,0,0,0,0|0,0,2]=4 830 B10R1.29 O=C1CCCC1NCCBr 290d3c72b0f0ece08be4b88910ed41af [1,1,0,0,0,0|1,0,1]=4 831 B10R1.29 O=C1CCCC1NCCI bc8f7bd50f547f74fa5fcbb6da0febc5 [1,1,0,0,0,0|1,0,1]=4 832 B10R1.29 O=C1CCCC1NCCO c0c0b931d9c69710892d72abef2c7869 [1,1,0,0,0,0|1,0,1]=4 833 B10R1.29 O=C1CCCC1NCCS ced2dcba1c7d80e404bf89a0a611c948 [1,1,0,0,0,0|1,0,1]=4 834 B10R1.29 O=C1NCCC1NCCBr eeceda88d0c026cd4d6e214a656e2eef [1,1,0,0,0,0|1,0,1]=4 835 B10R1.29 O=C1NCCC1NCCF 80f636cd1b1a31b31f5587cbdf8592cf [1,1,0,0,0,0|1,0,1]=4 836 B10R1.29 O=C1NCCC1NCCI a034a6e857ec8079d2964ee7e9aa8438 [1,1,0,0,0,0|1,0,1]=4 837 B10R1.29 O=C1NCCC1NCCO a1e976c111bc706cb10fe7a11824863b [1,1,0,0,0,0|1,0,1]=4 838 B10R1.29 O=C1NCCC1NCCS a5db914cc7c0774a4ee296476da01a51 [1,1,0,0,0,0|1,0,1]=4 839 B10R1.29 O=C1NCC[C@@H]1NCCF e6cb9fe4f93f2cf521da92f948f78e21 [1,1,0,0,0,0|1,0,1]=4 840 B10R1.29 O=C1NCC[C@@H]1NCCO dee0a534b69ff05dc2ade486577161b4 [1,1,0,0,0,0|1,0,1]=4 841 B10R1.29 O=C1NCC[C@@H]1NCCS aee0df7ef1a758dd799ba08fd571468c [1,1,0,0,0,0|1,0,1]=4 842 B10R1.29 O=C1NCC[C@H]1NCCF e7b257a7ff753463bf787f678f1ba582 [1,1,0,0,0,0|1,0,1]=4 843 B10R1.29 O=C1NCC[C@H]1NCCO 90bf5b895ce61453349830a213c29eb9 [1,1,0,0,0,0|1,0,1]=4 844 B10R1.29 O=C1NCC[C@H]1NCCS b8c9ac5df80aa5c9ac22cb0607c31f63 [1,1,0,0,0,0|1,0,1]=4 845 B10R1.29 O=C1OCC[C@@H]1NCCF 163ef1d2d333bddc35dee0619137d8f7 [1,1,0,0,0,0|0,1,1]=4 846 B10R1.29 O=C1OCC[C@@H]1NCCO f07e1cc332babcc8239cab6f5999e4fc [1,1,0,0,0,0|0,1,1]=4 847 B10R1.29 O=C1OCC[C@@H]1NCCS 947b41ed7f833ffd75739a0b4c4ac19a [1,1,0,0,0,0|0,1,1]=4 848 B10R1.29 O=C1OCC[C@H]1NCCF 3dbba06316584889dd603da60b99eaf9 [1,1,0,0,0,0|0,1,1]=4 849 B10R1.29 O=C1OCC[C@H]1NCCO 40e6125077aaf4e7f5bb18567238ea28 [1,1,0,0,0,0|0,1,1]=4 850 B10R1.29 O=C1OCC[C@H]1NCCS 72bf8b4b5b9a1f0e2606f4c4970c2fe5 [1,1,0,0,0,0|0,1,1]=4 851 B10R1.29 O=C1SCCC1NCCF 759d19e8388d8c5da328855c073367a6 [1,1,0,0,0,0|0,0,1]=3 852 B10R1.29 O=C1SCCC1NCCO aacb2ecd0370a351387f2e3c46171e16 [1,1,0,0,0,0|0,0,1]=3 853 B10R1.29 O=C1SCCC1NCCS adb048b5658e1cffb21f5c81b38c40bb [1,1,0,0,0,0|0,0,1]=3 854 B10R1.29 O=CCNC1CCNC1=O 3ffd0a7e29caa0683ee17f097bb822ec [1,1,0,0,0,0|1,0,0]=3 855 B10R1.29 O=CCNC1CCSC1=O c1eb9f1ccf76f6f1773d366c936e8636 [1,1,0,0,0,0|0,0,0]=2 856 B10R1.29 O=CCNC1CONC1=O dd70993725900c4ca1b6e7483dd2c972 [1,1,0,0,0,0|2,0,0]=4 857 B10R1.29 O=CCN[C@@H]1CCNC1=O c94d55756b2f33336906a62c92fb8c74 [1,1,0,0,0,0|1,0,0]=3 858 B10R1.29 O=CCN[C@@H]1CCOC1=O 3ea0be769ccf09041e68aa2c49374e81 [1,1,0,0,0,0|0,1,0]=3 859 B10R1.29 O=CCN[C@@H]1CONC1=O 5ab118b8715ca23a6ae7c39f9686f372 [1,1,0,0,0,0|2,0,0]=4 860 B10R1.29 O=CCN[C@H]1CCNC1=O a9070c919bd45960910927a05fa14781 [1,1,0,0,0,0|1,0,0]=3 861 B10R1.29 O=CCN[C@H]1CCOC1=O 4653d81af95cdef835b16804b3513bf1 [1,1,0,0,0,0|0,1,0]=3 862 B10R1.29 O=CCN[C@H]1CONC1=O 8fb7681fa80d5276d140821421abfd4f [1,1,0,0,0,0|2,0,0]=4 863 B10R1.29 O=CCOC1CCCC1=O 4eff49ffc86550920140ccf5b8449986 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.29 O=CCOC1CCNC1=O 994e12e01d24a97ce9a230b32736768b [1,1,0,0,0,0|2,0,0]=4 865 B10R1.29 O=CCOC1CCOC1=O 1a8d096af9696aefb7bb484affc7db87 [1,1,0,0,0,0|1,1,0]=4 866 B10R1.29 O=CCO[C@@H]1CCNC1=O e215bad9dcf2bd903fea5232a118d2fc [1,1,0,0,0,0|2,0,0]=4 867 B10R1.29 O=CCO[C@@H]1CCOC1=O 7a495fc2ea04aaa922a2cdcf1f99832c [1,1,0,0,0,0|1,1,0]=4 868 B10R1.29 O=CCO[C@H]1CCNC1=O 4c77dd4377e2411874ef7166ea2a4439 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.29 O=CCO[C@H]1CCOC1=O 5c6284ff7864968e59bf09b456df5b11 [1,1,0,0,0,0|1,1,0]=4 870 B10R1.29 O=CNCC1CCNC1=O 3d8f4f33b72c75f69e5be126ab9ecea5 [1,1,0,0,0,0|1,0,0]=3 871 B10R1.94 CCNC1CCN(C1=O)C 1241daa572815e530b39b7ba74f412da [1,1,0,0,0,0|1,0,1]=4 872 B10R1.94 CCNC1CCN(C1=O)O a8014b6a0e4cb178a99da5762361c187 [1,1,0,0,0,0|1,0,1]=4 873 B10R1.94 CCN[C@@H]1CCN(C1=O)C 95d82e8e6a1369f5d742bbd2ebdf8539 [1,1,0,0,0,0|1,0,1]=4 874 B10R1.94 CCN[C@@H]1CCN(C1=O)O 20cce75be4d135f06eb0b5cd80deeced [1,1,0,0,0,0|1,0,1]=4 875 B10R1.94 CCN[C@H]1CCN(C1=O)C 77c861beb20fb2835dd9e4a082febc26 [1,1,0,0,0,0|1,0,1]=4 876 B10R1.94 O=CNC1CCN(C1=O)O 38cb447030fec32666cd744b084159c7 [1,1,0,0,0,0|1,0,0]=3 877 B10R1.94 O=CN[C@@H]1CCN(C1=O)O decb21e048a7aa92d75ad61fbc5330d4 [1,1,0,0,0,0|1,0,0]=3 878 B10R1.130 O=CNC1CC(=O)NC1=O 4e2381fcd427cb975b2906351770f389 [1,1,0,0,0,0|1,0,1]=4 879 B10R1.130 O=CN[C@@H]1CC(=O)NC1=O ca9014166dce8b7c20f2156421b769e5 [1,1,0,0,0,0|1,0,1]=4 880 B10R1.130 O=CN[C@H]1CC(=O)NC1=O ac7a98721642fad1dec9dcd7c3f9983f [1,1,0,0,0,0|1,0,1]=4 881 B10R1.187 CCN[C@@H]1C(=O)NC[C@H]1O e8a9e3b563b3692607779b9fed676e68 [1,1,0,0,0,0|1,0,1]=4 882 B10R1.187 O=CN[C@@H]1C(=O)NC[C@H]1O 95f1c815cbbfa193e04a10ac4c860614 [1,1,0,0,0,0|1,0,0]=3 883 B10R1.527 CC1(CCNC1=O)NC=O 95c64877b861edbfbb95012ee43e9aaa [1,1,0,0,0,0|1,0,0]=3 884 B10R1.527 CCNC1(CCNC1=O)C 5ce47bffaa327e244550d9ec978763b4 [1,1,0,0,0,0|1,0,1]=4 885 B10R1.80 CC(=O)N[C@@H]1CN(C1=O)C 6d98f51b2d81135e4f5b27d5d839978f [0,1,0,0,1,0|1,0,0]=3 886 B10R1.80 CC(=O)N[C@H]1CN(C1=O)C 7c442089d92813928f3728f6985b424b [0,1,0,0,1,0|1,0,0]=3 887 B10R1.173 COC1CCC1NC(=O)C 25dc329934ae20ae647eaff3b135d675 [0,1,0,0,1,0|0,0,2]=4 888 B10R1.173 CO[C@@H]1CC[C@@H]1NC(=O)C 2b4e06bf131c36a80072f2d2eccd1b93 [0,1,0,0,1,0|0,0,2]=4 889 B10R1.173 CO[C@@H]1CC[C@H]1NC(=O)C 069f4e563cd051c1cf85671b13400397 [0,1,0,0,1,0|0,0,2]=4 890 B10R1.173 CO[C@H]1CC[C@@H]1NC(=O)C 3077d1a2a6baf5f56b22f38c0c0f7be2 [0,1,0,0,1,0|0,0,2]=4 891 B10R1.173 CO[C@H]1CC[C@H]1NC(=O)C e1be9e7d1b31a3193da27f5a69aa2f49 [0,1,0,0,1,0|0,0,2]=4 892 B10R1.463 C#CC(=O)N[C@H]1CNC1=O f674994fad93494eb3cd133cbd6ca029 [0,1,0,0,1,0|1,0,1]=4 893 B10R1.463 C#CC(C)NC1CCC1=O 61550470daa4cec8689d1d97a774f3cc [0,1,0,0,1,0|1,0,1]=4 894 B10R1.463 C#C[C@@H](C)NC1CCC1=O 550d6890eea7a544df713e49339b327a [0,1,0,0,1,0|1,0,1]=4 895 B10R1.463 C#C[C@H](C)NC1CCC1=O 4445d3bd39757f60f0fd71b094f6624e [0,1,0,0,1,0|1,0,1]=4 896 B10R1.463 C=C(C=O)OC1CCC1=O 9df36ea24b1d5a0131e744bb3d16f510 [0,1,0,0,1,0|1,0,1]=4 897 B10R1.463 C=CC(=O)N[C@H]1CNC1=O 667dd5d8e03f460620a6a42bf4d5dfd8 [0,1,0,0,1,0|1,0,1]=4 898 B10R1.463 C=CC(C)NC1CCC1=O b18e648eb82d7662d282d011d0121c46 [0,1,0,0,1,0|1,0,1]=4 899 B10R1.463 CC(C#N)NC1CCC1=O c0df59426918f957c03f0616937d0daa [0,1,0,0,1,0|1,0,1]=4 900 B10R1.463 CC(C=O)N[C@H]1CNC1=O f111c353174b4b959580842c67fa14f9 [0,1,0,0,1,0|1,0,1]=4 901 B10R1.463 CC(C=O)OC1CCC1=O 8e5a8a5def609dc9ef6521bae893f70d [0,1,0,0,1,0|1,0,1]=4 902 B10R1.463 CC(CO)NC1CCC1=O cf88208cd0b23febb43c703e49a1c338 [0,1,0,0,1,0|0,0,2]=4 903 B10R1.463 CCC(=O)NC1CCC1F 3b229a578fb8fb4bb1b43885d228fb1b [0,1,0,0,1,0|1,0,1]=4 904 B10R1.463 CCC(=O)NC1CCC1O e6f27b7afd8b926f07ccd7e59cbd22fd [0,1,0,0,1,0|0,0,2]=4 905 B10R1.463 CCC(=O)N[C@@H]1CC[C@@H]1O 98d191b323ef432cb6f7721665101c11 [0,1,0,0,1,0|0,0,2]=4 906 B10R1.463 CCC(=O)N[C@@H]1CC[C@H]1C 320096b3a4bdbb175ab66dc7c2045b20 [0,1,0,0,1,0|1,0,1]=4 907 B10R1.463 CCC(=O)N[C@@H]1CC[C@H]1O 7c76eebb74f70df9f44ca5e4819635f9 [0,1,0,0,1,0|0,0,2]=4 908 B10R1.463 CCC(=O)N[C@H]1CC[C@@H]1O 657fb3878b0a665fa5c024cecd198fff [0,1,0,0,1,0|0,0,2]=4 909 B10R1.463 CCC(=O)N[C@H]1CC[C@H]1C 3495bd1a586bac1c14ef9843b25e4a8c [0,1,0,0,1,0|1,0,1]=4 910 B10R1.463 CCC(=O)N[C@H]1CC[C@H]1O d7a8043bb2d375ac0d72c6c978741460 [0,1,0,0,1,0|0,0,2]=4 911 B10R1.463 CCC(=O)N[C@H]1CNC1=O 52d018e02fdfb737b73c9f6d60a901a6 [0,1,0,0,1,0|1,0,0]=3 912 B10R1.463 C[C@@H](CO)NC1CCC1=O ca31cafae6e6a2f581f9a32e852cb952 [0,1,0,0,1,0|0,0,2]=4 913 B10R1.463 C[C@@H]1CC[C@@H]1NC(=O)CF b3b6a80ac851e9d42adc3658284201e9 [0,1,0,0,1,0|1,0,1]=4 914 B10R1.463 C[C@@H]1CC[C@@H]1NC(=O)CO 64f296434c3c4e35d0828c8adc4c2d1e [0,1,0,0,1,0|1,0,1]=4 915 B10R1.463 C[C@@H]1CC[C@@H]1NC(=O)CS 41eec0a798586bc6bb89fc3378049d4b [0,1,0,0,1,0|1,0,1]=4 916 B10R1.463 C[C@@H]1CC[C@H]1NC(=O)CF e2519cb75ec4a1912b2d9255f8546e4e [0,1,0,0,1,0|1,0,1]=4 917 B10R1.463 C[C@@H]1CC[C@H]1NC(=O)CO 97ea91fedaa54574ecac6196d12b893b [0,1,0,0,1,0|1,0,1]=4 918 B10R1.463 C[C@@H]1CC[C@H]1NC(=O)CS be89c8dcdefe0ea4111c047c2ae0f8a9 [0,1,0,0,1,0|1,0,1]=4 919 B10R1.463 C[C@H](C=O)N[C@H]1CNC1=O 20bd0d4c3219379e71e627f9dc69aff5 [0,1,0,0,1,0|1,0,1]=4 920 B10R1.463 C[C@H](C=O)OC1CCC1=O 87d097aeb7d9e1ae2888bd9f99a126b1 [0,1,0,0,1,0|1,0,1]=4 921 B10R1.463 C[C@H](CO)NC1CCC1=O ccc95e28cac8587af23b2fa6f6932ed4 [0,1,0,0,1,0|0,0,2]=4 922 B10R1.463 O=C(CF)NC1CCC1F bc7a3dcb7da619eedbb9da69383220b8 [0,1,0,0,1,0|1,0,1]=4 923 B10R1.463 O=C(CF)NC1CCC1O 0d0100d37f5930d2dd2628dd33664364 [0,1,0,0,1,0|0,0,2]=4 924 B10R1.463 O=C(CF)N[C@@H]1CC[C@@H]1O a73570c81f9e9f076cc196e168975b67 [0,1,0,0,1,0|0,0,2]=4 925 B10R1.463 O=C(CF)N[C@@H]1CC[C@H]1O e68e05327f930a79b892fdcd474f607d [0,1,0,0,1,0|0,0,2]=4 926 B10R1.463 O=C(CF)N[C@H]1CC[C@@H]1O ac5fd4a8f2a00373b35ec553dfd2880a [0,1,0,0,1,0|0,0,2]=4 927 B10R1.463 O=C(CF)N[C@H]1CC[C@H]1O 71d9a0ef9848260ad42fa0d575e771d4 [0,1,0,0,1,0|0,0,2]=4 928 B10R1.463 O=C(CF)N[C@H]1CNC1=O a27084cc958c711606feaa92a236466c [0,1,0,0,1,0|1,0,0]=3 929 B10R1.463 O=C(CO)NC1CCC1F aef75be22a2ffb299c57e20c5a42ad09 [0,1,0,0,1,0|1,0,1]=4 930 B10R1.463 O=C(CO)NC1CCC1O 6d19e39066bed44a74d39858acdc3dcd [0,1,0,0,1,0|0,0,2]=4 931 B10R1.463 O=C(CO)N[C@@H]1CC[C@@H]1O 94f4f9e00f6b4d15d794c9b406d997dc [0,1,0,0,1,0|0,0,2]=4 932 B10R1.463 O=C(CO)N[C@@H]1CC[C@H]1O 66c5e6a04ec0a293c5e4a6e7b16c416a [0,1,0,0,1,0|0,0,2]=4 933 B10R1.463 O=C(CO)N[C@H]1CC[C@@H]1O 2d534f17c2ba48485319b13069b825a9 [0,1,0,0,1,0|0,0,2]=4 934 B10R1.463 O=C(CO)N[C@H]1CC[C@H]1O 7585f3d09ae595bea693250b1a38f9d8 [0,1,0,0,1,0|0,0,2]=4 935 B10R1.463 O=C(CO)N[C@H]1CNC1=O d635156e127a67abf495f2ef762d2df0 [0,1,0,0,1,0|1,0,0]=3 936 B10R1.463 O=C(CS)NC1CCC1F f3a1a11a61f2f012da8623341750c452 [0,1,0,0,1,0|1,0,1]=4 937 B10R1.463 O=C(CS)NC1CCC1O 70a8386b2dba55a4f17507273bf87047 [0,1,0,0,1,0|0,0,2]=4 938 B10R1.463 O=C(CS)N[C@@H]1CC[C@@H]1O 8401a390ca125b64d68dfd0928a468ce [0,1,0,0,1,0|0,0,2]=4 939 B10R1.463 O=C(CS)N[C@@H]1CC[C@H]1O 1424768c2f626395464fab50bbd245f7 [0,1,0,0,1,0|0,0,2]=4 940 B10R1.463 O=C(CS)N[C@H]1CC[C@@H]1O 4d73a2091a61193ee500e4bee9078bb7 [0,1,0,0,1,0|0,0,2]=4 941 B10R1.463 O=C(CS)N[C@H]1CC[C@H]1O d79eb8df18cb52e108f70a14b719e56d [0,1,0,0,1,0|0,0,2]=4 942 B10R1.463 O=C(CS)N[C@H]1CNC1=O 5097db3f785ff9ab283c2687599dfe15 [0,1,0,0,1,0|1,0,0]=3 943 B10R1.463 O=CC(=O)N[C@H]1CNC1=O 750a9c8e0a1ffeff0d77f9ce94c88ff2 [0,1,0,0,1,0|1,0,1]=4 944 B12R1.224 CC(=O)NC1CCCN(C1=O)C ddf73b293f4325d3e64e7e8fa521ced1 [0,1,0,0,0,1|1,0,0]=3 945 B12R1.224 CC(=O)N[C@@H]1CCCN(C1=O)C 7deaf0815bafcc140caae7c5d03f89b7 [0,1,0,0,0,1|1,0,0]=3 946 B12R1.224 CC(=O)N[C@H]1CCCN(C1=O)C e30823926a3636b00b661935adafa892 [0,1,0,0,0,1|1,0,0]=3 947 B12R1.233 CC(=O)NC1CCC(=O)NC1=O a698bf19177846d10569217f39a7b242 [0,1,0,0,0,1|1,0,0]=3 948 B12R1.233 CC(=O)N[C@@H]1CCC(=O)NC1=O a991da9dd45c899d7a4887720257c525 [0,1,0,0,0,1|1,0,0]=3 949 B12R1.233 CC(=O)N[C@H]1CCC(=O)NC1=O 84b1dc46b48e70f279fb40003df47ad7 [0,1,0,0,0,1|1,0,0]=3 950 B12R1.371 C#CC(=O)NC1CCCNC1=O 9f09b7eae2e8b73279d9a3548ebece26 [0,1,0,0,0,1|1,0,1]=4 951 B12R1.371 C#CC(=O)N[C@@H]1CCCNC1=O b3231b09b795fb93bc1381c575c9278c [0,1,0,0,0,1|1,0,1]=4 952 B12R1.371 C#CC(=O)N[C@H]1CCCNC1=O 87ce1af8e01129ab2023bcf0492da3d0 [0,1,0,0,0,1|1,0,1]=4 953 B12R1.371 C=CC(=O)NC1CCCNC1=O d9f18f3e7e2eabf64d902449b154d757 [0,1,0,0,0,1|1,0,1]=4 954 B12R1.371 C=CC(=O)N[C@@H]1CCCNC1=O 4efac991bcf2d1bc96b4c7d74352fda0 [0,1,0,0,0,1|1,0,1]=4 955 B12R1.371 C=CC(=O)N[C@H]1CCCNC1=O 842cc9b6bae7cb170fe0def8476b52d6 [0,1,0,0,0,1|1,0,1]=4 956 B12R1.371 CC(C=O)NC1CCCNC1=O 4a77ee1223cffe369cde66edfb4954d7 [0,1,0,0,0,1|1,0,1]=4 957 B12R1.371 CC(C=O)N[C@@H]1CCCNC1=O 41143535d9dfb3a16c1dad8dd7705e2b [0,1,0,0,0,1|1,0,1]=4 958 B12R1.371 CC(C=O)N[C@H]1CCCNC1=O 42a3b8da2de8b0cea15a3195dc127ebc [0,1,0,0,0,1|1,0,1]=4 959 B12R1.371 CCC(=O)NC1CCCNC1=O 3a72769738d6771f538f5247018e2e4f [0,1,0,0,0,1|1,0,0]=3 960 B12R1.371 CCC(=O)N[C@@H]1CCCNC1=O 19c470e3325c048ba69677783bec1b38 [0,1,0,0,0,1|1,0,0]=3 961 B12R1.371 CCC(=O)N[C@H]1CCCNC1=O d84b3537251d910dae85ec63d788d063 [0,1,0,0,0,1|1,0,0]=3 962 B12R1.371 C[C@H](C=O)NC1CCCNC1=O 453c6b263804ca234f9c0393c3392cec [0,1,0,0,0,1|1,0,1]=4 963 B12R1.371 C[C@H](C=O)N[C@@H]1CCCNC1=O 0deeaa1b6a859d5f1f2cddb91fdf6f9f [0,1,0,0,0,1|1,0,1]=4 964 B12R1.371 C[C@H](C=O)N[C@H]1CCCNC1=O 4533b00aeee32280b8cc8d370b256a8d [0,1,0,0,0,1|1,0,1]=4 965 B12R1.371 O=C(CF)NC1CCCNC1=O 0f4c9020aea336194181966e7e2ff27a [0,1,0,0,0,1|1,0,0]=3 966 B12R1.371 O=C(CF)N[C@@H]1CCCNC1=O 16db97394b95032645792f7992b5e011 [0,1,0,0,0,1|1,0,0]=3 967 B12R1.371 O=C(CF)N[C@H]1CCCNC1=O 7bb7d217424ab060577720a663811c82 [0,1,0,0,0,1|1,0,0]=3 968 B12R1.371 O=C(CO)NC1CCCNC1=O 52cc4960271167997eda00b4f19b269f [0,1,0,0,0,1|1,0,0]=3 969 B12R1.371 O=C(CO)N[C@@H]1CCCNC1=O d56b7d0a2ab90c66e66d1ecd12dc51a8 [0,1,0,0,0,1|1,0,0]=3 970 B12R1.371 O=C(CO)N[C@H]1CCCNC1=O 07d00c643596b8fd3bc8096be17651b1 [0,1,0,0,0,1|1,0,0]=3 971 B12R1.371 O=C(CS)NC1CCCNC1=O ec1fb125b3175e108aea474c8cee90ef [0,1,0,0,0,1|1,0,0]=3 972 B12R1.371 O=C(CS)N[C@@H]1CCCNC1=O e7c6bb84ee41aab48c9369eb958c8260 [0,1,0,0,0,1|1,0,0]=3 973 B12R1.371 O=C(CS)N[C@H]1CCCNC1=O e2a8b085384f697808410e39562b8355 [0,1,0,0,0,1|1,0,0]=3 974 B12R1.371 O=CC(=O)NC1CCCNC1=O 0d677d26f202fcdc5dfa3064402f2ac4 [0,1,0,0,0,1|1,0,1]=4 975 B12R1.371 O=CC(=O)N[C@@H]1CCCNC1=O 6a36ba989a440ef3793ce6b1a209e9f3 [0,1,0,0,0,1|1,0,1]=4 976 B12R1.371 O=CC(=O)N[C@H]1CCCNC1=O ea6d22273dba2b68910a9c6d0c198f43 [0,1,0,0,0,1|1,0,1]=4 977 B12R1.129 CC(C)(C)CNC1CCSC1=O 0eeb66225ae17c960910c0c794654f93 [0,1,0,0,0,1|1,0,1]=4 978 B12R1.129 CC(C)(F)CNC1CCSC1=O c3650e7c44e027e71d1d9d5f41e38569 [0,1,0,0,0,1|1,0,1]=4 979 B12R1.129 CC(C)(O)CNC1CCSC1=O 30381612c136289bf97114264b6f3631 [0,1,0,0,0,1|0,0,2]=4 980 B12R1.129 CC(F)(F)CNC1CCSC1=O 5841589fa7347ccdac0e063fcd51b3e9 [0,1,0,0,0,1|1,0,1]=4 981 B12R1.129 CS(=O)(=O)CNC1CCNC1=O 5066505ce5477adf29b69c1d8bf214ed [0,1,0,0,0,1|2,0,0]=4 982 B12R1.129 CS(=O)(=O)CNC1CCSC1=O a95c461c7c46d9cf12396b556e14798e [0,1,0,0,0,1|1,0,0]=3 983 B12R1.129 CS(=O)(=O)CN[C@@H]1CCNC1=O e6bc7ab01daef0e2986a84175255a62f [0,1,0,0,0,1|2,0,0]=4 984 B12R1.129 CS(=O)(=O)CN[C@@H]1CCOC1=O 8f30626b210c6deeb8941bd557ff8c88 [0,1,0,0,0,1|1,1,0]=4 985 B12R1.129 CS(=O)(=O)CN[C@H]1CCNC1=O 95bad9be3a45f3c2c6131f3d185ce4ec [0,1,0,0,0,1|2,0,0]=4 986 B12R1.129 CS(=O)(=O)CN[C@H]1CCOC1=O 87355ef0787dd749d053984f4eba23be [0,1,0,0,0,1|1,1,0]=4 987 B12R1.129 O=C1SCCC1NCS(=O)(=O)O b6c7f0579f3229b268a3bb1658e690cf [0,1,0,0,0,1|2,0,0]=4 988 B12R1.131 C=C(C)CNC1(CCNC1=O)C 383e717d29d80c44d68d97bdcfd36978 [0,1,0,0,0,1|2,0,0]=4 989 B12R1.131 CC1(CCNC1=O)NCC(=O)N a244746e6d76c6c3972bccc127ee5e91 [0,1,0,0,0,1|2,0,0]=4 990 B12R1.131 CC1(CCNC1=O)NCC(=O)O a4e01afd8add0313a1aba6c7d650aba9 [0,1,0,0,0,1|2,0,0]=4 991 B12R1.145 C=C(Br)C(=O)NC1CCSC1=O 45b73a2f22ef1b455ea2074b338bdb67 [0,1,0,0,0,1|1,0,1]=4 992 B12R1.145 C=C(C)C(=O)NC1CCNC1=O 852f37cecbb8ed3a2efe32037731c85d [0,1,0,0,0,1|2,0,0]=4 993 B12R1.145 C=C(C)C(=O)NC1CCSC1=O ecbde38ae8289c5fded2183a9fcfda74 [0,1,0,0,0,1|1,0,0]=3 994 B12R1.145 C=C(C)C(=O)N[C@@H]1CCNC1=O 31b754025a9acadf314891b48c1ac7de [0,1,0,0,0,1|2,0,0]=4 995 B12R1.145 C=C(C)C(=O)N[C@@H]1CCOC1=O 7372119b60adc19a3c826e129e0a2c8a [0,1,0,0,0,1|1,1,0]=4 996 B12R1.145 C=C(C)C(=O)N[C@H]1CCNC1=O c0a07ead8787844cf3e6864cbd61aba4 [0,1,0,0,0,1|2,0,0]=4 997 B12R1.145 C=C(C)C(=O)N[C@H]1CCOC1=O 6927efad0809cd4fa7d9a0671e9d7f93 [0,1,0,0,0,1|1,1,0]=4 998 B12R1.145 C=C(Cl)C(=O)NC1CCSC1=O 15e14a2bcee1321e463cbc416bc520e1 [0,1,0,0,0,1|1,0,1]=4 999 B12R1.145 C=C(F)C(=O)NC1CCSC1=O 04cbadb42f58942c9767ab865c6e8ecc [0,1,0,0,0,1|1,0,1]=4 1000 B12R1.145 CC(=O)C(=O)NC1CCNC1=O dd63706cf70fe7e724a18f37d882ca35 [0,1,0,0,0,1|1,0,0]=3 1001 B12R1.145 CC(=O)C(=O)NC1CCSC1=O fbe2058b03e7e531666cbe218bcb1342 [0,1,0,0,0,1|0,0,0]=2 1002 B12R1.145 CC(=O)C(=O)NC1CONC1=O 15608db20dda9ba5e045959256f6050e [0,1,0,0,0,1|2,0,0]=4 1003 B12R1.145 CC(=O)C(=O)N[C@@H]1CCNC1=O 06bf5a8d3c8c3d8387b35c4b3fccc555 [0,1,0,0,0,1|1,0,0]=3 1004 B12R1.145 CC(=O)C(=O)N[C@@H]1CCOC1=O ac10e2d75cf4c47c104021d1c6edf15b [0,1,0,0,0,1|0,1,0]=3 1005 B12R1.145 CC(=O)C(=O)N[C@@H]1CONC1=O 02e2e208946501e61ae7917e96547222 [0,1,0,0,0,1|2,0,0]=4 1006 B12R1.145 CC(=O)C(=O)N[C@H]1CCNC1=O 72179c0b333f3f5e2610ba3d04caedbd [0,1,0,0,0,1|1,0,0]=3 1007 B12R1.145 CC(=O)C(=O)N[C@H]1CCOC1=O 4a2c632b53878d59332956c462fce31d [0,1,0,0,0,1|0,1,0]=3 1008 B12R1.145 CC(=O)C(=O)N[C@H]1CONC1=O a74e93fda0365df5a9a7dd4954ef4140 [0,1,0,0,0,1|2,0,0]=4 1009 B12R1.145 CC(=O)C(C)NC1CCNC1=O 3f4e72f839f8383b852c6125d50cfd9d [0,1,0,0,0,1|1,0,0]=3 1010 B12R1.145 CC(=O)C(C)NC1CCSC1=O 988a172d44b092597aab92de1cc34253 [0,1,0,0,0,1|0,0,0]=2 1011 B12R1.145 CC(=O)C(C)N[C@@H]1CCNC1=O 01d8f32d5d38c8cd213a2d24376a23ad [0,1,0,0,0,1|1,0,0]=3 1012 B12R1.145 CC(=O)C(C)N[C@@H]1CCOC1=O 188b3e9d09fa677300173715bb2df7e9 [0,1,0,0,0,1|0,1,0]=3 1013 B12R1.145 CC(=O)C(C)N[C@H]1CCNC1=O b5fbc8e584d2a3475b3c26aaf9053677 [0,1,0,0,0,1|1,0,0]=3 1014 B12R1.145 CC(=O)C(C)N[C@H]1CCOC1=O 99c4edb7c6bc21d4d6d3c0ef88a83092 [0,1,0,0,0,1|0,1,0]=3 1015 B12R1.145 CC(=O)C(C)OC1CCNC1=O 439c5e8de4fd886e466fdc9bf8caf340 [0,1,0,0,0,1|2,0,0]=4 1016 B12R1.145 CC(=O)C(C)OC1CCOC1=O 6211b458c7ab0a25a8da81163cc7e14c [0,1,0,0,0,1|1,1,0]=4 1017 B12R1.145 CC(=O)C(C)O[C@@H]1CCNC1=O 92afef09fa5cdcf1838fa3b48b2521e5 [0,1,0,0,0,1|2,0,0]=4 1018 B12R1.145 CC(=O)C(C)O[C@@H]1CCOC1=O ea44e0b4c33f13ee60222b4b79f15f54 [0,1,0,0,0,1|1,1,0]=4 1019 B12R1.145 CC(=O)C(C)O[C@H]1CCNC1=O cb0075f56cfb0a27d105e03054a69c32 [0,1,0,0,0,1|2,0,0]=4 1020 B12R1.145 CC(=O)C(C)O[C@H]1CCOC1=O a693d30d6fafddd8e87c17e5f0575ea7 [0,1,0,0,0,1|1,1,0]=4 1021 B12R1.145 CC(C)C(C)NC1CCSC1=O b1cb253f38b4732d5b176484a54545ae [0,1,0,0,0,1|1,0,1]=4 1022 B12R1.145 CC(NC1CCCC1=O)C(=O)N c1df809166e26046ca07a0cf1df0365a [0,1,0,0,0,1|2,0,0]=4 1023 B12R1.145 CC(NC1CCCC1=O)C(=O)O e265f769454f9fe260b95386887c894b [0,1,0,0,0,1|2,0,0]=4 1024 B12R1.145 CC(NC1CCNC1=O)C(=O)N 397c73e3ff81a473694d59cb4376c733 [0,1,0,0,0,1|2,0,0]=4 1025 B12R1.145 CC(NC1CCNC1=O)C(=O)O 5c4907d5cbc704ddbabded4a26f855b0 [0,1,0,0,0,1|2,0,0]=4 1026 B12R1.145 CC(NC1CCSC1=O)C(=O)N 131dd30491e57a9c20d64b8d552d5c3f [0,1,0,0,0,1|1,0,0]=3 1027 B12R1.145 CC(NC1CCSC1=O)C(=O)O 1cd5bd7172173ce22946ceb04fb0c7d8 [0,1,0,0,0,1|1,0,0]=3 1028 B12R1.145 CC(N[C@@H]1CCNC1=O)C(=O)N 16ff263279a48f326f6583958bce369b [0,1,0,0,0,1|2,0,0]=4 1029 B12R1.145 CC(N[C@@H]1CCNC1=O)C(=O)O c20339b6894bb8973d67726bbfb7e946 [0,1,0,0,0,1|2,0,0]=4 1030 B12R1.145 CC(N[C@@H]1CCOC1=O)C(=O)N 137bf8af6de23dc804aa75e5244448cd [0,1,0,0,0,1|1,1,0]=4 1031 B12R1.145 CC(N[C@H]1CCNC1=O)C(=O)N f477bc06df169e3556e5402dbb6e8b63 [0,1,0,0,0,1|2,0,0]=4 1032 B12R1.145 CC(N[C@H]1CCNC1=O)C(=O)O 190fd3c35d1ebd53ecfc84df2328a5bd [0,1,0,0,0,1|2,0,0]=4 1033 B12R1.145 CC(N[C@H]1CCOC1=O)C(=O)N d26de40ec5d5acd1d8247b0259eb2072 [0,1,0,0,0,1|1,1,0]=4 1034 B12R1.145 CC(O)C(=O)NC1CCSC1=O bf77ad767571edad75ef53d6bacee125 [0,1,0,0,0,1|0,0,2]=4 1035 B12R1.145 CC(S)C(=O)NC1CCSC1=O cabb7aa6c3bde423676874c3d6f3dd95 [0,1,0,0,0,1|0,1,1]=4 1036 B12R1.145 C[C@@H](NC1CCCC1=O)C(=O)N 67c752d7a221df1cc471d00c219996d6 [0,1,0,0,0,1|2,0,0]=4 1037 B12R1.145 C[C@@H](NC1CCCC1=O)C(=O)O e99f937c3a4c3fe85d9db07102e275b2 [0,1,0,0,0,1|2,0,0]=4 1038 B12R1.145 C[C@@H](NC1CCNC1=O)C(=O)N 810b0f2730635e608a5f391bbb2f4224 [0,1,0,0,0,1|2,0,0]=4 1039 B12R1.145 C[C@@H](NC1CCNC1=O)C(=O)O fa887a5ade3e8c2af163aea46bc0a47b [0,1,0,0,0,1|2,0,0]=4 1040 B12R1.145 C[C@@H](NC1CCSC1=O)C(=O)N a7086d7d23100bf86bcc56749b41f2cf [0,1,0,0,0,1|1,0,0]=3 1041 B12R1.145 C[C@@H](NC1CCSC1=O)C(=O)O 2b92d6568b491faaa54abfe09bd24c44 [0,1,0,0,0,1|1,0,0]=3 1042 B12R1.145 C[C@@H](N[C@@H]1CCNC1=O)C(=O)N dad808b025166bbfd55f5c8ab92f7ecf [0,1,0,0,0,1|2,0,0]=4 1043 B12R1.145 C[C@@H](N[C@@H]1CCNC1=O)C(=O)O 04247e8619646cff2e06efb51cf8519f [0,1,0,0,0,1|2,0,0]=4 1044 B12R1.145 C[C@@H](N[C@H]1CCNC1=O)C(=O)N d833d59fa4e42279f1f388bbe65350af [0,1,0,0,0,1|2,0,0]=4 1045 B12R1.145 C[C@@H](N[C@H]1CCNC1=O)C(=O)O aff103231fbce0159568f3f402512511 [0,1,0,0,0,1|2,0,0]=4 1046 B12R1.145 C[C@@H](O)C(=O)NC1CCSC1=O 047c9c8d307037a13acaa2051b55d8f8 [0,1,0,0,0,1|0,0,2]=4 1047 B12R1.145 C[C@H](NC1CCCC1=O)C(=O)N f4cc760f750c42ee5b49414d64e9791e [0,1,0,0,0,1|2,0,0]=4 1048 B12R1.145 C[C@H](NC1CCCC1=O)C(=O)O 1a7f567fbec218c579cb89351bca6ac9 [0,1,0,0,0,1|2,0,0]=4 1049 B12R1.145 C[C@H](NC1CCNC1=O)C(=O)N fcfbceee651e2213850e11115b857117 [0,1,0,0,0,1|2,0,0]=4 1050 B12R1.145 C[C@H](NC1CCNC1=O)C(=O)O f8ec4956d988b6659554108bac98e096 [0,1,0,0,0,1|2,0,0]=4 1051 B12R1.145 C[C@H](NC1CCSC1=O)C(=O)N b37a38454f187d94dffcd83b6d67b9dd [0,1,0,0,0,1|1,0,0]=3 1052 B12R1.145 C[C@H](NC1CCSC1=O)C(=O)O 5b42ae14af7a882ee00a39d98aaac2ed [0,1,0,0,0,1|1,0,0]=3 1053 B12R1.145 C[C@H](N[C@@H]1CCNC1=O)C(=O)N 1d190c183e8b6103580ef0bf88b3d822 [0,1,0,0,0,1|2,0,0]=4 1054 B12R1.145 C[C@H](N[C@@H]1CCNC1=O)C(=O)O ec76a6cca0ad3604669fdc693c79f93e [0,1,0,0,0,1|2,0,0]=4 1055 B12R1.145 C[C@H](N[C@H]1CCNC1=O)C(=O)N 55a3bf82c7905ec2fb8b93b70645785f [0,1,0,0,0,1|2,0,0]=4 1056 B12R1.145 C[C@H](N[C@H]1CCNC1=O)C(=O)O be7747990fd7640149fb5cdf9ef4b86e [0,1,0,0,0,1|2,0,0]=4 1057 B12R1.145 C[C@H](O)C(=O)NC1CCSC1=O 1324e047c4aa4fdf968d16ac2456b09a [0,1,0,0,0,1|0,0,2]=4 1058 B12R1.145 NC(=O)C(=O)NC1CCNC1=O 64ca1226c29242517307771c546b4ab0 [0,1,0,0,0,1|2,0,0]=4 1059 B12R1.145 NC(=O)C(=O)NC1CCSC1=O 60d10b5b8280bab7b645c5cd66a04453 [0,1,0,0,0,1|1,0,0]=3 1060 B12R1.145 NC(=O)C(=O)N[C@@H]1CCNC1=O d4f316c699261a233cd42d396cb91869 [0,1,0,0,0,1|2,0,0]=4 1061 B12R1.145 NC(=O)C(=O)N[C@H]1CCNC1=O 48df3105a387b6147e06f8df5ad02dfe [0,1,0,0,0,1|2,0,0]=4 1062 B12R1.145 NC(=O)C(F)NC1CCNC1=O c4ebebca668df1411381ad614cbe1627 [0,1,0,0,0,1|2,0,0]=4 1063 B12R1.145 NC(=O)C(F)NC1CCSC1=O cdb87e9fdf0178d5c47a536148f488ab [0,1,0,0,0,1|1,0,0]=3 1064 B12R1.145 NC(=O)C(F)N[C@@H]1CCNC1=O 73e130a0402f660fa8409dd021e63fa1 [0,1,0,0,0,1|2,0,0]=4 1065 B12R1.145 NC(=O)C(F)N[C@@H]1CCOC1=O 7f62afef6eba757c6b58119674b0bdbe [0,1,0,0,0,1|1,1,0]=4 1066 B12R1.145 NC(=O)C(F)N[C@H]1CCNC1=O 2465fe88eb01834fe73591dc0eadfa03 [0,1,0,0,0,1|2,0,0]=4 1067 B12R1.145 NC(=O)C(F)N[C@H]1CCOC1=O 47b814d4f0d6eeba0f62d47b22b52318 [0,1,0,0,0,1|1,1,0]=4 1068 B12R1.145 O=C(O)C(F)NC1CCNC1=O 7bdd80df4cec0e612ed1dc8f50a13904 [0,1,0,0,0,1|2,0,0]=4 1069 B12R1.145 O=C(O)C(F)N[C@@H]1CCNC1=O 8474a86003ebf7c3cb27d41e7e07ed03 [0,1,0,0,0,1|2,0,0]=4 1070 B12R1.145 O=C(O)C(F)N[C@@H]1CCOC1=O 8dbcb53b9100064f72583c8bc1c01976 [0,1,0,0,0,1|1,1,0]=4 1071 B12R1.145 O=C(O)C(F)N[C@H]1CCNC1=O 4abb05753f64e5385fef5819212a6228 [0,1,0,0,0,1|2,0,0]=4 1072 B12R1.145 O=C(O)C(F)N[C@H]1CCOC1=O 6e78200d6c4447e1259c7ab04220d84e [0,1,0,0,0,1|1,1,0]=4 1073 B12R1.145 O=C(O)C(O)NC1CCNC1=O bc1d4c3438b325a613a358b8b255299a [0,1,0,0,0,1|2,0,0]=4 1074 B12R1.145 O=C(O)[C@H](F)N[C@@H]1CCOC1=O dbfb012e2ab7f411ce606cdff372e93f [0,1,0,0,0,1|1,1,0]=4 1075 B12R1.145 O=C(O)[C@H](F)N[C@H]1CCOC1=O 6a8d3b96e1ca726622f5f31e10895ceb [0,1,0,0,0,1|1,1,0]=4 1076 B12R1.353 C#CC(=O)NCC1CCNC1=O 6d4d948c38e77277d71848cc11b94ca5 [0,1,0,0,0,1|1,0,1]=4 1077 B12R1.353 C=C(C#N)CNC1CCSC1=O 1eb516185315488cfa427e956078aa33 [0,1,0,0,0,1|1,0,1]=4 1078 B12R1.353 C=C(CC)CNC1CCNC1=O 666800c47b7833c0d0d78a194d9d376f [0,1,0,0,0,1|2,0,0]=4 1079 B12R1.353 C=C(CC)CNC1CCSC1=O 6967fb5907e9c60fdaf2369dd3a3c948 [0,1,0,0,0,1|1,0,0]=3 1080 B12R1.353 C=C(CC)CN[C@@H]1CCNC1=O 963c9c6625c3dca55cd8d4a58bf4ecaf [0,1,0,0,0,1|2,0,0]=4 1081 B12R1.353 C=C(CC)CN[C@@H]1CCOC1=O 5b85cd0aaa8b2e9ad7f5f71ea8d31785 [0,1,0,0,0,1|1,1,0]=4 1082 B12R1.353 C=C(CC)CN[C@H]1CCNC1=O ac558ad6a9bf2322bff195d375ab44bf [0,1,0,0,0,1|2,0,0]=4 1083 B12R1.353 C=C(CC)CN[C@H]1CCOC1=O 4ce5d306b7758a650e5d861dbdf345e9 [0,1,0,0,0,1|1,1,0]=4 1084 B12R1.353 C=C(CNC1CCNC1=O)OC 073b8bc210fcad1bbb52628c3d03e3f2 [0,1,0,0,0,1|2,0,0]=4 1085 B12R1.353 C=C(CNC1CCSC1=O)OC 9f35571ab29a86f0c311c7365cfda03c [0,1,0,0,0,1|1,0,0]=3 1086 B12R1.353 C=C(CN[C@@H]1CCNC1=O)OC 0febf1575420ace1dfafb8a432df6e9e [0,1,0,0,0,1|2,0,0]=4 1087 B12R1.353 C=C(CN[C@@H]1CCOC1=O)OC b4307db9eed0d9ba7dfb12bcbb9d0092 [0,1,0,0,0,1|1,1,0]=4 1088 B12R1.353 C=C(CN[C@H]1CCNC1=O)OC d9a6fa53465603d628b19b47e26eedf2 [0,1,0,0,0,1|2,0,0]=4 1089 B12R1.353 C=C(CN[C@H]1CCOC1=O)OC 105163991461199ea2810a5a7a27985c [0,1,0,0,0,1|1,1,0]=4 1090 B12R1.353 C=C(CO)CNC1CCNC1=O 7e71eb31f6a4abd4a092967b74e88307 [0,1,0,0,0,1|2,0,0]=4 1091 B12R1.353 C=C(CO)CNC1CCSC1=O 54311bb003e91d7119239371bd2a6ffc [0,1,0,0,0,1|1,0,0]=3 1092 B12R1.353 C=C(CO)CN[C@@H]1CCNC1=O ca566e8ad500af627bd27a07c80ed970 [0,1,0,0,0,1|2,0,0]=4 1093 B12R1.353 C=C(CO)CN[C@@H]1CCOC1=O 447e054ffd4d75e31d2b30995af5ad5b [0,1,0,0,0,1|1,1,0]=4 1094 B12R1.353 C=C(CO)CN[C@H]1CCNC1=O 1f87d39ed3ebcc1ee815f3b140894a56 [0,1,0,0,0,1|2,0,0]=4 1095 B12R1.353 C=C(CO)CN[C@H]1CCOC1=O 4c96f43d20eb87d668b305383bbcfb8b [0,1,0,0,0,1|1,1,0]=4 1096 B12R1.353 C=CC(=O)NCC1CCNC1=O 92cb409f5232f1dfb643f2d2fe4aef6b [0,1,0,0,0,1|1,0,1]=4 1097 B12R1.353 CC(C#N)CNC1CCSC1=O cb3f4778eba67f7324d91e48223ceea2 [0,1,0,0,0,1|1,0,1]=4 1098 B12R1.353 CC(C=O)NCC1CCNC1=O 0ebc377364a41e0cce03edce6e528d37 [0,1,0,0,0,1|1,0,1]=4 1099 B12R1.353 CC(CO)CNC1CCSC1=O 35f6956b218cb3eba5f9d419acece625 [0,1,0,0,0,1|0,0,2]=4 1100 B12R1.353 CCC(=O)CNC1CCNC1=O 80ad8dd1ddc508d6340ffd2dba814fb6 [0,1,0,0,0,1|1,0,0]=3 1101 B12R1.353 CCC(=O)CNC1CCSC1=O 5fe03f7688c8fd86888042ec8ac51acf [0,1,0,0,0,1|0,0,0]=2 1102 B12R1.353 CCC(=O)CNC1CONC1=O 4cbcfd1f5fef77987932088a86bfcfae [0,1,0,0,0,1|2,0,0]=4 1103 B12R1.353 CCC(=O)CN[C@@H]1CCNC1=O c3e2c36375ea84319521fd6dc7399eff [0,1,0,0,0,1|1,0,0]=3 1104 B12R1.353 CCC(=O)CN[C@@H]1CCOC1=O b8ba6712a822a71ef4cc3adf3d6226f8 [0,1,0,0,0,1|0,1,0]=3 1105 B12R1.353 CCC(=O)CN[C@@H]1CONC1=O 59e58d137012c83c5d4a99b72e497912 [0,1,0,0,0,1|2,0,0]=4 1106 B12R1.353 CCC(=O)CN[C@H]1CCNC1=O c562313a6df49373b25c99270372be0e [0,1,0,0,0,1|1,0,0]=3 1107 B12R1.353 CCC(=O)CN[C@H]1CCOC1=O 61f83f61469cb97f122ef7108c059348 [0,1,0,0,0,1|0,1,0]=3 1108 B12R1.353 CCC(=O)CN[C@H]1CONC1=O 6eb7f8bf0e26ceed2e016bc87a3b4c46 [0,1,0,0,0,1|2,0,0]=4 1109 B12R1.353 CCC(=O)COC1CCCC1=O 779788e35e5153299dea538d141dfd11 [0,1,0,0,0,1|2,0,0]=4 1110 B12R1.353 CCC(=O)COC1CCNC1=O 5274547fb4504e78d0666019f5e7e638 [0,1,0,0,0,1|2,0,0]=4 1111 B12R1.353 CCC(=O)COC1CCOC1=O 49b394d7a3a13ed209b0765b738ba9aa [0,1,0,0,0,1|1,1,0]=4 1112 B12R1.353 CCC(=O)CO[C@@H]1CCNC1=O 7d7e709d0b7e1547b3136dfe50324bb3 [0,1,0,0,0,1|2,0,0]=4 1113 B12R1.353 CCC(=O)CO[C@@H]1CCOC1=O ee81409c9cce869c6d87be42eded0627 [0,1,0,0,0,1|1,1,0]=4 1114 B12R1.353 CCC(=O)CO[C@H]1CCNC1=O 176b317f114aa572b716c805e3992882 [0,1,0,0,0,1|2,0,0]=4 1115 B12R1.353 CCC(=O)CO[C@H]1CCOC1=O fba6dd98ca29c52bd102bfa859c9baa6 [0,1,0,0,0,1|1,1,0]=4 1116 B12R1.353 CCC(=O)NCC1CCNC1=O 7abbb25e34b88280849bb344371a1db2 [0,1,0,0,0,1|1,0,0]=3 1117 B12R1.353 CCC(C)CNC1CCSC1=O 7a590916b58003b1f8ae1ad7c01ccb3a [0,1,0,0,0,1|1,0,1]=4 1118 B12R1.353 CCC(O)CNC1CCSC1=O 1aa36d357d5370d26e17d75133e216cc [0,1,0,0,0,1|0,0,2]=4 1119 B12R1.353 CC[C@@H](C)CNC1CCSC1=O 72a5c66b48135142e47fc8a3082bbffe [0,1,0,0,0,1|1,0,1]=4 1120 B12R1.353 CC[C@H](C)CNC1CCSC1=O 55e69ee850cad05792a4d507de2de3ed [0,1,0,0,0,1|1,0,1]=4 1121 B12R1.353 CNC(=O)CNC1CCCC1=O d69ef94556f7c52713ca850c57aebf35 [0,1,0,0,0,1|1,0,0]=3 1122 B12R1.353 CNC(=O)CNC1CCNC1=O fd2ba64abafeee875a4047b84daf7af5 [0,1,0,0,0,1|1,0,0]=3 1123 B12R1.353 CNC(=O)CNC1CCSC1=O e3a07a17311c90bbeb926ed805836bb3 [0,1,0,0,0,1|0,0,0]=2 1124 B12R1.353 CNC(=O)CNC1CONC1=O 50dbd6f93476d2832afd2f25d773669f [0,1,0,0,0,1|2,0,0]=4 1125 B12R1.353 CNC(=O)CN[C@@H]1CCNC1=O 36c7130a3bab75d4ea428761146cac00 [0,1,0,0,0,1|1,0,0]=3 1126 B12R1.353 CNC(=O)CN[C@@H]1CCOC1=O e39f98200eda3f438f1ee3c071ffe6f1 [0,1,0,0,0,1|0,1,0]=3 1127 B12R1.353 CNC(=O)CN[C@@H]1CONC1=O a67db2e0dad8c4548b3ee70a6906b584 [0,1,0,0,0,1|2,0,0]=4 1128 B12R1.353 CNC(=O)CN[C@H]1CCNC1=O e090b7db85879b22536ba39e8dc6fdff [0,1,0,0,0,1|1,0,0]=3 1129 B12R1.353 CNC(=O)CN[C@H]1CCOC1=O 1f5227ada71a362819740a07e800e413 [0,1,0,0,0,1|0,1,0]=3 1130 B12R1.353 CNC(=O)CN[C@H]1CONC1=O ac11d7a21f413d7aeda5e3700e629c55 [0,1,0,0,0,1|2,0,0]=4 1131 B12R1.353 CNC(=O)COC1CCCC1=O 199d1174f45dac8d23168f260fab13ae [0,1,0,0,0,1|2,0,0]=4 1132 B12R1.353 CNC(=O)COC1CCNC1=O b53ed2cd0dfa6b4b2265c8ce756954cd [0,1,0,0,0,1|2,0,0]=4 1133 B12R1.353 CNC(=O)COC1CCOC1=O dab593115eff20bb376b8f0b169e6537 [0,1,0,0,0,1|1,1,0]=4 1134 B12R1.353 CNC(=O)CO[C@@H]1CCNC1=O 710dc2b5abdc751a175dd57084047a50 [0,1,0,0,0,1|2,0,0]=4 1135 B12R1.353 CNC(=O)CO[C@@H]1CCOC1=O 41c7ab73d70bb71d5971448a09f93f30 [0,1,0,0,0,1|1,1,0]=4 1136 B12R1.353 CNC(=O)CO[C@H]1CCNC1=O f00caf54f69033f58c26b37f6e7add6d [0,1,0,0,0,1|2,0,0]=4 1137 B12R1.353 CNC(=O)CO[C@H]1CCOC1=O 3bc42757ecf5ebb82c5685f66bdbc07d [0,1,0,0,0,1|1,1,0]=4 1138 B12R1.353 COC(=O)CNC1CCNC1=O 8dc65eb41a891f47305d34c885a760b4 [0,1,0,0,0,1|1,0,0]=3 1139 B12R1.353 COC(=O)CNC1CCSC1=O 1c6cb7c03f4bf62e33033fdfa85151bb [0,1,0,0,0,1|0,0,0]=2 1140 B12R1.353 COC(=O)CNC1CONC1=O ae5a47cbd518030176bc0042bc9907a8 [0,1,0,0,0,1|2,0,0]=4 1141 B12R1.353 COC(=O)CN[C@@H]1CCNC1=O 8db764f73aa18714ca6df4644726c0ee [0,1,0,0,0,1|1,0,0]=3 1142 B12R1.353 COC(=O)CN[C@@H]1CCOC1=O 3e549482be4aafc1135e5881ef670635 [0,1,0,0,0,1|0,1,0]=3 1143 B12R1.353 COC(=O)CN[C@@H]1CONC1=O a63eeb3267f60927a47f7cc8f750fffd [0,1,0,0,0,1|2,0,0]=4 1144 B12R1.353 COC(=O)CN[C@H]1CCNC1=O e480c8df1bd7a732257f2e69c26ab4b8 [0,1,0,0,0,1|1,0,0]=3 1145 B12R1.353 COC(=O)CN[C@H]1CCOC1=O aca6c04a5efbddfcfb8821cb66529341 [0,1,0,0,0,1|0,1,0]=3 1146 B12R1.353 COC(=O)CN[C@H]1CONC1=O 35285132e6ae517f33b5e077c8ab02c2 [0,1,0,0,0,1|2,0,0]=4 1147 B12R1.353 COC(=O)COC1CCCC1=O 0afbb45bb6d5d583bfd173ff486ef02e [0,1,0,0,0,1|2,0,0]=4 1148 B12R1.353 COC(=O)COC1CCNC1=O 230f73dfe6eaf16c513ba2d241ee0057 [0,1,0,0,0,1|2,0,0]=4 1149 B12R1.353 COC(=O)COC1CCOC1=O d11073e6fbfe416748c950fcb9604a46 [0,1,0,0,0,1|1,1,0]=4 1150 B12R1.353 COC(=O)CO[C@@H]1CCNC1=O b27ff34372ab6333f82dff39b353e2df [0,1,0,0,0,1|2,0,0]=4 1151 B12R1.353 COC(=O)CO[C@@H]1CCOC1=O 218071863024a88b117c05f9ad070451 [0,1,0,0,0,1|1,1,0]=4 1152 B12R1.353 COC(=O)CO[C@H]1CCNC1=O f318a0ddc9855e31ccfe7127a3866356 [0,1,0,0,0,1|2,0,0]=4 1153 B12R1.353 COC(=O)CO[C@H]1CCOC1=O 546d055ce6113f93883b0b6074cfe3b8 [0,1,0,0,0,1|1,1,0]=4 1154 B12R1.353 COC(C)CNC1CCSC1=O 401a1d8c0fcb57de81c3ca32056ecceb [0,1,0,0,0,1|0,0,2]=4 1155 B12R1.353 CO[C@@H](C)CNC1CCSC1=O 7813a7a0c1df6f391a1600f934c689fd [0,1,0,0,0,1|0,0,2]=4 1156 B12R1.353 CO[C@H](C)CNC1CCSC1=O a7931959f624350849a97538b0252cfb [0,1,0,0,0,1|0,0,2]=4 1157 B12R1.353 C[C@@H](CO)CNC1CCSC1=O a1e3d1d0a6d3844cf34cfe0dd1969565 [0,1,0,0,0,1|0,0,2]=4 1158 B12R1.353 C[C@H](C=O)NCC1CCNC1=O 787206d67c1227253c7abdcc27d8c175 [0,1,0,0,0,1|1,0,1]=4 1159 B12R1.353 C[C@H](CO)CNC1CCSC1=O 62bf6326e83e549f8cd83b0879600f81 [0,1,0,0,0,1|0,0,2]=4 1160 B12R1.353 O=C(CF)NCC1CCNC1=O c8d5277f558ff7c02b9ce54143030ae2 [0,1,0,0,0,1|1,0,0]=3 1161 B12R1.353 O=C(CNC1CCNC1=O)NO 93338790b5c5ee1be20dba280e211fef [0,1,0,0,0,1|2,0,0]=4 1162 B12R1.353 O=C(CO)CNC1CCNC1=O 51f39efdf1c9a3eb995219fc9ae7b374 [0,1,0,0,0,1|1,0,0]=3 1163 B12R1.353 O=C(CO)CNC1CCSC1=O 1c104efe3aa3f29224ac5b5b09d518ce [0,1,0,0,0,1|0,0,0]=2 1164 B12R1.353 O=C(CO)CNC1CONC1=O a61bcd682554214c4d71e10af9fe8b70 [0,1,0,0,0,1|2,0,0]=4 1165 B12R1.353 O=C(CO)CN[C@@H]1CCNC1=O ac9d4e7abc4bbea3c14b1d8d1fc3097f [0,1,0,0,0,1|1,0,0]=3 1166 B12R1.353 O=C(CO)CN[C@@H]1CCOC1=O d2805179d1af5f51a4db0a1a05810d6d [0,1,0,0,0,1|0,1,0]=3 1167 B12R1.353 O=C(CO)CN[C@@H]1CONC1=O 268e5a966f0bf4b19f6abad46659cf0b [0,1,0,0,0,1|2,0,0]=4 1168 B12R1.353 O=C(CO)CN[C@H]1CCNC1=O 30b04831631ffc3dae41b1dae951be89 [0,1,0,0,0,1|1,0,0]=3 1169 B12R1.353 O=C(CO)CN[C@H]1CCOC1=O c53bdf143b1026e63a488e54de54b7b7 [0,1,0,0,0,1|0,1,0]=3 1170 B12R1.353 O=C(CO)CN[C@H]1CONC1=O eeced3baddbe2f15bd8c4db2715eab00 [0,1,0,0,0,1|2,0,0]=4 1171 B12R1.353 O=C(CO)NCC1CCNC1=O c44a2db7dd770771785347448b518992 [0,1,0,0,0,1|1,0,0]=3 1172 B12R1.353 O=C(CS)NCC1CCNC1=O 2b27d70588db35512d64e6c24a672c85 [0,1,0,0,0,1|1,0,0]=3 1173 B12R1.353 O=C1SCCC1NC/C(=C/Cl)/Cl 010f22fd8c9e66ffb654731573ac6d45 [0,1,0,0,0,1|1,0,1]=4 1174 B12R1.353 O=C1SCCC1NCC(O)CF 3db51034d8b7cf517b568afd74c05f52 [0,1,0,0,0,1|0,0,2]=4 1175 B12R1.353 O=C1SCCC1NCC(O)CO 2af26f63cf0e7038a2e84319058e2c1e [0,1,0,0,0,1|0,0,2]=4 1176 B12R1.353 O=C1SCCC1NC[C@@H](O)CO 261abb370f7d9ccac557230e7639e444 [0,1,0,0,0,1|0,0,2]=4 1177 B12R1.353 O=C1SCCC1NC[C@H](O)CO ca38c04cab2686964e6dd485409887d3 [0,1,0,0,0,1|0,0,2]=4 1178 B12R1.353 O=CC(=O)NCC1CCNC1=O ebf34bcd7cbc12fe956bbc295eed6350 [0,1,0,0,0,1|1,0,1]=4 1179 B12R1.861 C=C(C)CNC1CC(OC1=O)C 0be098047f3752d450eb601d7767e1ef [0,1,0,0,0,1|1,1,0]=4 1180 B12R1.861 CC(=O)CNC1CC(OC1=O)C 04313e59eaf948c654b82d6a64470202 [0,1,0,0,0,1|0,1,0]=3 1181 B12R1.861 CC(=O)COC1CC(OC1=O)C 7deb35cb74e3bf98858ec1edf7ba972b [0,1,0,0,0,1|1,1,0]=4 1182 B12R1.861 CC1CC(C(=O)O1)NCC(=O)N fe1077ef3350f6ab96d4470ca2967f17 [0,1,0,0,0,1|1,1,0]=4 1183 B12R1.870 C=C(C)CNC1CCN(C1=O)C 2583aed6ad92e4966159dd4c006e962f [0,1,0,0,0,1|2,0,0]=4 1184 B12R1.870 C=C(C)CNC1CCN(C1=O)O 77773f9166fdec9271ed30415b5d96a6 [0,1,0,0,0,1|2,0,0]=4 1185 B12R1.870 C=C(C)CN[C@@H]1CCN(C1=O)C 155b4a846b36a1b10efc54f33f6fd049 [0,1,0,0,0,1|2,0,0]=4 1186 B12R1.870 C=C(C)CN[C@@H]1CCN(C1=O)O 99f38ac5e8162f52574d09dccb386655 [0,1,0,0,0,1|2,0,0]=4 1187 B12R1.870 C=C(C)CN[C@H]1CCN(C1=O)C 5d1d497a052d22e771f3eaaa2b60a41f [0,1,0,0,0,1|2,0,0]=4 1188 B12R1.870 CN1CCC(C1=O)NCC(=O)N f5901ebeee1b5bbc1c7165ba901acfde [0,1,0,0,0,1|2,0,0]=4 1189 B12R1.870 CN1CCC(C1=O)NCC(=O)O ae29f994cac0be6607db8459ecfd73a4 [0,1,0,0,0,1|2,0,0]=4 1190 B12R1.870 CN1CC[C@@H](C1=O)NCC(=O)N 8fdc7146db24bc791f5e9c67f59451fe [0,1,0,0,0,1|2,0,0]=4 1191 B12R1.870 CN1CC[C@@H](C1=O)NCC(=O)O e08109fbce330350b078cb576db40f16 [0,1,0,0,0,1|2,0,0]=4 1192 B12R1.870 CN1CC[C@H](C1=O)NCC(=O)N 1af4662a6274ac5cc744130c62e0d288 [0,1,0,0,0,1|2,0,0]=4 1193 B12R1.870 CN1CC[C@H](C1=O)NCC(=O)O ae2a3a59a4c86d22188510fd5a7088e2 [0,1,0,0,0,1|2,0,0]=4 1194 B12R1.870 NC(=O)CNC1CCN(C1=O)O e939578ca941616312bc7de55b8e40b7 [0,1,0,0,0,1|2,0,0]=4 1195 B12R1.870 NC(=O)CN[C@@H]1CCN(C1=O)O 9fb1d8866a39d52df16bcda8be6d8d60 [0,1,0,0,0,1|2,0,0]=4 1196 B12R1.870 O=C(O)CNC1CCN(C1=O)O 4e4d429a244b3cea2cb5bfbb64782f38 [0,1,0,0,0,1|2,0,0]=4 1197 B12R1.870 O=C(O)CN[C@@H]1CCN(C1=O)O a21d5aa05a85d85f6be44232421b33ec [0,1,0,0,0,1|2,0,0]=4 1198 B12R1.895 C=C(C)CN[C@@H]1C(=O)NC[C@H]1O 1eff79f8dd0303fcc53e678747f8d6dd [0,1,0,0,0,1|2,0,0]=4 1199 B12R1.895 CC(=O)CNC1C(=O)CCC1=O 970dad11c3999d27aa03826f71f29b05 [0,1,0,0,0,1|1,0,1]=4 1200 B12R1.895 CC(=O)CNC1C(=O)COC1=O 907631e6d26f9369d470f86bc2ce8040 [0,1,0,0,0,1|0,1,1]=4 1201 B12R1.895 NC(=O)CN[C@@H]1C(=O)NC[C@H]1O d266be9c91b2dee92e3c77e616ed4bc4 [0,1,0,0,0,1|2,0,0]=4 1202 B12R1.895 O=C(O)CN[C@@H]1C(=O)NC[C@H]1O 3a3d5b11778f2957244409dc45903ede [0,1,0,0,0,1|2,0,0]=4 1203 B12R1.19 CC(=O)NC1CCN(C(=O)C1)C f3bcf2b171000b5895cfe5a578cb6c34 [0,1,0,0,0,1|1,0,0]=3 1204 B12R1.19 CC(=O)N[C@@H]1CCN(C(=O)C1)C 38f6cbfaabc3632e657e574eb5265ccd [0,1,0,0,0,1|1,0,0]=3 1205 B12R1.19 CC(=O)N[C@H]1CCN(C(=O)C1)C 610e49c7679de6576e2ce0ff5506b2ec [0,1,0,0,0,1|1,0,0]=3 1206 B12R1.50 C#CC(=O)NC1CCNC(=O)C1 7325bbdaa4c4ba79f0a40f096eccaf8f [0,1,0,0,0,1|1,0,1]=4 1207 B12R1.50 C#CC(=O)N[C@@H]1CCNC(=O)C1 8ac0975514abe8dfcf7444ce6f368153 [0,1,0,0,0,1|1,0,1]=4 1208 B12R1.50 C#CC(=O)N[C@H]1CCNC(=O)C1 3d529333e85b1bd31c9bfed154d55abc [0,1,0,0,0,1|1,0,1]=4 1209 B12R1.50 C=CC(=O)NC1CCNC(=O)C1 ba523fa432708fafe22923067eee3026 [0,1,0,0,0,1|1,0,1]=4 1210 B12R1.50 C=CC(=O)N[C@@H]1CCNC(=O)C1 7dc44a85dc6835c961b76dc9a62e3afa [0,1,0,0,0,1|1,0,1]=4 1211 B12R1.50 C=CC(=O)N[C@H]1CCNC(=O)C1 3f32242a09b39e99386015482812f6a5 [0,1,0,0,0,1|1,0,1]=4 1212 B12R1.50 CC(C=O)NC1CCNC(=O)C1 4b170575c70217441b7afc4ad41284e7 [0,1,0,0,0,1|1,0,1]=4 1213 B12R1.50 CC(C=O)N[C@@H]1CCNC(=O)C1 ef8275ed21634ae55a2992543a247713 [0,1,0,0,0,1|1,0,1]=4 1214 B12R1.50 CC(C=O)N[C@H]1CCNC(=O)C1 f22992ea0516adf5904873e154423d5e [0,1,0,0,0,1|1,0,1]=4 1215 B12R1.50 CCC(=O)NC1CCNC(=O)C1 98047c309451cba81b2e83c1aecedd2a [0,1,0,0,0,1|1,0,0]=3 1216 B12R1.50 CCC(=O)N[C@@H]1CCNC(=O)C1 e8f8026439a60ab29aaf90511ca02ba0 [0,1,0,0,0,1|1,0,0]=3 1217 B12R1.50 CCC(=O)N[C@H]1CCNC(=O)C1 64289d3f457f6ba077eee5f2e09a80bf [0,1,0,0,0,1|1,0,0]=3 1218 B12R1.50 C[C@H](C=O)NC1CCNC(=O)C1 3b29a21393aedef8295d658dca6646be [0,1,0,0,0,1|1,0,1]=4 1219 B12R1.50 C[C@H](C=O)N[C@@H]1CCNC(=O)C1 b49d3fe703be445083549f1e94dd0af1 [0,1,0,0,0,1|1,0,1]=4 1220 B12R1.50 C[C@H](C=O)N[C@H]1CCNC(=O)C1 5481fdf111880d848c16a3d5148765bc [0,1,0,0,0,1|1,0,1]=4 1221 B12R1.50 O=C1CC(CCN1)NC(=O)CF c570191c7dfd35aa1589568a05d89d31 [0,1,0,0,0,1|1,0,0]=3 1222 B12R1.50 O=C1CC(CCN1)NC(=O)CO daf34bd10005af2c93a04b831807a327 [0,1,0,0,0,1|1,0,0]=3 1223 B12R1.50 O=C1CC(CCN1)NC(=O)CS 7558db8c77762fa0bd4c03e9b9996db2 [0,1,0,0,0,1|1,0,0]=3 1224 B12R1.50 O=C1C[C@@H](CCN1)NC(=O)CF b2ae434f28eaa983e54d756e35f54e78 [0,1,0,0,0,1|1,0,0]=3 1225 B12R1.50 O=C1C[C@@H](CCN1)NC(=O)CO f76ddc07149c0d7aa09e8125db755cb0 [0,1,0,0,0,1|1,0,0]=3 1226 B12R1.50 O=C1C[C@@H](CCN1)NC(=O)CS d1321997cc0db1dc09c1f002f0b10de7 [0,1,0,0,0,1|1,0,0]=3 1227 B12R1.50 O=C1C[C@H](CCN1)NC(=O)CF e0ddff3dbdccd35d1567cebb49fffcf5 [0,1,0,0,0,1|1,0,0]=3 1228 B12R1.50 O=C1C[C@H](CCN1)NC(=O)CO a17ead97b29f6473965c629102695b03 [0,1,0,0,0,1|1,0,0]=3 1229 B12R1.50 O=C1C[C@H](CCN1)NC(=O)CS 44491bbc6e6af824f4a8b507cf636fe3 [0,1,0,0,0,1|1,0,0]=3 1230 B12R1.50 O=CC(=O)NC1CCNC(=O)C1 c375ddd766ae6cfdb8acdaa48f41531c [0,1,0,0,0,1|1,0,1]=4 1231 B12R1.50 O=CC(=O)N[C@@H]1CCNC(=O)C1 562b238a823974abf5bb089b3696c483 [0,1,0,0,0,1|1,0,1]=4 1232 B12R1.50 O=CC(=O)N[C@H]1CCNC(=O)C1 916a9a4299cdacd0469594f92fc07f20 [0,1,0,0,0,1|1,0,1]=4 1233 B12R1.438 CC(=O)NC1CCCN(C1)C=O 7c22f8c89bdd6212f076230061968a8c [0,1,0,0,0,1|2,0,0]=4 1234 B12R1.1821 CC(=O)NC1CCCS(=O)(=O)C1 825389553a2533abc6f991d11c08ad50 [0,1,0,0,0,1|2,0,0]=4 1235 B12R1.1821 CC(=O)N[C@@H]1CCCS(=O)(=O)C1 f4803bef500c1760d30d337da926a37f [0,1,0,0,0,1|2,0,0]=4 1236 B12R1.1821 CC(=O)N[C@H]1CCCS(=O)(=O)C1 b8d45bdae6683cfac1fe358a8b2e93cb [0,1,0,0,0,1|2,0,0]=4 1237 B12R1.3532 C#CC(=O)NC1(CCNC1=O)C 9712295890dcbbd4c1b6b64efc76a73a [0,2,0,0,0,0|1,0,1]=4 1238 B12R1.3532 C=CC(=O)NC1(CCNC1=O)C 303c05ffc1cf9976b572ff482f713411 [0,2,0,0,0,0|1,0,1]=4 1239 B12R1.3532 CC(C=O)NC1(CCNC1=O)C 8e419fe2168ef6c0d9bc51b470656a7f [0,2,0,0,0,0|1,0,1]=4 1240 B12R1.3532 CC1(CCNC1=O)NC(=O)C=O 43515b2beba0d7ee0396c60f6d2bf734 [0,2,0,0,0,0|1,0,1]=4 1241 B12R1.3532 CC1(CCNC1=O)NC(=O)CF 4cbb46c3dc7a9e325808ddc4b274358c [0,2,0,0,0,0|1,0,0]=3 1242 B12R1.3532 CC1(CCNC1=O)NC(=O)CO a82afe2a8eb9fc6931dc89e53b3dd460 [0,2,0,0,0,0|1,0,0]=3 1243 B12R1.3532 CC1(CCNC1=O)NC(=O)CS 5ab3a72cafa112e602899dbe7be389a1 [0,2,0,0,0,0|1,0,0]=3 1244 B12R1.3532 CCC(=O)NC1(CCNC1=O)C d61182f3e3f89e82e07e4e771de46b06 [0,2,0,0,0,0|1,0,0]=3 1245 B12R1.3532 C[C@H](C=O)NC1(CCNC1=O)C 54ccb753fb0503fcb116b5698098f8ea [0,2,0,0,0,0|1,0,1]=4 1246 B12R1.251 CCC(C=O)NC1CCNC1=O f8e176dad99ba15b7c5951df08cda722 [0,2,0,0,0,0|1,0,1]=4 1247 B12R1.251 CCC(C=O)NC1CCSC1=O 6214a125722d0cff0aab14ebbbbfd36c [0,2,0,0,0,0|0,0,1]=3 1248 B12R1.251 CCC(C=O)N[C@@H]1CCNC1=O 9ef3074be3355eba1a4b2bfc86ca25ae [0,2,0,0,0,0|1,0,1]=4 1249 B12R1.251 CCC(C=O)N[C@@H]1CCOC1=O 234846786bf524d95549ddcc67913e23 [0,2,0,0,0,0|0,1,1]=4 1250 B12R1.251 CCC(C=O)N[C@H]1CCNC1=O e687f7601a821887da8d98acb42fad7c [0,2,0,0,0,0|1,0,1]=4 1251 B12R1.251 CCC(C=O)N[C@H]1CCOC1=O 3b540e10d6d8294627f47629d7a90025 [0,2,0,0,0,0|0,1,1]=4 1252 B12R1.251 CCC(CC)NC1CCSC1=O a9658b08e200718396d21df344e4d1da [0,2,0,0,0,0|1,0,1]=4 1253 B12R1.251 CCC(CO)NC1CCSC1=O 1835e7c393ae0485c80973569f7996f3 [0,2,0,0,0,0|0,0,2]=4 1254 B12R1.251 N#CC(C=O)NC1CCSC1=O da7a0133829c31029e1d217ee27ae093 [0,2,0,0,0,0|0,0,2]=4 1255 B12R1.251 O=C1SCCC1NC(CO)CO 19966d22f710104fd006f6df191cb864 [0,2,0,0,0,0|0,0,2]=4 1256 B12R1.251 O=CC(C=O)NC1CCSC1=O 61c20fcea5f620d8c023f3fa307183f4 [0,2,0,0,0,0|0,0,2]=4 1257 B12R1.318 C#CCC(=O)NC1CCNC1=O 32fc1a0312b9de019168e96d25049cc3 [0,2,0,0,0,0|1,0,0]=3 1258 B12R1.318 C#CCC(=O)NC1CCSC1=O b0f925f1cddd3d0356aa19939f538e37 [0,2,0,0,0,0|0,0,0]=2 1259 B12R1.318 C#CCC(=O)NC1CONC1=O b9f11a17408a3efed86e2b82e82c081c [0,2,0,0,0,0|2,0,0]=4 1260 B12R1.318 C#CCC(=O)N[C@@H]1CCNC1=O e8093cb8e8ee6cda4e19d93a5593843c [0,2,0,0,0,0|1,0,0]=3 1261 B12R1.318 C#CCC(=O)N[C@@H]1CCOC1=O dc6b2a6df0fd01ac917d17207c62c548 [0,2,0,0,0,0|0,1,0]=3 1262 B12R1.318 C#CCC(=O)N[C@@H]1CONC1=O 6b979473412bd95a0bc2afc9ae232eae [0,2,0,0,0,0|2,0,0]=4 1263 B12R1.318 C#CCC(=O)N[C@H]1CCNC1=O b34ef17eaf85795ef29de8b19cebcab7 [0,2,0,0,0,0|1,0,0]=3 1264 B12R1.318 C#CCC(=O)N[C@H]1CCOC1=O 86bd327d08aabca342ec34e9167ee943 [0,2,0,0,0,0|0,1,0]=3 1265 B12R1.318 C#CCC(=O)N[C@H]1CONC1=O 10502c2f6c1806cf9a1b0a44f8fd0dfa [0,2,0,0,0,0|2,0,0]=4 1266 B12R1.318 C/C=C/C(=O)NC1CCNC1=O 467337658af5239b902246fa385ab643 [0,2,0,0,0,0|1,0,0]=3 1267 B12R1.318 C/C=C/C(=O)NC1CCSC1=O e5672571ca7266bd63401fb4117f8041 [0,2,0,0,0,0|0,0,0]=2 1268 B12R1.318 C/C=C/C(=O)NC1CONC1=O ccefbbd090ae889460244d9619b2afd1 [0,2,0,0,0,0|2,0,0]=4 1269 B12R1.318 C/C=C/C(=O)N[C@@H]1CCNC1=O f2dedcc712e3d445783ba0ebdf7b49a8 [0,2,0,0,0,0|1,0,0]=3 1270 B12R1.318 C/C=C/C(=O)N[C@@H]1CCOC1=O 48bf49a7121a37275200141e17d579ee [0,2,0,0,0,0|0,1,0]=3 1271 B12R1.318 C/C=C/C(=O)N[C@@H]1CONC1=O 853e879504b00c854f925a24225cd098 [0,2,0,0,0,0|2,0,0]=4 1272 B12R1.318 C/C=C/C(=O)N[C@H]1CCNC1=O 3e4c0cbd41a56daf3a5c5ca8668affd2 [0,2,0,0,0,0|1,0,0]=3 1273 B12R1.318 C/C=C/C(=O)N[C@H]1CCOC1=O dc89fa28ed6cb8a5b318ad0cf8390768 [0,2,0,0,0,0|0,1,0]=3 1274 B12R1.318 C/C=C/C(=O)N[C@H]1CONC1=O dd52785871ffc9a694ff0ed53abe0481 [0,2,0,0,0,0|2,0,0]=4 1275 B12R1.318 C=CCC(=O)NC1CCNC1=O 6f3099557f4dea07bc1ccb4afee621a9 [0,2,0,0,0,0|1,0,0]=3 1276 B12R1.318 C=CCC(=O)NC1CCSC1=O db5b3bd03b1d28339ab66fdd1bbad902 [0,2,0,0,0,0|0,0,0]=2 1277 B12R1.318 C=CCC(=O)NC1CONC1=O 485f05be1a033708fdb124aeef102d51 [0,2,0,0,0,0|2,0,0]=4 1278 B12R1.318 C=CCC(=O)N[C@@H]1CCNC1=O c7c1a85ff9f60dd4d1481fa44cd0fd8b [0,2,0,0,0,0|1,0,0]=3 1279 B12R1.318 C=CCC(=O)N[C@@H]1CCOC1=O aba1c42c8d6b078c8fae58753c07a5d1 [0,2,0,0,0,0|0,1,0]=3 1280 B12R1.318 C=CCC(=O)N[C@@H]1CONC1=O d494c252847d1088988954d99300ffbb [0,2,0,0,0,0|2,0,0]=4 1281 B12R1.318 C=CCC(=O)N[C@H]1CCNC1=O 9b8bc46f87af3e34a92012cd8f235fa4 [0,2,0,0,0,0|1,0,0]=3 1282 B12R1.318 C=CCC(=O)N[C@H]1CCOC1=O ba914a2246ddeaee5b7148f818476a9b [0,2,0,0,0,0|0,1,0]=3 1283 B12R1.318 C=CCC(=O)N[C@H]1CONC1=O 52f9efc3b8cf5949acb4d59969d5a993 [0,2,0,0,0,0|2,0,0]=4 1284 B12R1.318 CC#CC(=O)NC1CCNC1=O 08bf274ccb90098af481846dd84d1808 [0,2,0,0,0,0|1,0,0]=3 1285 B12R1.318 CC#CC(=O)NC1CONC1=O 0d847473b21f2a5ce394c32376de189a [0,2,0,0,0,0|2,0,0]=4 1286 B12R1.318 CC#CC(=O)N[C@@H]1CCNC1=O 09ad1c0699d07c15aac3ed8eabcd786d [0,2,0,0,0,0|1,0,0]=3 1287 B12R1.318 CC#CC(=O)N[C@@H]1CONC1=O f5a7e75e5257e2c2655ba84956f346d2 [0,2,0,0,0,0|2,0,0]=4 1288 B12R1.318 CC#CC(=O)N[C@H]1CCNC1=O 9fc23e1f794c20879bf24d2888b161f7 [0,2,0,0,0,0|1,0,0]=3 1289 B12R1.318 CC#CC(=O)N[C@H]1CONC1=O 6488e9279d1e375ceb4a9c10a730350a [0,2,0,0,0,0|2,0,0]=4 1290 B12R1.318 CC(CC#N)NC1CCSC1=O 677b2c14fe19772c9d628c6c19bc047e [0,2,0,0,0,0|1,0,1]=4 1291 B12R1.318 CC(CCO)NC1CCSC1=O d6c29629c2106344dd0cea2c67d29760 [0,2,0,0,0,0|0,0,2]=4 1292 B12R1.318 CCCC(=O)NC1CCNC1=O e6cea89f6ee4272a10288f991039f7d9 [0,2,0,0,0,0|1,0,0]=3 1293 B12R1.318 CCCC(=O)NC1CCSC1=O 59760a3991edad249155264f4b9065a0 [0,2,0,0,0,0|0,0,0]=2 1294 B12R1.318 CCCC(=O)NC1CONC1=O 6a6fc3e5815264cb6ac7f8509ac6f247 [0,2,0,0,0,0|2,0,0]=4 1295 B12R1.318 CCCC(=O)N[C@@H]1CCNC1=O b6511e013aa7eea75d67c5c28a77a1cd [0,2,0,0,0,0|1,0,0]=3 1296 B12R1.318 CCCC(=O)N[C@@H]1CCOC1=O d00f2e25c23ab0d5b42b8b7ea58b0f67 [0,2,0,0,0,0|0,1,0]=3 1297 B12R1.318 CCCC(=O)N[C@@H]1CONC1=O 92215a8a3cb456ace3e7896c2ce44270 [0,2,0,0,0,0|2,0,0]=4 1298 B12R1.318 CCCC(=O)N[C@H]1CCNC1=O 70011fe774eae8f8f6b30c2567f18521 [0,2,0,0,0,0|1,0,0]=3 1299 B12R1.318 CCCC(=O)N[C@H]1CCOC1=O fd71054f51d598cb0c124128a82bf2c5 [0,2,0,0,0,0|0,1,0]=3 1300 B12R1.318 CCCC(=O)N[C@H]1CONC1=O 031dea1bfbb3846d6ab58255be684bed [0,2,0,0,0,0|2,0,0]=4 1301 B12R1.318 CCCC(C)NC1CCSC1=O eba2fd74c48b18f7a72e9fbd00423669 [0,2,0,0,0,0|1,0,1]=4 1302 B12R1.318 COCC(=O)NC1CCNC1=O ccac8840452cc23ed08747ab84208500 [0,2,0,0,0,0|1,0,0]=3 1303 B12R1.318 COCC(=O)NC1CCSC1=O 560327a5ea4c06ee15e161a29966c02d [0,2,0,0,0,0|0,0,0]=2 1304 B12R1.318 COCC(=O)NC1CONC1=O 93d77f807f6dc7ce3cbb77141b8168ec [0,2,0,0,0,0|2,0,0]=4 1305 B12R1.318 COCC(=O)N[C@@H]1CCNC1=O cf4b8237e8dab78e563d79d5756fcfc0 [0,2,0,0,0,0|1,0,0]=3 1306 B12R1.318 COCC(=O)N[C@@H]1CCOC1=O ff53df36aa2086fd6a2384784059610e [0,2,0,0,0,0|0,1,0]=3 1307 B12R1.318 COCC(=O)N[C@@H]1CONC1=O 10177c5fccbca8bd4c14b1fe7a729d8c [0,2,0,0,0,0|2,0,0]=4 1308 B12R1.318 COCC(=O)N[C@H]1CCNC1=O 1420f487eb97d8724d7f6c5de66543df [0,2,0,0,0,0|1,0,0]=3 1309 B12R1.318 COCC(=O)N[C@H]1CCOC1=O e01666a9647a027384cd6b8156df2862 [0,2,0,0,0,0|0,1,0]=3 1310 B12R1.318 COCC(=O)N[C@H]1CONC1=O bff35acb8d4916c6c39b07f50f9a17a5 [0,2,0,0,0,0|2,0,0]=4 1311 B12R1.318 COCC(C)NC1CCSC1=O de7405e98149c2315484580ba85b99fc [0,2,0,0,0,0|0,0,2]=4 1312 B12R1.318 CSCC(=O)NC1CCNC1=O 666b1ee5f3197a2d8e0dd07d7b17e1b6 [0,2,0,0,0,0|1,0,0]=3 1313 B12R1.318 CSCC(=O)N[C@@H]1CCNC1=O 11a27921c4f48ab161d1b9791085d304 [0,2,0,0,0,0|1,0,0]=3 1314 B12R1.318 CSCC(=O)N[C@@H]1CCOC1=O 6b2d0a47d2a57d78f9d116a90e8a0128 [0,2,0,0,0,0|0,1,0]=3 1315 B12R1.318 CSCC(=O)N[C@H]1CCNC1=O dd4e40dfb76464eab7ad04b9adbed5cf [0,2,0,0,0,0|1,0,0]=3 1316 B12R1.318 CSCC(=O)N[C@H]1CCOC1=O 798b94a7f2fd81b527917fdfe73560ac [0,2,0,0,0,0|0,1,0]=3 1317 B12R1.318 N#CCC(=O)NC1CCNC1=O fe0867b3b0bd0969edec1585c97b8ead [0,2,0,0,0,0|1,0,0]=3 1318 B12R1.318 N#CCC(=O)N[C@@H]1CCNC1=O 7f2bc5d56b48e89ff70d29364b3a8dc7 [0,2,0,0,0,0|1,0,0]=3 1319 B12R1.318 N#CCC(=O)N[C@H]1CCNC1=O 081afda0484c09606a75eebee9601acf [0,2,0,0,0,0|1,0,0]=3 1320 B12R1.318 N#CNC(=O)NC1CCNC1=O 984cd45a0de225950ff124f33c9b7372 [0,2,0,0,0,0|1,0,1]=4 1321 B12R1.318 N#CNC(=O)N[C@@H]1CCNC1=O 515cf2edd1a6be0b0f8837b4b47c87e1 [0,2,0,0,0,0|1,0,1]=4 1322 B12R1.318 N#CNC(=O)N[C@H]1CCNC1=O af20f9ddb9af3105f3667f6319bfa01c [0,2,0,0,0,0|1,0,1]=4 1323 B12R1.318 NOCC(=O)NC1CCNC1=O a74ec210af7285072c8f9d66734dd950 [0,2,0,0,0,0|1,0,0]=3 1324 B12R1.318 NOCC(=O)NC1CCSC1=O ffd40a0508332f08f535ad2dd912585e [0,2,0,0,0,0|0,0,0]=2 1325 B12R1.318 NOCC(=O)NC1CONC1=O afd1f4e752ea7dff4ad0bcc5700e64e1 [0,2,0,0,0,0|2,0,0]=4 1326 B12R1.318 NOCC(=O)N[C@@H]1CCNC1=O 8f0e241b1cdea7a80a31dff65e5de891 [0,2,0,0,0,0|1,0,0]=3 1327 B12R1.318 NOCC(=O)N[C@@H]1CCOC1=O 64c7343ae705a17276a4881c4b301411 [0,2,0,0,0,0|0,1,0]=3 1328 B12R1.318 NOCC(=O)N[C@@H]1CONC1=O 69589dcf0d1f8093f8f36b469fe0faf0 [0,2,0,0,0,0|2,0,0]=4 1329 B12R1.318 NOCC(=O)N[C@H]1CCNC1=O 8634374a7f9ce2def1ead25618e8ec3c [0,2,0,0,0,0|1,0,0]=3 1330 B12R1.318 NOCC(=O)N[C@H]1CCOC1=O 87bf4b88190a9ebac785ff482b93e091 [0,2,0,0,0,0|0,1,0]=3 1331 B12R1.318 NOCC(=O)N[C@H]1CONC1=O 6c9d87fade950eb0d82aafdd62e39da0 [0,2,0,0,0,0|2,0,0]=4 1332 B12R1.318 O=C(/C=C/Br)NC1CCNC1=O 8311d348e69a6731bbfc48dca8a6ff28 [0,2,0,0,0,0|1,0,1]=4 1333 B12R1.318 O=C(/C=C/Br)NC1CCSC1=O 1bdb242e42bfae5b41dc6a7ba26a9743 [0,2,0,0,0,0|0,0,1]=3 1334 B12R1.318 O=C(/C=C/Br)N[C@@H]1CCNC1=O 78393ed586b68c7a8a1809195be22514 [0,2,0,0,0,0|1,0,1]=4 1335 B12R1.318 O=C(/C=C/Br)N[C@@H]1CCOC1=O 40170cdf938a4a0ca96fde668f9ed707 [0,2,0,0,0,0|0,1,1]=4 1336 B12R1.318 O=C(/C=C/Br)N[C@H]1CCNC1=O 993785786c5c380db6290cdd65b53632 [0,2,0,0,0,0|1,0,1]=4 1337 B12R1.318 O=C(/C=C/Br)N[C@H]1CCOC1=O 3d2894d6e01259cc6e35cebebb7b77f9 [0,2,0,0,0,0|0,1,1]=4 1338 B12R1.318 O=C(/C=C/Cl)NC1CCNC1=O 38c1dfb1da11d331e309380d0955305d [0,2,0,0,0,0|1,0,1]=4 1339 B12R1.318 O=C(/C=C/Cl)NC1CCSC1=O ad0ed759dd32843e0ce189dc3208680f [0,2,0,0,0,0|0,0,1]=3 1340 B12R1.318 O=C(/C=C/Cl)N[C@@H]1CCNC1=O 910f153ea7922d55592fb213a931120f [0,2,0,0,0,0|1,0,1]=4 1341 B12R1.318 O=C(/C=C/Cl)N[C@@H]1CCOC1=O 4219b2a4010ef3d7613cf734b035660b [0,2,0,0,0,0|0,1,1]=4 1342 B12R1.318 O=C(/C=C/Cl)N[C@H]1CCNC1=O 8276735061130938a96d400f145a8c1b [0,2,0,0,0,0|1,0,1]=4 1343 B12R1.318 O=C(/C=C/Cl)N[C@H]1CCOC1=O 5abe0e9a6eea081625c540a287f5844d [0,2,0,0,0,0|0,1,1]=4 1344 B12R1.318 O=C(/C=C/I)NC1CCNC1=O f9169d0d3abe1b5ba4f1bf88e44c60e2 [0,2,0,0,0,0|1,0,1]=4 1345 B12R1.318 O=C(/C=C/I)NC1CCSC1=O 696b33856d745494c90455a7c8c25a13 [0,2,0,0,0,0|0,0,1]=3 1346 B12R1.318 O=C(/C=C/I)N[C@@H]1CCNC1=O 445dac88f6287e44cf8010059a9f0db6 [0,2,0,0,0,0|1,0,1]=4 1347 B12R1.318 O=C(/C=C/I)N[C@@H]1CCOC1=O caefec03bcee5825c5f95ab73499e13c [0,2,0,0,0,0|0,1,1]=4 1348 B12R1.318 O=C(/C=C/I)N[C@H]1CCNC1=O 2c8c610aaf71f3d83e46be11d8d94565 [0,2,0,0,0,0|1,0,1]=4 1349 B12R1.318 O=C(/C=C/I)N[C@H]1CCOC1=O 146f67eb07c4d73d51282e64bb001c7d [0,2,0,0,0,0|0,1,1]=4 1350 B12R1.318 O=C(/C=C\Br)NC1CCNC1=O daefc417f3bcc0ff910c19f4f051f3e4 [0,2,0,0,0,0|1,0,1]=4 1351 B12R1.318 O=C(/C=C\Br)NC1CCSC1=O 70c35c754fe86004f6445ba7837606e3 [0,2,0,0,0,0|0,0,1]=3 1352 B12R1.318 O=C(/C=C\Br)N[C@@H]1CCNC1=O ba6159eac1a50e302a46a27654238b4e [0,2,0,0,0,0|1,0,1]=4 1353 B12R1.318 O=C(/C=C\Br)N[C@@H]1CCOC1=O a8add1ee42cef4879f7e2f9fb6e465a1 [0,2,0,0,0,0|0,1,1]=4 1354 B12R1.318 O=C(/C=C\Br)N[C@H]1CCNC1=O 8b8997c8bf8ce7c20ae14fff630578dc [0,2,0,0,0,0|1,0,1]=4 1355 B12R1.318 O=C(/C=C\Br)N[C@H]1CCOC1=O fe61b325a88e66fb277013a87cd54b85 [0,2,0,0,0,0|0,1,1]=4 1356 B12R1.318 O=C(/C=C\Cl)NC1CCNC1=O 51339e52a756b5511e3badb899bc7de3 [0,2,0,0,0,0|1,0,1]=4 1357 B12R1.318 O=C(/C=C\Cl)NC1CCSC1=O 2f7d5c808e74ca965f415202e52096bd [0,2,0,0,0,0|0,0,1]=3 1358 B12R1.318 O=C(/C=C\Cl)N[C@@H]1CCNC1=O 40d876602947a957d3786ebc0224f492 [0,2,0,0,0,0|1,0,1]=4 1359 B12R1.318 O=C(/C=C\Cl)N[C@@H]1CCOC1=O 5901ab8e646344c5f932d137fced803d [0,2,0,0,0,0|0,1,1]=4 1360 B12R1.318 O=C(/C=C\Cl)N[C@H]1CCNC1=O e741f39a6cdafbace3cb10d34c2d3313 [0,2,0,0,0,0|1,0,1]=4 1361 B12R1.318 O=C(/C=C\Cl)N[C@H]1CCOC1=O 48a497bc5c47f34a74c0f11369c61fb2 [0,2,0,0,0,0|0,1,1]=4 1362 B12R1.318 O=C(/C=C\I)NC1CCNC1=O a36acba14df144bad04a51d26ea7d963 [0,2,0,0,0,0|1,0,1]=4 1363 B12R1.318 O=C(/C=C\I)NC1CCSC1=O 8f9fb182644d9fd578fb7243c20689bd [0,2,0,0,0,0|0,0,1]=3 1364 B12R1.318 O=C(/C=C\I)N[C@@H]1CCNC1=O db6a026a17f7e2ae29cb3ef1079fb04a [0,2,0,0,0,0|1,0,1]=4 1365 B12R1.318 O=C(/C=C\I)N[C@@H]1CCOC1=O cb71d5a62a36ce143ff688142752eab9 [0,2,0,0,0,0|0,1,1]=4 1366 B12R1.318 O=C(/C=C\I)N[C@H]1CCNC1=O 6f794a31d6b81f4a3181ee0ba4744273 [0,2,0,0,0,0|1,0,1]=4 1367 B12R1.318 O=C(/C=C\I)N[C@H]1CCOC1=O a2003d55fd1401e7e22755ee899854c2 [0,2,0,0,0,0|0,1,1]=4 1368 B12R1.318 O=C(C#CBr)NC1CCNC1=O 7835d4aaa9df635ebcf3c1fcde4db7c0 [0,2,0,0,0,0|1,0,1]=4 1369 B12R1.318 O=C(C#CBr)NC1CCSC1=O a12cb5d1707d8e31778e41d195bd2336 [0,2,0,0,0,0|0,0,1]=3 1370 B12R1.318 O=C(C#CBr)N[C@@H]1CCNC1=O 527252b7bf9579c45f5abbb9df99ad6c [0,2,0,0,0,0|1,0,1]=4 1371 B12R1.318 O=C(C#CBr)N[C@H]1CCNC1=O e9f560be66e21ae2a64923598ee4335b [0,2,0,0,0,0|1,0,1]=4 1372 B12R1.318 O=C(C=CBr)NC1CCNC1=O 69504c9fddb59546f1a8f7483c9d3ecf [0,2,0,0,0,0|1,0,1]=4 1373 B12R1.318 O=C(C=CBr)NC1CCSC1=O d457c74a64ef71311658ed3e72627ddc [0,2,0,0,0,0|0,0,1]=3 1374 B12R1.318 O=C(C=CBr)N[C@@H]1CCNC1=O 8f6dbc729cbd43eb027d99f3d1a393ab [0,2,0,0,0,0|1,0,1]=4 1375 B12R1.318 O=C(C=CBr)N[C@@H]1CCOC1=O 99d08987fd0f1108ea98a01e0cca9d06 [0,2,0,0,0,0|0,1,1]=4 1376 B12R1.318 O=C(C=CBr)N[C@H]1CCNC1=O 2232bc91a8fb9ef5aa008ff22f01c8d0 [0,2,0,0,0,0|1,0,1]=4 1377 B12R1.318 O=C(C=CBr)N[C@H]1CCOC1=O a92447e6fcb2ed193720d4326955c8b4 [0,2,0,0,0,0|0,1,1]=4 1378 B12R1.318 O=C(C=CI)NC1CCNC1=O 7e457293a23522c1c4bf4a152d52c606 [0,2,0,0,0,0|1,0,1]=4 1379 B12R1.318 O=C(C=CI)NC1CCSC1=O aa73ef9957d9c612eb7f912414d3045c [0,2,0,0,0,0|0,0,1]=3 1380 B12R1.318 O=C(C=CI)N[C@@H]1CCNC1=O 49566674a3dfa1654d381fc4e37a43f6 [0,2,0,0,0,0|1,0,1]=4 1381 B12R1.318 O=C(C=CI)N[C@@H]1CCOC1=O 8be9d5572ee1ff4d0f6dfc20e7c501bc [0,2,0,0,0,0|0,1,1]=4 1382 B12R1.318 O=C(C=CI)N[C@H]1CCNC1=O 158d1d546093f5330507b9549b24a541 [0,2,0,0,0,0|1,0,1]=4 1383 B12R1.318 O=C(C=CI)N[C@H]1CCOC1=O c01c55c5c9cdcb9a6d6da3465b296d66 [0,2,0,0,0,0|0,1,1]=4 1384 B12R1.318 O=C(CCF)NC1CCNC1=O fbb7668126fa6504abd48f289c3e040f [0,2,0,0,0,0|1,0,0]=3 1385 B12R1.318 O=C(CCF)NC1CONC1=O 73ae29f0ca875a01c7bad461041e9e01 [0,2,0,0,0,0|2,0,0]=4 1386 B12R1.318 O=C(CCF)N[C@@H]1CCNC1=O 08ea2d86f4a282d25002dc76ba039803 [0,2,0,0,0,0|1,0,0]=3 1387 B12R1.318 O=C(CCF)N[C@@H]1CCOC1=O 6ae103d796e41a345ef32c02f53fdd24 [0,2,0,0,0,0|0,1,0]=3 1388 B12R1.318 O=C(CCF)N[C@@H]1CONC1=O 0e20a5004660e88e4d0ace531f233128 [0,2,0,0,0,0|2,0,0]=4 1389 B12R1.318 O=C(CCF)N[C@H]1CCNC1=O f0742d54f972e1fa9c42eb915d409524 [0,2,0,0,0,0|1,0,0]=3 1390 B12R1.318 O=C(CCF)N[C@H]1CCOC1=O d3105cae54c627ebee3d581ec4132725 [0,2,0,0,0,0|0,1,0]=3 1391 B12R1.318 O=C(CCF)N[C@H]1CONC1=O ac03c097671626f564847829d2052cf3 [0,2,0,0,0,0|2,0,0]=4 1392 B12R1.318 O=C(CCO)NC1CCNC1=O 06448082ca186d2eae92c814404d77fb [0,2,0,0,0,0|1,0,0]=3 1393 B12R1.318 O=C(CCO)N[C@@H]1CCNC1=O 880767a837f1acd79438e45e65c80162 [0,2,0,0,0,0|1,0,0]=3 1394 B12R1.318 O=C(CCO)N[C@H]1CCNC1=O 1878948ade5f4e8fa096a86371781f45 [0,2,0,0,0,0|1,0,0]=3 1395 B12R1.318 O=C(CCS)NC1CCNC1=O 80cf34b2a28517023332207de151ea39 [0,2,0,0,0,0|1,0,0]=3 1396 B12R1.318 O=C(CCS)NC1CONC1=O f658d104fa86284fdc6f01e93afd5c54 [0,2,0,0,0,0|2,0,0]=4 1397 B12R1.318 O=C(CCS)N[C@@H]1CCNC1=O b2ab7df0ae991e19739b31b68d3710f8 [0,2,0,0,0,0|1,0,0]=3 1398 B12R1.318 O=C(CCS)N[C@@H]1CONC1=O 6fb677f1f1572d2885c31ec890939c6c [0,2,0,0,0,0|2,0,0]=4 1399 B12R1.318 O=C(CCS)N[C@H]1CCNC1=O 3221436458c15d802966f529678c97f1 [0,2,0,0,0,0|1,0,0]=3 1400 B12R1.318 O=C(CCS)N[C@H]1CONC1=O 5384ceceb8b5cdb5e3ef502a571d80bf [0,2,0,0,0,0|2,0,0]=4 1401 B12R1.318 O=CCC(=O)NC1CCNC1=O ab3850983933aeb6131b1b1a6a69b143 [0,2,0,0,0,0|1,0,0]=3 1402 B12R1.318 O=CCC(=O)NC1CCSC1=O 4c6b1e7efcf3f2810e022c898415597e [0,2,0,0,0,0|0,0,0]=2 1403 B12R1.318 O=CCC(=O)NC1CONC1=O 7c106416de37aba595a4c97d294f9ca4 [0,2,0,0,0,0|2,0,0]=4 1404 B12R1.318 O=CCC(=O)N[C@@H]1CCNC1=O 5f8863578834898a6ad9a13d040286e7 [0,2,0,0,0,0|1,0,0]=3 1405 B12R1.318 O=CCC(=O)N[C@@H]1CCOC1=O b761f02f0b764eed2589745bc313a417 [0,2,0,0,0,0|0,1,0]=3 1406 B12R1.318 O=CCC(=O)N[C@@H]1CONC1=O be220191bc5b6f91c104310c049331b3 [0,2,0,0,0,0|2,0,0]=4 1407 B12R1.318 O=CCC(=O)N[C@H]1CCNC1=O 572c19ae82455d55e2d3c70e6f38f2e2 [0,2,0,0,0,0|1,0,0]=3 1408 B12R1.318 O=CCC(=O)N[C@H]1CCOC1=O a8bd12b15dff5b2dbbb99389c6595aba [0,2,0,0,0,0|0,1,0]=3 1409 B12R1.318 O=CCC(=O)N[C@H]1CONC1=O 7a884554ed670c429953f8db40b8abcd [0,2,0,0,0,0|2,0,0]=4 1410 B12R1.532 CCC(=O)NC1CC(=O)NC1=O d6878428899b1dd3f044c33672c28b3b [0,2,0,0,0,0|1,0,1]=4 1411 B12R1.532 CCC(=O)N[C@@H]1CC(=O)NC1=O d22b8bfbc32d7416651d1f4dae44ff4f [0,2,0,0,0,0|1,0,1]=4 1412 B12R1.532 CCC(=O)N[C@H]1CC(=O)NC1=O bc0a7a8d5006eda329a94bc2d0eb2268 [0,2,0,0,0,0|1,0,1]=4 1413 B12R1.532 O=C1CC(C(=O)N1)NC(=O)CF c253fa2a87bacf5ca7855b9afd6cbe9d [0,2,0,0,0,0|1,0,1]=4 1414 B12R1.532 O=C1CC(C(=O)N1)NC(=O)CO 5ea6f7079d09a9142f040d9881c5616d [0,2,0,0,0,0|1,0,1]=4 1415 B12R1.532 O=C1CC(C(=O)N1)NC(=O)CS c03030afb013e423dc35135c6f329765 [0,2,0,0,0,0|1,0,1]=4 1416 B12R1.532 O=C1C[C@@H](C(=O)N1)NC(=O)CF 4e000008dae8b861f50d90c1a4287b36 [0,2,0,0,0,0|1,0,1]=4 1417 B12R1.532 O=C1C[C@@H](C(=O)N1)NC(=O)CO 2152169bbd3b29e7ab040f299688aa23 [0,2,0,0,0,0|1,0,1]=4 1418 B12R1.532 O=C1C[C@@H](C(=O)N1)NC(=O)CS c9dc3181b3cfae3b958b4358c0809a39 [0,2,0,0,0,0|1,0,1]=4 1419 B12R1.532 O=C1C[C@H](C(=O)N1)NC(=O)CF 4e86f81005d43e4464f81a943d5cfdd1 [0,2,0,0,0,0|1,0,1]=4 1420 B12R1.532 O=C1C[C@H](C(=O)N1)NC(=O)CO 5f6cb7f8e50afae14ee8777791e225bb [0,2,0,0,0,0|1,0,1]=4 1421 B12R1.532 O=C1C[C@H](C(=O)N1)NC(=O)CS 0b6eee52a613258fefbba82de2f7af4e [0,2,0,0,0,0|1,0,1]=4 1422 B12R1.1672 C#CC(=O)NC1CCN(C1=O)C cbab5f7a2d978204a3038f22a818d08d [0,2,0,0,0,0|1,0,1]=4 1423 B12R1.1672 C#CC(=O)NC1CCN(C1=O)O 035e37020ce377c7c9252c30efd621dc [0,2,0,0,0,0|1,0,1]=4 1424 B12R1.1672 C#CC(=O)N[C@@H]1CCN(C1=O)C d8c12252c3f1f738db54f0ff05bf8517 [0,2,0,0,0,0|1,0,1]=4 1425 B12R1.1672 C#CC(=O)N[C@@H]1CCN(C1=O)O 722649fbb429f37c2027b6f2f945305a [0,2,0,0,0,0|1,0,1]=4 1426 B12R1.1672 C#CC(=O)N[C@H]1CCN(C1=O)C ff65b3b52324e9bb18fade4c33a1455e [0,2,0,0,0,0|1,0,1]=4 1427 B12R1.1672 C=CC(=O)NC1CCN(C1=O)C ff1b48285cf8513c31e7ef85dbea6e1f [0,2,0,0,0,0|1,0,1]=4 1428 B12R1.1672 C=CC(=O)NC1CCN(C1=O)O 05b434ebbed8149477877f3e888407b7 [0,2,0,0,0,0|1,0,1]=4 1429 B12R1.1672 C=CC(=O)N[C@@H]1CCN(C1=O)C ef270e201de7f2d385390e152fe56592 [0,2,0,0,0,0|1,0,1]=4 1430 B12R1.1672 C=CC(=O)N[C@@H]1CCN(C1=O)O ab82a6f4135663a33f3809e7f9124b05 [0,2,0,0,0,0|1,0,1]=4 1431 B12R1.1672 C=CC(=O)N[C@H]1CCN(C1=O)C 09227cdc7accff6272a8f2d7872e4b49 [0,2,0,0,0,0|1,0,1]=4 1432 B12R1.1672 CC(C=O)NC1CCN(C1=O)C 090b9a2cf00f4859b3443cea7479cd44 [0,2,0,0,0,0|1,0,1]=4 1433 B12R1.1672 CC(C=O)NC1CCN(C1=O)O c973fe78ffd032ab55a65236ebe9c0a4 [0,2,0,0,0,0|1,0,1]=4 1434 B12R1.1672 CC(C=O)N[C@@H]1CCN(C1=O)C 3afc060eb992906286ceef6407b552b7 [0,2,0,0,0,0|1,0,1]=4 1435 B12R1.1672 CC(C=O)N[C@@H]1CCN(C1=O)O d5705ae7f1c17ba73eb1b59d9dbb9718 [0,2,0,0,0,0|1,0,1]=4 1436 B12R1.1672 CC(C=O)N[C@H]1CCN(C1=O)C dc57266a4557c8b2ff22dd9cd21775e7 [0,2,0,0,0,0|1,0,1]=4 1437 B12R1.1672 CN1CCC(C1=O)NC(=O)C=O 8afa25be703abd662e20bc930e036ed4 [0,2,0,0,0,0|1,0,1]=4 1438 B12R1.1672 CN1CC[C@@H](C1=O)NC(=O)C=O e97f3ac1f7520f213903affce473851d [0,2,0,0,0,0|1,0,1]=4 1439 B12R1.1672 CN1CC[C@H](C1=O)NC(=O)C=O 25758633f9cc1102c92a8889f3e05f76 [0,2,0,0,0,0|1,0,1]=4 1440 B12R1.1672 C[C@H](C=O)NC1CCN(C1=O)C d848ecf6f653a2634af3cbb86507155e [0,2,0,0,0,0|1,0,1]=4 1441 B12R1.1672 C[C@H](C=O)NC1CCN(C1=O)O d77c86d923140aec6b2822905b0f12c5 [0,2,0,0,0,0|1,0,1]=4 1442 B12R1.1672 C[C@H](C=O)N[C@@H]1CCN(C1=O)C fc164917aec5960478e3e4306be193ef [0,2,0,0,0,0|1,0,1]=4 1443 B12R1.1672 C[C@H](C=O)N[C@@H]1CCN(C1=O)O 907dbe3dd990cb154727cee144ee75ea [0,2,0,0,0,0|1,0,1]=4 1444 B12R1.1672 C[C@H](C=O)N[C@H]1CCN(C1=O)C 97608cca3e7514e176406d92e055af33 [0,2,0,0,0,0|1,0,1]=4 1445 B12R1.1672 O=C(CO)NC1CCN(C1=O)O ec54f34a9fefba1e2c206c67e5bb5978 [0,2,0,0,0,0|1,0,0]=3 1446 B12R1.1672 O=C(CO)N[C@@H]1CCN(C1=O)O 885d3d74783c07c0b45ac40f5e9bc8f2 [0,2,0,0,0,0|1,0,0]=3 1447 B12R1.1672 O=CC(=O)NC1CCN(C1=O)O e0d579980143dda41183b2d937c380ea [0,2,0,0,0,0|1,0,1]=4 1448 B12R1.1672 O=CC(=O)N[C@@H]1CCN(C1=O)O 78e142b3f794f1fe6194c22bc56eff4f [0,2,0,0,0,0|1,0,1]=4 1449 B12R1.2217 C#CC(=O)N[C@@H]1C(=O)NC[C@H]1O f3ad3fb5d11ec2882abde28986d833ae [0,2,0,0,0,0|1,0,1]=4 1450 B12R1.2217 C=CC(=O)N[C@@H]1C(=O)NC[C@H]1O bfb90c42e246a6b4db3815cd92160095 [0,2,0,0,0,0|1,0,1]=4 1451 B12R1.2217 CC(C=O)N[C@@H]1C(=O)NC[C@H]1O 429bb3dfaf955c1a0cb322ad7e0dc263 [0,2,0,0,0,0|1,0,1]=4 1452 B12R1.2217 CCC(=O)N[C@@H]1C(=O)NC[C@H]1O d15174e3e90a15c004512d035eb799e2 [0,2,0,0,0,0|1,0,0]=3 1453 B12R1.2217 C[C@H](C=O)N[C@@H]1C(=O)NC[C@H]1O dce8d9449c47e72ba39cbaa83de62785 [0,2,0,0,0,0|1,0,1]=4 1454 B12R1.2217 O=C(CF)N[C@@H]1C(=O)NC[C@H]1O cdd8379792afce734defeac1d9763b1d [0,2,0,0,0,0|1,0,0]=3 1455 B12R1.2217 O=C(CO)N[C@@H]1C(=O)NC[C@H]1O 93fef195a132480f869bcb7e13105e25 [0,2,0,0,0,0|1,0,0]=3 1456 B12R1.2217 O=C(CS)N[C@@H]1C(=O)NC[C@H]1O dcd7fb8e27ffbb7af62e92968b782662 [0,2,0,0,0,0|1,0,0]=3 1457 B12R1.2217 O=CC(=O)N[C@@H]1C(=O)NC[C@H]1O ff8a69b236a4d3f648b3988c3bf36241 [0,2,0,0,0,0|1,0,1]=4 1458 B12R1.1276 CC(=O)NC1CC(=O)N(C1=O)C 2aed95a90ca65aaad399f0e9b70612b4 [0,2,0,0,0,0|1,0,1]=4 1459 B10R1.10 O=CCN1CCNC(=O)C1 1eb29f89f47ca82546c13bc4af9377ee [0,0,1,1,0,0|2,0,0]=4 1460 B10R1.10 O=CNC1CCNC(=O)C1 d47a9ff12078ea45926ce99e6dc19669 [0,0,1,1,0,0|1,0,0]=3 1461 B10R1.10 O=CN[C@@H]1CCNC(=O)C1 939e0de9e707ac9fd7ff5b73a3d70f40 [0,0,1,1,0,0|1,0,0]=3 1462 B10R1.10 O=CN[C@H]1CCNC(=O)C1 352532a44c9585014214a6f948f5ade2 [0,0,1,1,0,0|1,0,0]=3 1463 B10R1.16 O=CCCN1CNC(=O)C1 4c9ac5cc82cf9fd6c1642ca0fb2fe920 [0,0,1,1,0,0|2,0,0]=4 1464 B10R1.16 O=CCNC1CNC(=O)C1 3a4772255e17df1736076425cb01d5a0 [0,0,1,1,0,0|2,0,0]=4 1465 B10R1.16 O=CCN[C@@H]1CNC(=O)C1 7cf8d1b4e0d77623e93b30eea842ee02 [0,0,1,1,0,0|2,0,0]=4 1466 B10R1.16 O=CCN[C@H]1CNC(=O)C1 b391165ad5322b4705a44e91901fa50f [0,0,1,1,0,0|2,0,0]=4 1467 B10R1.16 O=CCOC1CNC(=O)C1 5577888f11198eec92e1ca4dd0cf16dd [0,0,1,1,0,0|2,0,0]=4 1468 B10R1.16 O=CCO[C@@H]1CNC(=O)C1 68f0f54da28e59f3995a9242a3aa5caf [0,0,1,1,0,0|2,0,0]=4 1469 B10R1.16 O=CCO[C@H]1CNC(=O)C1 cbb7852efee29bd7f74cf9714a4c369d [0,0,1,1,0,0|2,0,0]=4 1470 B10R1.16 O=CNCC1CNC(=O)C1 d8983798325b1c91e5cde8deb78bac2b [0,0,1,1,0,0|1,0,0]=3 1471 B10R1.16 O=CNC[C@@H]1CNC(=O)C1 b01424561999e0e66499ab497081e657 [0,0,1,1,0,0|1,0,0]=3 1472 B10R1.18 CC(=O)NC1C=CCCC1 1d5ddd958afbd2a3a6ae98a719be40e7 [0,0,1,1,0,0|2,0,0]=4 1473 B10R1.18 CC(=O)NC1CCSCC1 532c6db35a0b9f3a89303777aedbda02 [0,0,1,1,0,0|1,0,1]=4 1474 B10R1.24 O=CCOCC1CC(=O)N1 981e98d7c2a0d1e2f063492a13f25391 [0,0,1,1,0,0|2,0,0]=4 1475 B10R1.24 O=CCOC[C@@H]1CC(=O)N1 76b24afacfdfa84f500e045c215b1762 [0,0,1,1,0,0|2,0,0]=4 1476 B10R1.24 O=CCOC[C@H]1CC(=O)N1 ed29c201bd974ae1d73f41b40fc477c0 [0,0,1,1,0,0|2,0,0]=4 1477 B10R1.66 CC(=O)NCC1CC=CC1 fc1eefe51a17cea0ec5688a6927b0e1b [0,0,1,1,0,0|2,0,0]=4 1478 B10R1.162 O=CN1CCCNC(=O)C1 20f5771170acf328c40954a929bb7f84 [0,0,1,1,0,0|1,0,0]=3 1479 B10R1.408 COC(=O)C1CN1C(=O)C c862da5a96c4dadfa7f4ffdda0c31d2d [0,0,1,1,0,0|0,1,0]=3 1480 B10R1.408 COC(=O)[C@@H]1CN1C(=O)C ccd7e18a765f02d106e40e072e81d758 [0,0,1,1,0,0|0,1,0]=3 1481 B10R1.361 CC(=O)N1CCC1C(=O)N fe577cab9d51ac6c84aec9d9f8bc6d43 [0,0,1,1,0,0|1,0,0]=3 1482 B10R1.361 CC(=O)N1CC[C@@H]1C(=O)N bcfc46dbb045d8e9c12ffe86b35d1126 [0,0,1,1,0,0|1,0,0]=3 1483 B10R1.361 CC(=O)N1CC[C@H]1C(=O)N f95bf15e40d454368b6c6b4be360e373 [0,0,1,1,0,0|1,0,0]=3 1484 B10R1.442 CC(=O)NC1(CC1)C(=O)N fa42113c40cf5c7d81b57fbab87e94b6 [0,0,1,1,0,0|1,0,0]=3 1485 B10R2.351 CC(=O)N1C2C1CCC2 9699143556b5080ef759cce3beead167 [1,0,0,1,0,0|1,0,1]=4 1486 B12R2.466 O=C1SCCC1NCC2CC2 800c7712f683818a9524fc0a0b9d0f08 [0,0,0,1,0,1|1,0,1]=4 1487 B12R2.1145 CC(=O)N1CC2CC1C(=O)N2 6a93ff8c96764bc5c41197130024bbaa [0,1,0,1,0,0|1,0,0]=3 1488 B12R2.1145 CC(=O)N1C[C@@H]2C[C@H]1C(=O)N2 b42ccc532f319204d61562977dd38990 [0,1,0,1,0,0|1,0,0]=3 1489 B12R2.1145 CC(=O)N1C[C@H]2C[C@@H]1C(=O)N2 67ed3ce954e8586dab859254b8570a28 [0,1,0,1,0,0|1,0,0]=3 1490 B8R1.7 CC(=O)N1CCSC1 df98add89dd15161c9f678ec3ecd18ec [1,0,0,0,1,0|1,0,1]=4 1491 B8R1.34 CC(=O)NC1CCC1 46894fd3aa8761205eba8795d61a04cf [1,0,0,0,1,0|0,0,1]=3 1492 B8R1.34 CC(=O)NC1COC1 434b9f924b049f8d9fb83819938927c2 [1,0,0,0,1,0|0,1,1]=4 1493 B8R1.13 CCN[C@H]1CNC1=O f3f57bd052f649487c4a2d7e92b0d01a [1,0,0,0,1,0|1,0,1]=4 1494 B8R1.13 CCOC1CCC1=O 3dbc6f04881f51171a4de09e2024a401 [1,0,0,0,1,0|1,0,1]=4 1495 B8R1.13 C[C@@H]1CC[C@@H]1NC=O 832ca8b43ce77bd607bafce837c26208 [1,0,0,0,1,0|1,0,1]=4 1496 B8R1.13 C[C@@H]1CC[C@H]1NC=O d2720f62c3566f7476bb8bd3bbb32a7b [1,0,0,0,1,0|1,0,1]=4 1497 B8R1.13 N#CNC1CCC1=O 6fef62f5b6597e2c0a9f8080852ec84e [1,0,0,0,1,0|1,0,1]=4 1498 B8R1.13 O=CNC1CCC1F e99322470d72654c68e8cc3b0db230df [1,0,0,0,1,0|1,0,1]=4 1499 B8R1.13 O=CNC1CCC1O 77e73a0cb4e5ad431641f250066379fd [1,0,0,0,1,0|0,0,2]=4 1500 B8R1.13 O=CN[C@@H]1CC[C@@H]1O 9be330af07ef7a68a61722f62097919e [1,0,0,0,1,0|0,0,2]=4 1501 B8R1.13 O=CN[C@@H]1CC[C@H]1O a74500781f0881ab291899b8727dffc0 [1,0,0,0,1,0|0,0,2]=4 1502 B8R1.13 O=CN[C@H]1CC[C@@H]1O f6c564b97b260290e49358d20aaec1a0 [1,0,0,0,1,0|0,0,2]=4 1503 B8R1.13 O=CN[C@H]1CC[C@H]1O 126bd3309ad6ca2ddfb41ff376dce6e2 [1,0,0,0,1,0|0,0,2]=4 1504 B8R1.13 O=CN[C@H]1CNC1=O 25fa02203e7bb0bfd52d6056013f333c [1,0,0,0,1,0|1,0,0]=3 1505 B8R1.20 CC(=O)NC1CC1C 1768a28e3842ccc949f84e026e8d58f3 [0,0,0,0,2,0|1,0,1]=4 1506 B8R1.20 CC(=O)N[C@@H]1C[C@H]1F bc7a6eb1a99ce556c18fcaf7f0c75c37 [0,0,0,0,2,0|1,0,1]=4 1507 B8R1.20 CC(=O)N[C@H]1C[C@@H]1F 576115c90eccc628d4e941f7a7852f6c [0,0,0,0,2,0|1,0,1]=4 1508 B8R1.20 CC(=O)N[C@H]1C[C@H]1F 8cb83b6d110bbd78098fefdd41f3f45a [0,0,0,0,2,0|1,0,1]=4 1509 B10R0.44 COC(=O)CC(C)NC(=O)C 68e387ed7a4ae21860cf574c8e2d8500 [0,0,1,0,0,1|0,1,0]=3 1510 B10R0.44 COC(=O)C[C@@H](C)NC(=O)C b6b4556920dc3a9658ee9729fc39fcc1 [0,0,1,0,0,1|0,1,0]=3 1511 B10R0.44 COC(=O)C[C@H](C)NC(=O)C f93340677db23962def701fa7afdc1a9 [0,0,1,0,0,1|0,1,0]=3 1512 B10R0.84 C=C(C)CNC(CC)C(=O)N 279325f97672d5971a5dfb9ffa2affa0 [0,0,1,0,0,1|2,0,0]=4 1513 B10R0.84 C=C(C)CNC(CC)C(=O)O 510f710840fe0b538b761eee55e7b3fb [0,0,1,0,0,1|1,1,0]=4 1514 B10R0.84 C=C(C)CN[C@@H](CC)C(=O)N a21f04e0d3ed72ec6cce065f141db48a [0,0,1,0,0,1|2,0,0]=4 1515 B10R0.84 C=C(C)CN[C@@H](CC)C(=O)O 3765a78189e33f4f74992e1fa1177f8a [0,0,1,0,0,1|1,1,0]=4 1516 B10R0.84 C=C(C)CN[C@H](CC)C(=O)O 866f028f926329197e8afa6d8ee1c1e5 [0,0,1,0,0,1|1,1,0]=4 1517 B10R0.84 CC(=O)CN[C@@H](CO)C(=O)O 1df15b950648cbd16fe4b77e2da47a49 [0,0,1,0,0,1|1,1,0]=4 1518 B10R0.84 CCC(NCC(=O)C)C(=O)N 91c2ee1e4c84bc362b79cf453c655412 [0,0,1,0,0,1|1,0,0]=3 1519 B10R0.84 CCC(NCC(=O)C)C(=O)O d6728d936cc361f59cacb1dc49f582f7 [0,0,1,0,0,1|0,1,0]=3 1520 B10R0.84 CCC(NCC(=O)N)C(=O)N 97edfa96c37f9311c1b9c676eab89f5f [0,0,1,0,0,1|2,0,0]=4 1521 B10R0.84 CCC(NCC(=O)N)C(=O)O 85116187121d9b53f628253e53642bb5 [0,0,1,0,0,1|1,1,0]=4 1522 B10R0.84 CCC(NCC(=O)O)C(=O)N 9f4a569a59f19435e420b0a7c629ca17 [0,0,1,0,0,1|2,0,0]=4 1523 B10R0.84 CCC(NCC(=O)O)C(=O)O 92e08a55aa048b022ad223a36688a554 [0,0,1,0,0,1|1,1,0]=4 1524 B10R0.84 CCC(OCC(=O)C)C(=O)N d9ac00c82f4ef377dffed68ae5e8277b [0,0,1,0,0,1|2,0,0]=4 1525 B10R0.84 CC[C@@H](NCC(=O)C)C(=O)O 83894517348aec2818f50fa1afcb16dc [0,0,1,0,0,1|0,1,0]=3 1526 B10R0.84 CC[C@@H](NCC(=O)N)C(=O)O 5f6bc19e7c1ce18645dce53e417095f6 [0,0,1,0,0,1|1,1,0]=4 1527 B10R0.84 CC[C@@H](NCC(=O)O)C(=O)O b4c841a10b10c741af6a8c9e9c17e934 [0,0,1,0,0,1|1,1,0]=4 1528 B10R0.84 CC[C@H](NCC(=O)C)C(=O)O 7184b52fde72ff0b92950c6d921826af [0,0,1,0,0,1|0,1,0]=3 1529 B10R0.84 CC[C@H](NCC(=O)N)C(=O)N 10f53d269205ddbdded3eb0e752b731e [0,0,1,0,0,1|2,0,0]=4 1530 B10R0.84 CC[C@H](NCC(=O)N)C(=O)O de1a38e16c8e2b6ce48e1a4af358d152 [0,0,1,0,0,1|1,1,0]=4 1531 B10R0.84 CC[C@H](NCC(=O)O)C(=O)N 0f16ec89a93e9c897aef879f0229fa18 [0,0,1,0,0,1|2,0,0]=4 1532 B10R0.84 CC[C@H](NCC(=O)O)C(=O)O 6eb4b6897d0d8d46e01b859dc73b7ed8 [0,0,1,0,0,1|1,1,0]=4 1533 B10R1.4 CCNC1CCCNC1=O 2611d2046d7c302d155fa2575da996cf [1,0,0,0,0,1|1,0,1]=4 1534 B10R1.4 CCN[C@@H]1CCCNC1=O cc017d9a7d93a52deca7f6d6027f7b45 [1,0,0,0,0,1|1,0,1]=4 1535 B10R1.4 CCN[C@H]1CCCNC1=O b5bc0fce4a04ce1c92ba3448cfe5c3bb [1,0,0,0,0,1|1,0,1]=4 1536 B10R1.4 O=CNC1CCCNC1=O f6da1c43bc5339f63cfaf3dde1207f77 [1,0,0,0,0,1|1,0,0]=3 1537 B10R1.4 O=CN[C@@H]1CCCNC1=O d36bb1e3b45a60044b3e2d218ef043dc [1,0,0,0,0,1|1,0,0]=3 1538 B10R1.4 O=CN[C@H]1CCCNC1=O 682fc0196eae394c213d9a64f5b4cf6e [1,0,0,0,0,1|1,0,0]=3 1539 B12R1.125 C=C(C)CNC1CCCCC1=O 18a1b0c32adfe18e3dd214f1c774f311 [0,0,0,0,0,2|2,0,0]=4 1540 B12R1.125 C=C(C)CNC1CCCNC1=O 95d92c387e7352e8a7daff46a3a0e109 [0,0,0,0,0,2|2,0,0]=4 1541 B12R1.125 C=C(C)CNC1COCCC1=O f684dcfcf3209558306a847c380e3033 [0,0,0,0,0,2|2,0,0]=4 1542 B12R1.125 C=C(C)CNC1SCCCC1=O c8e955f3ed8f232d505c0f97ce00fec7 [0,0,0,0,0,2|2,0,0]=4 1543 B12R1.125 C=C(C)CN[C@@H]1CCCNC1=O 9429e245f731cc769ec500d3bfeb2dd8 [0,0,0,0,0,2|2,0,0]=4 1544 B12R1.125 C=C(C)CN[C@H]1CCCNC1=O c0334e7eca7ea79aa719397dc6dd3bfd [0,0,0,0,0,2|2,0,0]=4 1545 B12R1.125 CC(=O)CNC1CCCCC1=O a377f22d1b39ec77a040a8541623200f [0,0,0,0,0,2|1,0,0]=3 1546 B12R1.125 CC(=O)CNC1CCCNC1=O 3779914d9002358a5d1550d23eff4c6c [0,0,0,0,0,2|1,0,0]=3 1547 B12R1.125 CC(=O)CNC1SCCCC1=O eacb68556d30b501622eb1db7a959f66 [0,0,0,0,0,2|1,0,0]=3 1548 B12R1.125 CC(=O)COC1CCCNC1=O 942d34ff26c53033374a8ba3d935dde8 [0,0,0,0,0,2|2,0,0]=4 1549 B12R1.125 CC(=O)COC1COCCC1=O c4a15f4b3c3c83ed3477655a629e2ef5 [0,0,0,0,0,2|2,0,0]=4 1550 B12R1.125 CC(=O)COC1SCCCC1=O 7f17c3b3c939188b5faf2eb0677ad5d5 [0,0,0,0,0,2|2,0,0]=4 1551 B12R1.125 NC(=O)CNC1CCCCC1=O 734e4645b1306e469f47dd1df36ec2d7 [0,0,0,0,0,2|2,0,0]=4 1552 B12R1.125 NC(=O)CNC1CCCNC1=O 5a9b97e23b7b2af38f3effd66883477c [0,0,0,0,0,2|2,0,0]=4 1553 B12R1.125 NC(=O)CNC1SCCCC1=O d317649f715af6d57fe0883ae57103b8 [0,0,0,0,0,2|2,0,0]=4 1554 B12R1.125 NC(=O)CN[C@@H]1CCCNC1=O d6ab769d38d2427618fb23fd668f5d45 [0,0,0,0,0,2|2,0,0]=4 1555 B12R1.125 NC(=O)CN[C@H]1CCCNC1=O 3623721fc86ed4df94c3897563cdd1ab [0,0,0,0,0,2|2,0,0]=4 1556 B12R1.125 O=C(O)CNC1CCCNC1=O 068a282878b9860cc85e988dcd33a2ab [0,0,0,0,0,2|2,0,0]=4 1557 B12R1.125 O=C(O)CNC1SCCCC1=O 28972401f0688c9337339c0e1a4204fa [0,0,0,0,0,2|2,0,0]=4 1558 B12R1.125 O=C(O)CN[C@@H]1CCCNC1=O 2bbb499099abc1a13b76c5f631231419 [0,0,0,0,0,2|2,0,0]=4 1559 B12R1.125 O=C(O)CN[C@H]1CCCNC1=O ba17b75ae8ecbb376c8b86a9a7744220 [0,0,0,0,0,2|2,0,0]=4 1560 B12R1.210 CC(=O)NC1CCCCNC1=O 76db79fb758264a00fb79d41345c27e3 [0,0,0,0,0,2|1,0,0]=3 1561 B12R1.210 CC(=O)N[C@@H]1CCCCNC1=O 132638b5d14772c05e1407db10425c59 [0,0,0,0,0,2|1,0,0]=3 1562 B12R1.210 CC(=O)N[C@H]1CCCCNC1=O 631dadfc286487234d36ffd824162bda [0,0,0,0,0,2|1,0,0]=3 1563 B12R1.130 C/C(=C/CNC1CCNC1=O)/I 90552fe718e7835ccab1ea09f6d1a273 [0,0,0,0,0,2|2,0,0]=4 1564 B12R1.130 C/C(=C/CNC1CCSC1=O)/I ea8ec7411bdf50ed9155e263c62cfa08 [0,0,0,0,0,2|1,0,0]=3 1565 B12R1.130 C/C(=C/CN[C@@H]1CCNC1=O)/I 55d70c83193020ed1c49291f43442ab3 [0,0,0,0,0,2|2,0,0]=4 1566 B12R1.130 C/C(=C/CN[C@@H]1CCOC1=O)/I d74df074b9b4c43e9a5acc42e60101ec [0,0,0,0,0,2|1,1,0]=4 1567 B12R1.130 C/C(=C/CN[C@H]1CCNC1=O)/I 925ca092819a94e7a31a1ac01d54f067 [0,0,0,0,0,2|2,0,0]=4 1568 B12R1.130 C/C(=C/CN[C@H]1CCOC1=O)/I 355f6aa678e02697d18f1cbab319843b [0,0,0,0,0,2|1,1,0]=4 1569 B12R1.130 C/C(=C\CNC1CCNC1=O)/Cl e814998b71b8364522c46be5b07d7ca7 [0,0,0,0,0,2|2,0,0]=4 1570 B12R1.130 C/C(=C\CNC1CCSC1=O)/Cl 4193a21a9951a57fa6c0c9e794ca27bb [0,0,0,0,0,2|1,0,0]=3 1571 B12R1.130 C/C(=C\CN[C@@H]1CCNC1=O)/Cl 4606ae3bd267d04cf612359dc058bc5d [0,0,0,0,0,2|2,0,0]=4 1572 B12R1.130 C/C(=C\CN[C@@H]1CCOC1=O)/Cl 6e83a523c82f6df264b736ba690dbbb9 [0,0,0,0,0,2|1,1,0]=4 1573 B12R1.130 C/C(=C\CN[C@H]1CCNC1=O)/Cl bf25df5303f9b3651755126cb76ac7f2 [0,0,0,0,0,2|2,0,0]=4 1574 B12R1.130 C/C(=C\CN[C@H]1CCOC1=O)/Cl e9ac8fd140fbce23dd46c7a600d7fe84 [0,0,0,0,0,2|1,1,0]=4 1575 B12R1.130 C=C(C)CCNC1CCNC1=O 079e4ddc71406079840cb806c09fb9aa [0,0,0,0,0,2|2,0,0]=4 1576 B12R1.130 C=C(C)CCNC1CCSC1=O 682c13e8ad03c350689723ae70760078 [0,0,0,0,0,2|1,0,0]=3 1577 B12R1.130 C=C(C)CCN[C@@H]1CCNC1=O a3e482a2997cbc50a701532da9bb1037 [0,0,0,0,0,2|2,0,0]=4 1578 B12R1.130 C=C(C)CCN[C@@H]1CCOC1=O 0e4f57cf08b8f96c0c2dc91c5f332833 [0,0,0,0,0,2|1,1,0]=4 1579 B12R1.130 C=C(C)CCN[C@H]1CCNC1=O 105fafda40d1635dc3b8be8737df4284 [0,0,0,0,0,2|2,0,0]=4 1580 B12R1.130 C=C(C)CCN[C@H]1CCOC1=O 59123629bf99663ef56205243ec2af84 [0,0,0,0,0,2|1,1,0]=4 1581 B12R1.130 C=C(C)CNCC1CCNC1=O 0eb9e3cc6e21e002b0b87b82eeb2d156 [0,0,0,0,0,2|2,0,0]=4 1582 B12R1.130 CC(=CCNC1CCCC1=O)C 4e3c74b293aa25c29113bd13028d6ed0 [0,0,0,0,0,2|2,0,0]=4 1583 B12R1.130 CC(=CCNC1CCNC1=O)C a25e4090a0c209b4463f9e69acc57800 [0,0,0,0,0,2|2,0,0]=4 1584 B12R1.130 CC(=CCNC1CCNC1=O)Cl d9bcf6eb956c6e10d701657475855b3c [0,0,0,0,0,2|2,0,0]=4 1585 B12R1.130 CC(=CCNC1CCNC1=O)I 17c71744891c8640ddfc7cb1b8c9161e [0,0,0,0,0,2|2,0,0]=4 1586 B12R1.130 CC(=CCNC1CCOC1=O)C ce02c2eb3080ad103e459569d1f0527a [0,0,0,0,0,2|1,1,0]=4 1587 B12R1.130 CC(=CCNC1CCSC1=O)C 3255e5e5b717ff3838a55d6506421732 [0,0,0,0,0,2|1,0,0]=3 1588 B12R1.130 CC(=CCNC1CCSC1=O)Cl cabeabf038bd6ac3690fc705f154cf71 [0,0,0,0,0,2|1,0,0]=3 1589 B12R1.130 CC(=CCNC1CCSC1=O)I a57c1aece183527613b7f84436306789 [0,0,0,0,0,2|1,0,0]=3 1590 B12R1.130 CC(=CCN[C@@H]1CCNC1=O)C b306321ad134862c4cd5eeccb0050c24 [0,0,0,0,0,2|2,0,0]=4 1591 B12R1.130 CC(=CCN[C@@H]1CCNC1=O)Cl 834bf555e35db7f4cf20f6f2dff9f29d [0,0,0,0,0,2|2,0,0]=4 1592 B12R1.130 CC(=CCN[C@@H]1CCNC1=O)I 3b648c8cf6e37200641bf1cabe969276 [0,0,0,0,0,2|2,0,0]=4 1593 B12R1.130 CC(=CCN[C@@H]1CCOC1=O)C 99b8fa03caf010dc1bd3873eedd9980a [0,0,0,0,0,2|1,1,0]=4 1594 B12R1.130 CC(=CCN[C@@H]1CCOC1=O)Cl a840d0bd2f9c0a7ed4c65b1634752d76 [0,0,0,0,0,2|1,1,0]=4 1595 B12R1.130 CC(=CCN[C@@H]1CCOC1=O)I 0dc56c91bbd20957d2f92d01e0d62b8c [0,0,0,0,0,2|1,1,0]=4 1596 B12R1.130 CC(=CCN[C@H]1CCNC1=O)C 3e45374c91070b83b13aea81f93cf4fd [0,0,0,0,0,2|2,0,0]=4 1597 B12R1.130 CC(=CCN[C@H]1CCNC1=O)Cl 4c7f212dd127baf50f4a1e0bd44f3f6e [0,0,0,0,0,2|2,0,0]=4 1598 B12R1.130 CC(=CCN[C@H]1CCNC1=O)I 1ebd6be96189047b0ea31eae605a268e [0,0,0,0,0,2|2,0,0]=4 1599 B12R1.130 CC(=CCN[C@H]1CCOC1=O)C e673a3147f40297e5b554c2ba7cda599 [0,0,0,0,0,2|1,1,0]=4 1600 B12R1.130 CC(=CCN[C@H]1CCOC1=O)Cl 75e367cd1f40b79ec993c361bd6bcf4d [0,0,0,0,0,2|1,1,0]=4 1601 B12R1.130 CC(=CCN[C@H]1CCOC1=O)I 406d24661fc9e90761719514eaa3c502 [0,0,0,0,0,2|1,1,0]=4 1602 B12R1.130 CC(=O)CCNC1CCNC1=O b1f54979b287dee2dffa3dc2b69fb473 [0,0,0,0,0,2|1,0,0]=3 1603 B12R1.130 CC(=O)CCNC1CCSC1=O 01a899a819a45ef82bd8ee257127a903 [0,0,0,0,0,2|0,0,0]=2 1604 B12R1.130 CC(=O)CCNC1CONC1=O aaa664a653ce1ee2229c3b8f06ba7ac0 [0,0,0,0,0,2|2,0,0]=4 1605 B12R1.130 CC(=O)CCN[C@@H]1CCNC1=O ff80c086c87392fa4c071e86dd9e1fbe [0,0,0,0,0,2|1,0,0]=3 1606 B12R1.130 CC(=O)CCN[C@@H]1CCOC1=O 3a307323823f113972d4970197302e80 [0,0,0,0,0,2|0,1,0]=3 1607 B12R1.130 CC(=O)CCN[C@@H]1CONC1=O ccb2350a7902ca9e32572fabdcbfc254 [0,0,0,0,0,2|2,0,0]=4 1608 B12R1.130 CC(=O)CCN[C@H]1CCNC1=O 4ebf44d9792359c1eb94f8c39841b53a [0,0,0,0,0,2|1,0,0]=3 1609 B12R1.130 CC(=O)CCN[C@H]1CCOC1=O aa08ce60df0eb44dc9b410862620221b [0,0,0,0,0,2|0,1,0]=3 1610 B12R1.130 CC(=O)CCN[C@H]1CONC1=O f22dc4c933a584c84f00814e5abc7acb [0,0,0,0,0,2|2,0,0]=4 1611 B12R1.130 CC(=O)CCOC1CCCC1=O 2e7bd6e0d76e424877ed4b699dbab07f [0,0,0,0,0,2|2,0,0]=4 1612 B12R1.130 CC(=O)CCOC1CCNC1=O f8991b0b5b57391dc28e4a4a2e9a7a5b [0,0,0,0,0,2|2,0,0]=4 1613 B12R1.130 CC(=O)CCOC1CCOC1=O 651c5dfd80703f409d2879b4293248de [0,0,0,0,0,2|1,1,0]=4 1614 B12R1.130 CC(=O)CCO[C@@H]1CCNC1=O badb87c1f04541002c0c2d4813d20b5f [0,0,0,0,0,2|2,0,0]=4 1615 B12R1.130 CC(=O)CCO[C@@H]1CCOC1=O cd1e909c590c404553eb1f3b152d50f1 [0,0,0,0,0,2|1,1,0]=4 1616 B12R1.130 CC(=O)CCO[C@H]1CCNC1=O 256e2a5dce27138c55bdb65d86d2e507 [0,0,0,0,0,2|2,0,0]=4 1617 B12R1.130 CC(=O)CCO[C@H]1CCOC1=O bda466da54797a1f36465cb3720bbac3 [0,0,0,0,0,2|1,1,0]=4 1618 B12R1.130 CC(=O)CNCN1CCCC1=O 9638ae16a1c222243f4ad8e64fbf20e6 [0,0,0,0,0,2|2,0,0]=4 1619 B12R1.130 CC(=O)NCCN1CCCC1=O 9ddf2861dde324a787a1d65093f2ce7f [0,0,0,0,0,2|2,0,0]=4 1620 B12R1.130 CC(=O)NCCN1CCNC1=O e612093a41a5208b98ea8626711f8743 [0,0,0,0,0,2|2,0,0]=4 1621 B12R1.130 CC(=O)NCOC1CCCC1=O 15727a1543013b7ce6fda475a6931c67 [0,0,0,0,0,2|1,0,0]=3 1622 B12R1.130 CC(=O)NCOC1CCNC1=O 606dec3e982b6e64f3a28fa4d5aa5454 [0,0,0,0,0,2|1,0,0]=3 1623 B12R1.130 CC(=O)OCNC1CCNC1=O 1df51678fcbcb94bf0b51dbd132bbe18 [0,0,0,0,0,2|1,0,0]=3 1624 B12R1.130 CC(=O)OCNC1CCSC1=O 2f1108e311fd025a4fecdd15eca74dea [0,0,0,0,0,2|0,0,0]=2 1625 B12R1.130 CC(=O)OCNC1CONC1=O a8c91630493c8be749f38f7abd3e7a24 [0,0,0,0,0,2|2,0,0]=4 1626 B12R1.130 CC(=O)OCN[C@@H]1CCNC1=O a9852f1d24f6b79da207302bb2dd1a8a [0,0,0,0,0,2|1,0,0]=3 1627 B12R1.130 CC(=O)OCN[C@@H]1CCOC1=O 83d1db3f41c3ff2887d547e4372b5c34 [0,0,0,0,0,2|0,1,0]=3 1628 B12R1.130 CC(=O)OCN[C@@H]1CONC1=O 6cadd211afcd8eb1f0191d023b745bd2 [0,0,0,0,0,2|2,0,0]=4 1629 B12R1.130 CC(=O)OCN[C@H]1CCNC1=O 7c9bf63d8a13e5255ecc531289c5c560 [0,0,0,0,0,2|1,0,0]=3 1630 B12R1.130 CC(=O)OCN[C@H]1CCOC1=O 9949888b679b0bc01949df1c9d046d4b [0,0,0,0,0,2|0,1,0]=3 1631 B12R1.130 CC(=O)OCN[C@H]1CONC1=O 7a78cf83db11d493c4a581037ad52d52 [0,0,0,0,0,2|2,0,0]=4 1632 B12R1.130 CC(=O)OCOC1CCCC1=O b4e27fb9446d9c71a48f647607a9030e [0,0,0,0,0,2|2,0,0]=4 1633 B12R1.130 CC(=O)OCOC1CCNC1=O 12bc377cdd5758e98a443ae94f7e297b [0,0,0,0,0,2|2,0,0]=4 1634 B12R1.130 CC(=O)OCOC1CCOC1=O 8b3dac06efab7dd210c9ac2bfb1e2043 [0,0,0,0,0,2|1,1,0]=4 1635 B12R1.130 CC(=O)OCO[C@@H]1CCNC1=O e8fc1346c8837bce48c5eb7cb6d91240 [0,0,0,0,0,2|2,0,0]=4 1636 B12R1.130 CC(=O)OCO[C@@H]1CCOC1=O e01f78ed6dcd884c6b16f56872a9ca67 [0,0,0,0,0,2|1,1,0]=4 1637 B12R1.130 CC(=O)OCO[C@H]1CCNC1=O b0a6357ffb3fb96a4c0b841511c7b0be [0,0,0,0,0,2|2,0,0]=4 1638 B12R1.130 CC(=O)OCO[C@H]1CCOC1=O 86737dba32818cb783b91c8a9763e883 [0,0,0,0,0,2|1,1,0]=4 1639 B12R1.130 CC(C)CCNC1CCSC1=O 103a90f4bff20d5ea97319076acb6efa [0,0,0,0,0,2|1,0,1]=4 1640 B12R1.130 CC(C)OCNC1CCSC1=O 8f72b459b845b0bcacc92859c4d3b1e9 [0,0,0,0,0,2|1,0,1]=4 1641 B12R1.130 CC(O)CCNC1CCSC1=O 75d962f6e5dbe2c634cbc91dbb74c395 [0,0,0,0,0,2|0,0,2]=4 1642 B12R1.130 CN(C)CCNC1CCSC1=O fc51046dfa216058080e3aff0a230615 [0,0,0,0,0,2|2,0,0]=4 1643 B12R1.130 CS(=O)CCNC1CCCC1=O efaee35f3bc0b4fdf96e3145d4257164 [0,0,0,0,0,2|2,0,0]=4 1644 B12R1.130 CS(=O)CCNC1CCNC1=O 5c17bd0592faf1564e1f11286e1651d7 [0,0,0,0,0,2|2,0,0]=4 1645 B12R1.130 CS(=O)CCNC1CCSC1=O 4a6e58c5b094c537033899b9a58e0f16 [0,0,0,0,0,2|1,0,0]=3 1646 B12R1.130 CS(=O)CCN[C@@H]1CCNC1=O 117fdcffb25ae81a4f9ef9bb2a6cf809 [0,0,0,0,0,2|2,0,0]=4 1647 B12R1.130 CS(=O)CCN[C@@H]1CCOC1=O 0247b0d7df180b6c13fb161af235d05c [0,0,0,0,0,2|1,1,0]=4 1648 B12R1.130 CS(=O)CCN[C@H]1CCNC1=O 4ab139b2db01c4d2a819080574c712dd [0,0,0,0,0,2|2,0,0]=4 1649 B12R1.130 CS(=O)CCN[C@H]1CCOC1=O 60f8a74af23ea12ca1abff88689deb3b [0,0,0,0,0,2|1,1,0]=4 1650 B12R1.130 NC(=O)CCNC1CCCC1=O 327564dbc795ca76fa50c24066b41aec [0,0,0,0,0,2|2,0,0]=4 1651 B12R1.130 NC(=O)CCNC1CCNC1=O 219fec7d5e8a9f80f11ba453b1850568 [0,0,0,0,0,2|2,0,0]=4 1652 B12R1.130 NC(=O)CCNC1CCSC1=O 8631c342915e255f4e6f818455160fcf [0,0,0,0,0,2|1,0,0]=3 1653 B12R1.130 NC(=O)CCN[C@@H]1CCNC1=O 26f3acd1121bf7d112bde7f5db133a59 [0,0,0,0,0,2|2,0,0]=4 1654 B12R1.130 NC(=O)CCN[C@@H]1CCOC1=O cec82a8f58854acc80c117cb5f465148 [0,0,0,0,0,2|1,1,0]=4 1655 B12R1.130 NC(=O)CCN[C@H]1CCNC1=O 586635d27c1c1388cdc8103ce17953b4 [0,0,0,0,0,2|2,0,0]=4 1656 B12R1.130 NC(=O)CCN[C@H]1CCOC1=O beb6653afd0419fd49ac3b865fc73bff [0,0,0,0,0,2|1,1,0]=4 1657 B12R1.130 NC(=O)CNCC1CCNC1=O b1ea817cdbe99abc3e2dcd8f696d5a5c [0,0,0,0,0,2|2,0,0]=4 1658 B12R1.130 NC(=O)NCOC1CCNC1=O 69967faa596e617a9243b5535433678b [0,0,0,0,0,2|2,0,0]=4 1659 B12R1.130 NC(=O)SCNC1CCNC1=O 64cf9fe423113b0cde36f13667c3b44f [0,0,0,0,0,2|2,0,0]=4 1660 B12R1.130 NC(=O)SCNC1CCSC1=O d3bd3b30574dd8d52b7a89b9f730ba8a [0,0,0,0,0,2|1,0,0]=3 1661 B12R1.130 NC(=O)SCN[C@@H]1CCNC1=O 0c5923221b90a216b3b596d3e7b700e6 [0,0,0,0,0,2|2,0,0]=4 1662 B12R1.130 NC(=O)SCN[C@@H]1CCOC1=O ed0b2ef0c6a157257a10976994afece1 [0,0,0,0,0,2|1,1,0]=4 1663 B12R1.130 NC(=O)SCN[C@H]1CCNC1=O 2d12a1aa7e46490d0828e7fba18bd37a [0,0,0,0,0,2|2,0,0]=4 1664 B12R1.130 NC(=O)SCN[C@H]1CCOC1=O e020fc57cbb2030cbef78c8125e1e173 [0,0,0,0,0,2|1,1,0]=4 1665 B12R1.130 O=C(O)CCNC1CCNC1=O 0ca6b6c65bf9d5cba431495df665ff00 [0,0,0,0,0,2|2,0,0]=4 1666 B12R1.130 O=C(O)CCNC1CCSC1=O b85112a7653d8e4c076db93ee27e57d7 [0,0,0,0,0,2|1,0,0]=3 1667 B12R1.130 O=C(O)CCN[C@@H]1CCNC1=O 7105fe2f4a781d3cab2923178b27e33f [0,0,0,0,0,2|2,0,0]=4 1668 B12R1.130 O=C(O)CCN[C@@H]1CCOC1=O 1f8bddd620ae69ff3d4d2851a5972572 [0,0,0,0,0,2|1,1,0]=4 1669 B12R1.130 O=C(O)CCN[C@H]1CCNC1=O 8768d0fe1a308862b51e0ea59b3391ac [0,0,0,0,0,2|2,0,0]=4 1670 B12R1.130 O=C(O)CCN[C@H]1CCOC1=O be6b42835ca51d00cb930f09b0af1cc7 [0,0,0,0,0,2|1,1,0]=4 1671 B12R1.130 O=C(O)CNCC1CCNC1=O fff9812d1e19977631b43661b78eefae [0,0,0,0,0,2|2,0,0]=4 1672 B12R1.130 O=C1SCCC1NCC=C(Cl)Cl e5d1a90e11e21df5b91f2de9156ab3f5 [0,0,0,0,0,2|2,0,0]=4 1673 B12R1.226 C=C(C)CNC1CCCC(=O)C1 35b7a2c6304d99be384b3739866c0789 [0,0,0,0,0,2|2,0,0]=4 1674 B12R1.226 C=C(C)CNC1CCNC(=O)C1 d3435c4e1da94f35e1509f4b0c57a79e [0,0,0,0,0,2|2,0,0]=4 1675 B12R1.226 C=C(C)CN[C@@H]1CCNC(=O)C1 9d185a688c53e6540cf7c835f1b126dd [0,0,0,0,0,2|2,0,0]=4 1676 B12R1.226 C=C(C)CN[C@H]1CCNC(=O)C1 4174f4a90f84bdf38d82088fbbb3096b [0,0,0,0,0,2|2,0,0]=4 1677 B12R1.226 CC(=O)CNC1CCCC(=O)C1 c54a0be17d2d118681e8798bb01651b2 [0,0,0,0,0,2|1,0,0]=3 1678 B12R1.226 CC(=O)COC1CCCC(=O)C1 f091092046b027bb08f66635c3aee824 [0,0,0,0,0,2|2,0,0]=4 1679 B12R1.226 CC(=O)NCC1CCCC(=O)N1 53c28ed3a82a4f74057bdd44be43b7c3 [0,0,0,0,0,2|1,0,0]=3 1680 B12R1.226 CC(=O)NCC1CCNC(=O)C1 ef86c80ae1d80258b77fb06799dd2bbe [0,0,0,0,0,2|1,0,0]=3 1681 B12R1.226 NC(=O)CNC1CCNC(=O)C1 91fd8d020a7fea1122e930d51dad1ace [0,0,0,0,0,2|2,0,0]=4 1682 B12R1.226 NC(=O)CN[C@@H]1CCNC(=O)C1 6fe9f4aeb822a8caf920b705dfb4a5ec [0,0,0,0,0,2|2,0,0]=4 1683 B12R1.226 NC(=O)CN[C@H]1CCNC(=O)C1 f2d7fb5a5d0bf18d9db85cbf948d74d9 [0,0,0,0,0,2|2,0,0]=4 1684 B12R1.226 O=C(O)CNC1CCNC(=O)C1 f06dc1da91480018124b0b1ed9214363 [0,0,0,0,0,2|2,0,0]=4 1685 B12R1.226 O=C(O)CN[C@@H]1CCNC(=O)C1 88171bfba16e96d48e9abed6cf93be80 [0,0,0,0,0,2|2,0,0]=4 1686 B12R1.226 O=C(O)CN[C@H]1CCNC(=O)C1 9c96a1a483f256e2813a07b1c4479721 [0,0,0,0,0,2|2,0,0]=4