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0c1237cf3962727bf4a99c757e2cf33b [1,0,0,0,0,0|2,0,1]=4 59 B9R0.1 C#C[C@@H](C)NCCC(C)C 699dab8dae07ab1de4d7ac130e17bab0 [1,0,0,0,0,0|1,0,2]=4 60 B9R0.1 C#C[C@@H](C)NCCN(C)C 5af13ee6c17d234f5652927419d73791 [1,0,0,0,0,0|2,0,1]=4 61 B9R0.1 C#C[C@@H](C)NCOC(=O)C 1b0cfbdab2dada392392ccbd56207c3d [1,0,0,0,0,0|3,0,0]=4 62 B9R0.1 C#C[C@@H](C)NCOC(C)C 5c3a5a6c0a0488539a6dc1f7c124db4e [1,0,0,0,0,0|2,0,1]=4 63 B9R0.1 C#C[C@@H](C)OC/C=C(/C)\I b762ecafeee0c47a73a3f8f5ca93f3a1 [1,0,0,0,0,0|2,0,0]=3 64 B9R0.1 C#C[C@@H](C)OC/C=C(\C)/Cl 7a98e06b4bf033cf72291fb9aff80a89 [1,0,0,0,0,0|2,0,0]=3 65 B9R0.1 C#C[C@@H](C)OCC=C(C)C fe88fc19aedf9458e6da47ae43b29e73 [1,0,0,0,0,0|1,0,0]=2 66 B9R0.1 C#C[C@@H](C)OCC=C(C)Cl 5d315cef764f540141a83a2498761516 [1,0,0,0,0,0|2,0,0]=3 67 B9R0.1 C#C[C@@H](C)OCC=C(C)I 7757ec375a117886c1853667c34f99c0 [1,0,0,0,0,0|2,0,0]=3 68 B9R0.1 C#C[C@@H](C)OCC=C(Cl)Cl c5fe4c2d0c241e1c3fd4562fb52c87bf [1,0,0,0,0,0|3,0,0]=4 69 B9R0.1 C#C[C@@H](C)OCCC(=C)C 6a3e543cc203316d741677572f9c015c [1,0,0,0,0,0|1,0,2]=4 70 B9R0.1 C#C[C@@H](C)OCCC(=O)C 7e586dd88e16e7dd536fb64f2b8dd52b [1,0,0,0,0,0|2,0,1]=4 71 B9R0.1 C#C[C@@H](C)OCCC(C)C 39ba57b16a6b29bc0d4fad775a85d51c [1,0,0,0,0,0|1,0,2]=4 72 B9R0.1 C#C[C@@H](C)OCCN(C)C 36a6eb6f54d59ad3c3be75a5cd55207b [1,0,0,0,0,0|2,0,1]=4 73 B9R0.1 C#C[C@@H](C)OCOC(=O)C 2907d97da2b97a632870bcd8c7a51054 [1,0,0,0,0,0|3,0,0]=4 74 B9R0.1 C#C[C@@H](C)OCOC(C)C 778e397c395a6b7a3e09321773a47be6 [1,0,0,0,0,0|2,0,1]=4 75 B9R0.1 C#C[C@H](C)NC/C=C(/C)\I 59802b35ba491304751057c27f1bf750 [1,0,0,0,0,0|2,0,0]=3 76 B9R0.1 C#C[C@H](C)NC/C=C(\C)/Cl 2838dd7c171ab3d5764309118929e327 [1,0,0,0,0,0|2,0,0]=3 77 B9R0.1 C#C[C@H](C)NCC=C(C)C 3e164a58648f09586712ca950945f4d5 [1,0,0,0,0,0|1,0,0]=2 78 B9R0.1 C#C[C@H](C)NCC=C(C)Cl fad0dbbdcd72e3db6eaca87f03658362 [1,0,0,0,0,0|2,0,0]=3 79 B9R0.1 C#C[C@H](C)NCC=C(C)I a9dae87322992d99bd6382c932e41aa6 [1,0,0,0,0,0|2,0,0]=3 80 B9R0.1 C#C[C@H](C)NCC=C(Cl)Cl 81785aa55a02226f948dd6e8a6a4ff33 [1,0,0,0,0,0|3,0,0]=4 81 B9R0.1 C#C[C@H](C)NCCC(=C)C ff504469d3847509b96aa3116f51f46e [1,0,0,0,0,0|1,0,2]=4 82 B9R0.1 C#C[C@H](C)NCCC(=O)C 318d7a262b86ea661eb7ce21f0740553 [1,0,0,0,0,0|2,0,1]=4 83 B9R0.1 C#C[C@H](C)NCCC(C)C 41cfb5f663239833fcdebf33a8bacf71 [1,0,0,0,0,0|1,0,2]=4 84 B9R0.1 C#C[C@H](C)NCCN(C)C e702d7ae71a23c5aa386d57b73e18981 [1,0,0,0,0,0|2,0,1]=4 85 B9R0.1 C#C[C@H](C)NCOC(=O)C 89a5577c833fb0a15151b724177d3ac0 [1,0,0,0,0,0|3,0,0]=4 86 B9R0.1 C#C[C@H](C)NCOC(C)C a0889a70e79ad8a1bd621ea78c17ef58 [1,0,0,0,0,0|2,0,1]=4 87 B9R0.1 C#C[C@H](C)OC/C=C(/C)\I 6cbe0cd016ea0247e2dbdef7eb2d95bd [1,0,0,0,0,0|2,0,0]=3 88 B9R0.1 C#C[C@H](C)OC/C=C(\C)/Cl c0ce811ff780f77d7bbade3738e89026 [1,0,0,0,0,0|2,0,0]=3 89 B9R0.1 C#C[C@H](C)OCC=C(C)C a7d3331fb14382ce6866accdaa415b5b [1,0,0,0,0,0|1,0,0]=2 90 B9R0.1 C#C[C@H](C)OCC=C(C)Cl 1b53e4c21704688fb08fba6c00ffab25 [1,0,0,0,0,0|2,0,0]=3 91 B9R0.1 C#C[C@H](C)OCC=C(C)I 680141e5415f3b28ed3bb3bd2c20fd2f [1,0,0,0,0,0|2,0,0]=3 92 B9R0.1 C#C[C@H](C)OCC=C(Cl)Cl 8f6231592055096e9b864c7f60ab2a43 [1,0,0,0,0,0|3,0,0]=4 93 B9R0.1 C#C[C@H](C)OCCC(=C)C b76f5ab32fd7b79f893e5d37095db1a5 [1,0,0,0,0,0|1,0,2]=4 94 B9R0.1 C#C[C@H](C)OCCC(=O)C 7e08e889f3f187ec5b8f08b81e2918a3 [1,0,0,0,0,0|2,0,1]=4 95 B9R0.1 C#C[C@H](C)OCCC(C)C 2059f654ec883d0e01e2a74ad6f88ffb [1,0,0,0,0,0|1,0,2]=4 96 B9R0.1 C#C[C@H](C)OCCN(C)C 9d0d816d8e0850665d44ba7c54779869 [1,0,0,0,0,0|2,0,1]=4 97 B9R0.1 C#C[C@H](C)OCOC(=O)C 0c8fff1fbe8e13344961fc961bb8803e [1,0,0,0,0,0|3,0,0]=4 98 B9R0.1 C#C[C@H](C)OCOC(C)C c0803cceec754a7cf6d5661f7131f3f9 [1,0,0,0,0,0|2,0,1]=4 99 B9R0.1 C/C(=C/CNC(C)C#N)/I 864a988604d981f67c415e73be4f2aa7 [1,0,0,0,0,0|3,0,0]=4 100 B9R0.1 C/C(=C/COC(C)C#N)/Cl b88aa2e7b27ebbabb2ac2d9974033fa9 [1,0,0,0,0,0|3,0,0]=4 101 B9R0.1 C/C(=C/COC(C)C#N)/I 81ea094f08ed43ea0d3a13ec4e14f3d5 [1,0,0,0,0,0|3,0,0]=4 102 B9R0.1 C/C(=C\CNC(C)C#N)/Cl 343cbc6be11c38ea8e1a4e514dbef5e1 [1,0,0,0,0,0|3,0,0]=4 103 B9R0.1 C=CC(C)NCC=C(C)C 64c69f10631d80367b5d4c3b07502c83 [1,0,0,0,0,0|1,0,2]=4 104 B9R0.1 C=CC(C)OCC=C(C)C 20e5319a9490769669161ba7f8adf99c [1,0,0,0,0,0|1,0,2]=4 105 B9R0.1 C=C[C@H](C)OCC=C(C)C 69f4fcf4cf471c0af125a25ed710522a [1,0,0,0,0,0|1,0,2]=4 106 B9R0.1 CC(=CCNC(C)C#N)C 6ee8ac7098e289d085d927600cbc3732 [1,0,0,0,0,0|2,0,0]=3 107 B9R0.1 CC(=CCNC(C)C#N)Cl bd16bac21b48738b3735dceb47dd92ce [1,0,0,0,0,0|3,0,0]=4 108 B9R0.1 CC(=CCNC(C)C#N)I fbc15f81cf893a5477695984dd139b59 [1,0,0,0,0,0|3,0,0]=4 109 B9R0.1 CC(=CCNC(C)C=O)C 2a952bc34b30add8a3ec26dd2cce4d5d [1,0,0,0,0,0|2,0,1]=4 110 B9R0.1 CC(=CCNC(C)CO)C 1760657284de2107a87809cc1e9a31b4 [1,0,0,0,0,0|2,0,1]=4 111 B9R0.1 CC(=CCNC(F)C#N)C f44dea2ba3d3c7c7b40e6b565abb2d0b [1,0,0,0,0,0|3,0,0]=4 112 B9R0.1 CC(=CCN[C@@H](C)CO)C 503550882df668804141809f00d65a83 [1,0,0,0,0,0|2,0,1]=4 113 B9R0.1 CC(=CCN[C@H](C)C=O)C 43df98502fba49cf5e9b21eae36020a2 [1,0,0,0,0,0|2,0,1]=4 114 B9R0.1 CC(=CCN[C@H](C)CO)C 149395f83d23fe72fd897f35f46036ff [1,0,0,0,0,0|2,0,1]=4 115 B9R0.1 CC(=CCOC(C)C#N)C afc52edab140b4d4c9344e56c2474ee2 [1,0,0,0,0,0|2,0,0]=3 116 B9R0.1 CC(=CCOC(C)C#N)I dba8680f11b9765f2fc330c5fcc6f797 [1,0,0,0,0,0|3,0,0]=4 117 B9R0.1 CC(=CCOC(C)C=O)C ffabf62222c7948c9bb7c4ad6c5785e7 [1,0,0,0,0,0|2,0,1]=4 118 B9R0.1 CC(=CCOC(C)CF)C 75ff53c5111656ca303f696ecd863da0 [1,0,0,0,0,0|2,0,1]=4 119 B9R0.1 CC(=CCOC(C)CS)C 9862585ed0092050348a8368f81059b3 [1,0,0,0,0,0|2,0,1]=4 120 B9R0.1 CC(=CCOC(F)C#N)C da4c666db7d22d9f6581d064c0270eec [1,0,0,0,0,0|3,0,0]=4 121 B9R0.1 CC(=CCO[C@H](C)C=O)C 76a443559fa42b1539c8aaf9163b966c [1,0,0,0,0,0|2,0,1]=4 122 B9R0.1 CC(=CCO[C@H](C)CS)C 2da706d5345c29b10ceebd436543821b [1,0,0,0,0,0|2,0,1]=4 123 B9R0.1 CCC(C)NCC=C(C)C a2f44659c461ef615ce082ecc587ff75 [1,0,0,0,0,0|1,0,2]=4 124 B9R0.1 CCC(C)OCC=C(C)C f1a856dad648c67c3199ced8e645ed40 [1,0,0,0,0,0|1,0,2]=4 125 B9R0.1 CCN(C)CCC=C(C)C 232ba2d38b136f9ab79e69d0e197cb22 [1,0,0,0,0,0|1,0,2]=4 126 B9R0.1 CC[C@@H](C)NCC=C(C)C 9805440ec95291712dd9e091ff4d0ac8 [1,0,0,0,0,0|1,0,2]=4 127 B9R0.1 CC[C@@H](C)OCC=C(C)C e4a6022f8d02a4c12c0cd2cf54a88045 [1,0,0,0,0,0|1,0,2]=4 128 B9R0.1 CC[C@H](C)NCC=C(C)C c96aecba3a4b1c0206c17da9f4870ccc [1,0,0,0,0,0|1,0,2]=4 129 B9R0.1 CC[C@H](C)OCC=C(C)C d2053192ca51a631dfb1bf706824d85b [1,0,0,0,0,0|1,0,2]=4 130 B9R0.20 C#CC(C)(C)NC/C=C/C bce6fab1c08eabdc5fa3bc97a756c5d3 [1,0,0,0,0,0|2,0,0]=3 131 B9R0.20 C#CC(C)(C)NC/C=C/Cl 6b8664fc80ddea60c562bc046c9c8e2e [1,0,0,0,0,0|3,0,0]=4 132 B9R0.20 C#CC(C)(C)NC/C=C\C a24e90b5582f4723e1198d592fbef5b3 [1,0,0,0,0,0|2,0,0]=3 133 B9R0.20 C#CC(C)(C)NC/C=C\Cl f5e515351d3fa96fa2b65e7d08cd218c [1,0,0,0,0,0|3,0,0]=4 134 B9R0.20 C#CC(C)(C)NC/C=C\O da5a1cd54318573b2400bf452efeea0f [1,0,0,0,0,0|3,0,0]=4 135 B9R0.20 C/C=C/CNC(C)(C)C#N e7285830f963c8b4f7b0cc0edd40fefe [1,0,0,0,0,0|3,0,0]=4 136 B9R0.20 C/C=C\CNC(C)(C)C#N d87bfe2548d80dd7b33147e12b93a39a [1,0,0,0,0,0|3,0,0]=4 137 B9R0.56 CC(=CCNC(C)(C)C)C bc5f6fe8c4fb0c67e01dfc2650e35d9b [1,0,0,0,0,0|2,0,1]=4 138 B9R0.56 CC(=O)NCCC(C)(C)O 09bac841bd2153dd8b07a31d7318af00 [1,0,0,0,0,0|2,0,1]=4 139 B9R0.56 CC(C)NCCC(C)(C)O 03abc3e07e78e8ef71ecbbfdc1f051c5 [1,0,0,0,0,0|1,0,2]=4 140 B9R0.56 CC(C)OCCC(C)(C)O 38132787d8ad654cd0616fc9176a2955 [1,0,0,0,0,0|1,0,2]=4 141 B11R0.213 C#CC(C)(CC)NC/C=C(/C)\I 0e507a7db4ef8a01eb582ec41304d42a [0,1,0,0,0,0|3,0,0]=4 142 B11R0.213 C#CC(C)(CC)NC/C=C(\C)/Cl 89cdd12322b887ba48763575d2901067 [0,1,0,0,0,0|3,0,0]=4 143 B11R0.213 C#CC(C)(CC)NCC=C(C)C dbd62f164852055434af83dc8d5c7710 [0,1,0,0,0,0|2,0,0]=3 144 B11R0.213 C#CC(C)(CC)NCC=C(C)Cl 1f14363f1c4dc0db0a2d36f0b433de22 [0,1,0,0,0,0|3,0,0]=4 145 B11R0.213 C#CC(C)(CC)NCC=C(C)I 758018c54d4c4e3e0ea21ce6bcb57ddd [0,1,0,0,0,0|3,0,0]=4 146 B11R0.213 CC(=CCNC(C)(CO)CO)C e3087a71bfd9a08703f4478084145405 [0,1,0,0,0,0|2,0,1]=4 147 B11R0.213 CCC(C)(C#N)NCC=C(C)C 5bd2caf74093f7015962d4125ec3fa3c [0,1,0,0,0,0|3,0,0]=4 148 B11R0.213 CCC(C)(CO)NCC=C(C)C c9f755f166eb9aea5b5725bd1bbd1f97 [0,1,0,0,0,0|1,0,2]=4 149 B11R0.300 C#CC(C)(C)NC(=O)C=C(C)C eea942bb0ce7f9e873b5b0353bcb380f [0,1,0,0,0,0|2,0,1]=4 150 B11R0.302 C#CC(C)(C)NCC(=O)C(=O)C 99dd659f8b184d8c99f61a9801cfb9b6 [0,1,0,0,0,0|3,0,0]=4 151 B11R0.302 C#CC(C)(C)NCC(=O)C(C)C 2679d1b4312768e0ecc07d3393f610ad [0,1,0,0,0,0|2,0,1]=4 152 B11R0.302 C#CC(C)(C)NCC(=O)N(C)C 9a362921d9b8f8a6e54c27cfe8cc667b [0,1,0,0,0,0|3,0,0]=4 153 B11R1.407 C#CC1(CC1)NC/C=C(/C)\I 2c155168d67667c580cce5066be0fa7d [0,0,0,1,0,0|3,0,0]=4 154 B11R1.407 C#CC1(CC1)NC/C=C(\C)/Cl ec58ca4409f06065f09204a8cdf39518 [0,0,0,1,0,0|3,0,0]=4 155 B11R1.407 C#CC1(CC1)NCC=C(C)C 4a309643c3798b169442a5d09fe51300 [0,0,0,1,0,0|2,0,0]=3 156 B11R1.407 C#CC1(CC1)NCC=C(C)Cl e82f2d916d9dfea01604c162984a3c21 [0,0,0,1,0,0|3,0,0]=4 157 B11R1.407 C#CC1(CC1)NCC=C(C)I 0656ed28ad7d12384c137270a929a56a [0,0,0,1,0,0|3,0,0]=4 158 B11R1.407 CC(=CCNC1(CC1)C#N)C 0f22453d6f0314ba1f656a3a04f182a5 [0,0,0,1,0,0|3,0,0]=4 159 B9R0.64 C#CC(C)(C)COC(C)C 29f75e69f814cda0ce946d3a8870fc25 [0,0,0,0,1,0|2,0,1]=4 160 B9R0.64 C#CC(C)(C)NCC(=C)C 8c59d979fe78eef142e9f8a526c2b84b [0,0,0,0,1,0|2,0,1]=4 161 B9R0.64 C#CC(C)(C)NCC(C)C b06e267b16d8c798c0e94c7029af39e4 [0,0,0,0,1,0|2,0,1]=4 162 B9R0.64 C#CC(C)(C)NCN(C)C 3a477ae6fff1a80817b766a8d58c2a83 [0,0,0,0,1,0|3,0,0]=4 163 B11R0.127 C#CC(C)(C)COC/C=C(/C)\I 08baa846abbed59b2dbc7efa590235fc [0,0,0,0,0,1|2,0,0]=3 164 B11R0.127 C#CC(C)(C)COC/C=C(\C)/Cl 45ea72a35420030342fd622d836214b0 [0,0,0,0,0,1|2,0,0]=3 165 B11R0.127 C#CC(C)(C)COCC=C(C)C 308de8a054cbe3b0b0cd1e46549698de [0,0,0,0,0,1|1,0,0]=2 166 B11R0.127 C#CC(C)(C)COCC=C(C)Cl 66fea4053aaebc4316f39321ecfc3f2b [0,0,0,0,0,1|2,0,0]=3 167 B11R0.127 C#CC(C)(C)COCC=C(C)I d1c63ac19f4d8b847a08313f41da8b47 [0,0,0,0,0,1|2,0,0]=3 168 B11R0.127 C#CC(C)(C)COCC=C(Cl)Cl b0f35f7b30bebbc887ff1fe8f0ec4cf7 [0,0,0,0,0,1|3,0,0]=4 169 B11R0.127 C#CC(C)(C)COCCC(=C)C 6be129e0f7393ff5aa290b2fa599ff62 [0,0,0,0,0,1|1,0,2]=4 170 B11R0.127 C#CC(C)(C)COCCC(=O)C 4ffd40d835ee7c555b074b48736384bd [0,0,0,0,0,1|2,0,1]=4 171 B11R0.127 C#CC(C)(C)COCCC(C)C 104e7fefe6808e58447a601041b10b72 [0,0,0,0,0,1|1,0,2]=4 172 B11R0.127 C#CC(C)(C)COCCN(C)C 9ec06957076b6c222b7d62072792ec9e [0,0,0,0,0,1|2,0,1]=4 173 B11R0.127 C#CC(C)(C)COCOC(=O)C 3bc74c15fba9f63d0da8afbbd7045e08 [0,0,0,0,0,1|3,0,0]=4 174 B11R0.127 C#CC(C)(C)COCOC(C)C 40d917e2fc69d9b41f8fb825b07031fb [0,0,0,0,0,1|2,0,1]=4 175 B11R0.127 C#CC(C)(C)NC/C=C/C(C)C 82db181f9cb4ad92df4992e4af82a226 [0,0,0,0,0,1|1,0,2]=4 176 B11R0.127 C#CC(C)(C)NCCC=C(C)C b4faea2bd97c6af6bfc5ffd3f6ab6510 [0,0,0,0,0,1|1,0,0]=2 177 B11R0.127 C#CC(C)(C)NCCC=C(F)F a21f23cef1689ebefbe30634f3f60971 [0,0,0,0,0,1|3,0,0]=4 178 B11R0.127 C#CC(C)(C)NCCCC(=C)C ba896ac42e31c21b7dd006dcec6c55fb [0,0,0,0,0,1|1,0,2]=4 179 B11R0.127 C#CC(C)(C)NCCCC(=O)C feb307ed3da255cb7c013464dc952cda [0,0,0,0,0,1|2,0,1]=4 180 B11R0.127 C#CC(C)(C)NCCCC(C)C d683b4bdd13ff3c2e8e6058b54b9d935 [0,0,0,0,0,1|1,0,2]=4 181 B11R0.127 C#CC(C)(C)NCCCN(C)C a81b95bf886b1a9d39a66c6708b89ca3 [0,0,0,0,0,1|2,0,1]=4 182 B11R0.127 C#CC(C)(C)NCCNC(=O)C 05ae475aec4704e7e25fa2202575f7ed [0,0,0,0,0,1|3,0,0]=4 183 B11R0.127 C#CC(C)(C)NCCOC(=O)C b642cbdcea0a062fa78997cc1b0c3ae7 [0,0,0,0,0,1|3,0,0]=4 184 B11R0.127 C#CC(C)(C)NCCOC(C)C 1b2fbcb67792c6e23cd85e4f65b5fc07 [0,0,0,0,0,1|2,0,1]=4 185 B11R0.127 C#CC(C)(C)NCCSC(=O)C b095ba7ead3f45e929c73c9fe9eb1502 [0,0,0,0,0,1|3,0,0]=4 186 B11R0.127 C#CC(C)(C)NCCSC(C)C 97dfcb45abcc4ce4b985aaef94c7aee5 [0,0,0,0,0,1|2,0,1]=4 187 B11R0.127 C/C(=C/CNCC(C)(C)C#N)/I 43d8a4dfa838cc6e17627a867eab3476 [0,0,0,0,0,1|3,0,0]=4 188 B11R0.127 C/C(=C/COCC(C)(C)C#N)/Cl b3320c681c212e84b97f51ddcbb77f30 [0,0,0,0,0,1|3,0,0]=4 189 B11R0.127 C/C(=C/COCC(C)(C)C#N)/I 8ea5a0cca10cbce1c5a405f4c11a6aa9 [0,0,0,0,0,1|3,0,0]=4 190 B11R0.127 C/C(=C\CNCC(C)(C)C#N)/Cl 10143f77a9547a63ac33d3354d18ce41 [0,0,0,0,0,1|3,0,0]=4 191 B11R0.127 C/C(=C\COCC(C)(C)C#N)/Cl 3737eb7b203689f0041f9348ad2a43f7 [0,0,0,0,0,1|3,0,0]=4 192 B11R0.127 C=CC(C)(C)COCC=C(C)C 502d3db9dcd5db842a7b0f6c6b7f6c23 [0,0,0,0,0,1|1,0,2]=4 193 B11R0.127 CC(=CCCNC(C)(C)C#N)C febc51f3b52d3f6762136661e245eb65 [0,0,0,0,0,1|2,0,0]=3 194 B11R0.127 CC(=CCCNC(C)(C)CF)C 5c6a7f51717fcd1a2b0e604afb38e594 [0,0,0,0,0,1|2,0,1]=4 195 B11R0.127 CC(=CCCNC(C)(C)CO)C b3c1638b072990bfe21a68b52121d8c6 [0,0,0,0,0,1|2,0,1]=4 196 B11R0.127 CC(=CCNCC(C)(C)C#N)C 99346793d9d6934f69abc4590aa16daa [0,0,0,0,0,1|2,0,0]=3 197 B11R0.127 CC(=CCNCC(C)(C)C#N)Cl 9d4d10a4b8651af757f99e54f7670df0 [0,0,0,0,0,1|3,0,0]=4 198 B11R0.127 CC(=CCNCC(C)(C)C#N)I 201e93dbd4d705a41c00125f22dc43c8 [0,0,0,0,0,1|3,0,0]=4 199 B11R0.127 CC(=CCNCC(C)(C)CF)C 3693b7d54e0fb979e4cf354118d3cca7 [0,0,0,0,0,1|2,0,1]=4 200 B11R0.127 CC(=CCNCC(C)(C)CO)C cbc9f2a399ec599b2849cbfc826618c4 [0,0,0,0,0,1|2,0,1]=4 201 B11R0.127 CC(=CCOCC(C)(C)C#N)C 09d0541d80d16f5dd1bb6fda54e10465 [0,0,0,0,0,1|2,0,0]=3 202 B11R0.127 CC(=CCOCC(C)(C)C#N)Cl 6f9f9f386cefdb26c5f2ea96cc499d2d [0,0,0,0,0,1|3,0,0]=4 203 B11R0.127 CC(=CCOCC(C)(C)C#N)I 84be061acc6627fe97256426d62ca9b7 [0,0,0,0,0,1|3,0,0]=4 204 B11R0.127 CC(=CCOCC(C)(C)C=O)C 13de8b7ca514a9f8eaea1c6af38bdea1 [0,0,0,0,0,1|2,0,1]=4 205 B11R0.127 CC(=CCOCC(C)(C)CF)C 7e7a49d0be5a5e214ee81bc844f776d4 [0,0,0,0,0,1|2,0,1]=4 206 B11R0.127 CCC(C)(C)CNCC=C(C)C b46a5f5269c615b34be7fdbd64dc7e79 [0,0,0,0,0,1|1,0,2]=4 207 B11R0.127 CCC(C)(C)NCCC=C(C)C a295a8fb9596e695995572c7b0977ad9 [0,0,0,0,0,1|1,0,2]=4 208 B11R0.127 CCC(C)(O)CNC/C=C(/C)\I 20afd29c36fd9623c57ed0164a33140f [0,0,0,0,0,1|1,0,2]=4 209 B11R0.127 CCC(C)(O)CNC/C=C(\C)/Cl 395143b7a9803ebd54528de6cc9dc310 [0,0,0,0,0,1|1,0,2]=4 210 B11R0.127 CCC(C)(O)CNCC=C(C)C 85773ce3ab24342aa9c14925b4e80f96 [0,0,0,0,0,1|0,0,2]=3 211 B11R0.127 CCC(C)(O)CNCC=C(C)Cl ccce3ba4dd97b70064eff72cb6ac9c6a [0,0,0,0,0,1|1,0,2]=4 212 B11R0.127 CCC(C)(O)CNCC=C(C)I 4b537e399e37c7318afd900ee6c3fdb7 [0,0,0,0,0,1|1,0,2]=4 213 B11R0.127 COC(C)(C)CNCC=C(C)C 056ea0294ee80b7f0a3cf221d6f87724 [0,0,0,0,0,1|2,0,1]=4 214 B11R0.127 COC(C)(C)COCC=C(C)C b60fc9fd18019f6ae7da0d675e77aad2 [0,0,0,0,0,1|2,0,1]=4 215 B8R0.6 C#CC(C)NC/C=C/C c0940ce5416f7d5bafa3706f6206c55e [2,0,0,0,0,0|1,0,0]=3 216 B8R0.6 C#CC(C)NC/C=C/Cl cef02ccb65f95a5e735c8649a15de9d1 [2,0,0,0,0,0|2,0,0]=4 217 B8R0.6 C#CC(C)NC/C=C\C 725cd7123a9bed3c983ac58d09ef6ff2 [2,0,0,0,0,0|1,0,0]=3 218 B8R0.6 C#CC(C)NC/C=C\Cl 4ca2abad681213beeb8408b70179d045 [2,0,0,0,0,0|2,0,0]=4 219 B8R0.6 C#CC(C)NC/C=C\O 9cabb65a35e3c87c434acd24c3e4b241 [2,0,0,0,0,0|2,0,0]=4 220 B8R0.6 C#CC(C)NCC=CC 915292a64fc619027eca5a68eb7a7f47 [2,0,0,0,0,0|1,0,0]=3 221 B8R0.6 C#CC(C)OC/C=C/C 5653c69a55ad8a46b726e978d7f2ebae [2,0,0,0,0,0|1,0,0]=3 222 B8R0.6 C#CC(C)OC/C=C/Cl 2e3fc0a39b4b3a02ef6171cecdaa055e [2,0,0,0,0,0|2,0,0]=4 223 B8R0.6 C#CC(C)OC/C=C\C 04140e362ce97569ca2aa93006ba5ae1 [2,0,0,0,0,0|1,0,0]=3 224 B8R0.6 C#CC(C)OC/C=C\Cl d3709dd7e481f948ff6162b34da29d8f [2,0,0,0,0,0|2,0,0]=4 225 B8R0.6 C#CC(C)OCC=CC fb4f95482be5bc88cf7e15e73fa30638 [2,0,0,0,0,0|1,0,0]=3 226 B8R0.6 C#CC(C)OCC=CCl 5fdd7ef5e96e14660a3b5ed3fc819504 [2,0,0,0,0,0|2,0,0]=4 227 B8R0.6 C#C[C@@H](C)NC/C=C/C f0ea50b7ee1676b51b8a0e5ac8145e57 [2,0,0,0,0,0|1,0,0]=3 228 B8R0.6 C#C[C@@H](C)NC/C=C/Cl 1b5a78b412e1436fca52043b8397ab8d [2,0,0,0,0,0|2,0,0]=4 229 B8R0.6 C#C[C@@H](C)NC/C=C\C caaf4f8e115c7cbeaa4d3ecec1d79368 [2,0,0,0,0,0|1,0,0]=3 230 B8R0.6 C#C[C@@H](C)NC/C=C\Cl eb605b34b245e328a43b8d8e1435de71 [2,0,0,0,0,0|2,0,0]=4 231 B8R0.6 C#C[C@@H](C)NC/C=C\O 9760978c7ba54d954cf3d87ae5f42e56 [2,0,0,0,0,0|2,0,0]=4 232 B8R0.6 C#C[C@@H](C)OC/C=C/C 4891518cd79a849f0a15495017b29aa0 [2,0,0,0,0,0|1,0,0]=3 233 B8R0.6 C#C[C@@H](C)OC/C=C/Cl 8eb8a5a1193f6d0c204d466b752cffa9 [2,0,0,0,0,0|2,0,0]=4 234 B8R0.6 C#C[C@@H](C)OC/C=C\C fe608a25daa10c7080b35c0c2b83c0c7 [2,0,0,0,0,0|1,0,0]=3 235 B8R0.6 C#C[C@@H](C)OC/C=C\Cl f9a07ba936d1e124571edd9b2e408429 [2,0,0,0,0,0|2,0,0]=4 236 B8R0.6 C#C[C@H](C)NC/C=C/C e7a67980af485e4979467702d027d420 [2,0,0,0,0,0|1,0,0]=3 237 B8R0.6 C#C[C@H](C)NC/C=C/Cl 8aca0120fb9bf543ba9f92df3507e9a5 [2,0,0,0,0,0|2,0,0]=4 238 B8R0.6 C#C[C@H](C)NC/C=C\C 5011f58e0006e9044d5494e0f80c73d1 [2,0,0,0,0,0|1,0,0]=3 239 B8R0.6 C#C[C@H](C)NC/C=C\Cl 4a308b9a53a80402c83f3c0f4790a91b [2,0,0,0,0,0|2,0,0]=4 240 B8R0.6 C#C[C@H](C)NC/C=C\O 0d09fd622c6d187c1a1ac2a48998c61d [2,0,0,0,0,0|2,0,0]=4 241 B8R0.6 C#C[C@H](C)OC/C=C/C 924a3e97f186eb25bf2fa73ce5c54c0a [2,0,0,0,0,0|1,0,0]=3 242 B8R0.6 C#C[C@H](C)OC/C=C/Cl da24867eea93d26f9a379ee5a25a8fd6 [2,0,0,0,0,0|2,0,0]=4 243 B8R0.6 C#C[C@H](C)OC/C=C\C 70d5f954cc48c00d70cb105a93275118 [2,0,0,0,0,0|1,0,0]=3 244 B8R0.6 C#C[C@H](C)OC/C=C\Cl 6e08bd17a3cf6787174039dbf4102ff6 [2,0,0,0,0,0|2,0,0]=4 245 B8R0.6 C/C=C/CNC(C)C#N 41aeed0f40dd96a5628675bc9738c82a [2,0,0,0,0,0|2,0,0]=4 246 B8R0.6 C/C=C/COC(C)C#N bb1cbf2d1942f6e3de5ad25298404664 [2,0,0,0,0,0|2,0,0]=4 247 B8R0.6 C/C=C\CNC(C)C#N c64cec89fabc2adf094cb2d9d5562d79 [2,0,0,0,0,0|2,0,0]=4 248 B8R0.6 C/C=C\COC(C)C#N 817e0ba50329f77848fc8a7e6835d921 [2,0,0,0,0,0|2,0,0]=4 249 B8R0.6 CC=CCNC(C)C#N 02c56120fe2c3a47d794c4a12e6ba1cf [2,0,0,0,0,0|2,0,0]=4 250 B8R0.6 CC=CCOC(C)C#N 07d1caac27514cdfa3ffcd26dbb291bf [2,0,0,0,0,0|2,0,0]=4 251 B8R0.7 C#CCCCNC(=O)C 8bbad3dcf674b05cb5f90221808a2bb7 [2,0,0,0,0,0|2,0,0]=4 252 B8R0.7 C#CCCCNC(C)C a191f2dd6f3014e4785c981a31a68729 [2,0,0,0,0,0|1,0,1]=4 253 B8R0.7 C#CCCCOC(C)C c2df5f3e15633977f96051966f9f9505 [2,0,0,0,0,0|1,0,1]=4 254 B8R0.7 C#CCNC/C=C(/C)\I 47feccffd9c76c63b975126ed658f6c1 [2,0,0,0,0,0|2,0,0]=4 255 B8R0.7 C#CCNC/C=C(\C)/Cl 171f3696b9c02b8c004cff06f007547e [2,0,0,0,0,0|2,0,0]=4 256 B8R0.7 C#CCNCC=C(C)C e2d53e06fa1b9709d4db4ea52a5cd833 [2,0,0,0,0,0|1,0,0]=3 257 B8R0.7 C#CCNCC=C(C)Cl f31349545cf2e8e726b71da29b43cbae [2,0,0,0,0,0|2,0,0]=4 258 B8R0.7 C#CCNCC=C(C)I 58066196447d5ea12c15abfd00bb930e [2,0,0,0,0,0|2,0,0]=4 259 B8R0.7 C#CCOC/C=C(/C)\Cl d0b099e5ebc42a1bb8984c9726a34c23 [2,0,0,0,0,0|2,0,0]=4 260 B8R0.7 C#CCOC/C=C(/C)\I 0e7771c62ec1d989fda7763440f6fd6c [2,0,0,0,0,0|2,0,0]=4 261 B8R0.7 C#CCOC/C=C(\C)/Cl 362f5946d1df7922107741bf0f3c8697 [2,0,0,0,0,0|2,0,0]=4 262 B8R0.7 C#CCOCC=C(C)C 2e4aaf9663a01ba98af45c5a071d3cd5 [2,0,0,0,0,0|1,0,0]=3 263 B8R0.7 C#CCOCC=C(C)Cl de0b75d809beed3dacf7ff5c0f51e788 [2,0,0,0,0,0|2,0,0]=4 264 B8R0.7 C#CCOCC=C(C)I d3752e304af1460c98377f39df9a0c47 [2,0,0,0,0,0|2,0,0]=4 265 B8R0.7 CC(=CCCNC#N)C 9f0cc49c522eaa369a53ab1c5b3c6fbb [2,0,0,0,0,0|2,0,0]=4 266 B8R0.7 CC(=CCNCC#N)C fc74b67ebcbd6ac22561cd0396ce1f00 [2,0,0,0,0,0|2,0,0]=4 267 B8R0.7 CC(=CCOCC#N)C bb5cbac60d6d27d1fcccf17e10aabf89 [2,0,0,0,0,0|2,0,0]=4 268 B8R0.28 CC(=CCNC(C)C)C 4bc1ccab37d407a99a9990c7578b5199 [2,0,0,0,0,0|1,0,1]=4 269 B8R0.28 CC(=CCOC(C)C)C e629491c9d8565cece6e7fc625997c17 [2,0,0,0,0,0|1,0,1]=4 270 B8R0.28 CC(=O)NCCC(C)O 9f83d99fdee0bda30ff85f31b4ee4b24 [2,0,0,0,0,0|2,0,0]=4 271 B8R0.28 CC(=O)NCC[C@@H](C)O 40ba395f3243b6aab3575e45be2f2594 [2,0,0,0,0,0|2,0,0]=4 272 B8R0.28 CC(=O)NCC[C@H](C)O ac547764dcce609b723a03cd4268cf9c [2,0,0,0,0,0|2,0,0]=4 273 B8R0.28 CC(C)NCC[C@@H](C)O 22fd34c721310950afa2eb5fa7b9be25 [2,0,0,0,0,0|1,0,1]=4 274 B8R0.28 CC(C)NCC[C@H](C)O 49b6367cd8f92ec1d9eb4f55dcad194e [2,0,0,0,0,0|1,0,1]=4 275 B8R0.28 CC(O)CCNC(C)C c17e7a58f1e2a686463daf8ba7d1a0e5 [2,0,0,0,0,0|1,0,1]=4 276 B8R0.25 C#CC(C)(C)NCC=C 89902fe1978be17806a75981627fa66b [2,0,0,0,0,0|2,0,0]=4 277 B10R0.3 C#CCC(C)OC/C=C(/C)\I a84a75cd801e937f2fb175fcd8a0bb7d [1,1,0,0,0,0|2,0,0]=4 278 B10R0.3 C#CCC(C)OC/C=C(\C)/Cl 9ebb99be97378dc5cb16a31543c9eb0a [1,1,0,0,0,0|2,0,0]=4 279 B10R0.3 C#CCC(C)OCC=C(C)C 3e58881b9430b2984e2c3e87eb761d7e [1,1,0,0,0,0|1,0,0]=3 280 B10R0.3 C#CCC(C)OCC=C(C)Cl 17854673f1c7e1201a01cbf822bf9cdc [1,1,0,0,0,0|2,0,0]=4 281 B10R0.3 C#CCC(C)OCC=C(C)I a2b38fdbf8fd4839f00bff687217bac0 [1,1,0,0,0,0|2,0,0]=4 282 B10R0.3 C#CCN(C)CCC=C(C)C b3766d786c1b67f9b8777a6770bc046f [1,1,0,0,0,0|1,0,0]=3 283 B10R0.3 CC#CC(C)OC/C=C(/C)\I df6f7edd706cb2fe2216c843bedf4ee8 [1,1,0,0,0,0|2,0,0]=4 284 B10R0.3 CC#CC(C)OC/C=C(\C)/Cl fd2470cc99df6a21fdf3a6f2616df1bb [1,1,0,0,0,0|2,0,0]=4 285 B10R0.3 CC#CC(C)OCC=C(C)C 15be7b759b66929abb4d84d4c97ef9d3 [1,1,0,0,0,0|1,0,0]=3 286 B10R0.3 CC#CC(C)OCC=C(C)Cl 9ae158fbd3412cb0c841c7e3a14e954a [1,1,0,0,0,0|2,0,0]=4 287 B10R0.3 CC#CC(C)OCC=C(C)I 923883b946e89779b6e8aaba9eac0590 [1,1,0,0,0,0|2,0,0]=4 288 B10R0.3 CC(=CCCC(C)OCF)C 6664a9ab1ffffce273c0154ca48b84b6 [1,1,0,0,0,0|1,0,1]=4 289 B10R0.3 CC(=CCCN(C)CC#N)C 47e22426e903ab6cdaab46aba3c8fb4e [1,1,0,0,0,0|1,0,1]=4 290 B10R0.3 CC(=CCC[C@@H](C)OCF)C 06963be90c9e89a7148fa3e5a57a42c1 [1,1,0,0,0,0|1,0,1]=4 291 B10R0.3 CC(=CCC[C@H](C)OCF)C 3df6c94219d6ff0ecf1b9dc25b9c280d [1,1,0,0,0,0|1,0,1]=4 292 B10R0.3 CC(=CCNC(C)CC#N)C ff989cb4cff304e739402ca03696b147 [1,1,0,0,0,0|1,0,1]=4 293 B10R0.3 CC(=CCOC(C)CC#N)C e94086449e78bb61456d8b64a9cf11ec [1,1,0,0,0,0|1,0,1]=4 294 B10R0.3 CC(=CCO[C@@H](C)CC#N)C 08333e37ac797a63c0e125eff44c1463 [1,1,0,0,0,0|1,0,1]=4 295 B10R0.3 CC(=CCO[C@H](C)CC#N)C d36abc60c195e52d57e2badee93eb6a2 [1,1,0,0,0,0|1,0,1]=4 296 B10R0.3 CCOC(C)CCC=C(C)C 1ca9ec3c5864b13eb80e92b783990b96 [1,1,0,0,0,0|0,0,2]=4 297 B10R0.3 CCO[C@@H](C)CCC=C(C)C 312b70b86dafc492e09af82360bc84e2 [1,1,0,0,0,0|0,0,2]=4 298 B10R0.3 CCO[C@H](C)CCC=C(C)C d649eb20379be96eaa844ec4fab7fcca [1,1,0,0,0,0|0,0,2]=4 299 B10R0.44 C#CC(C)NC(=O)C=C(C)C 1504b3f870ce71a0cfc381c92ed3ade5 [1,1,0,0,0,0|1,0,1]=4 300 B10R0.44 C#C[C@@H](C)NC(=O)C=C(C)C 09b2b9514cec5224918480cd393e6241 [1,1,0,0,0,0|1,0,1]=4 301 B10R0.44 C#C[C@H](C)NC(=O)C=C(C)C 88ca2f7c47c54a904eef7f069fbaf98a [1,1,0,0,0,0|1,0,1]=4 302 B10R0.59 C#C/C(=C/COC(C)C#C)/C 52676461aa67f1d217b250543801bfa6 [1,1,0,0,0,0|1,0,1]=4 303 B10R0.59 C#C/C(=C\COC(C)C#C)/C 67791a605a39943252f289cec8a58838 [1,1,0,0,0,0|1,0,1]=4 304 B10R0.77 C#CC(C#C)OCC=C(C)C 25c2e40b08c936d177b89f50e56fae3f [1,1,0,0,0,0|1,0,1]=4 305 B10R0.77 C#CC(C=C)OCC=C(C)C 1158d2a218958ad52d9debf6dd42b0cc [1,1,0,0,0,0|1,0,1]=4 306 B10R0.77 C#CC(CC)OC/C=C(/C)\I e944b3e6f2212802e0a87299564cf608 [1,1,0,0,0,0|2,0,0]=4 307 B10R0.77 C#CC(CC)OC/C=C(\C)/Cl c0d965cfd81c0f9d6fdc1b978f22068c [1,1,0,0,0,0|2,0,0]=4 308 B10R0.77 C#CC(CC)OCC=C(C)C b691d22f2c42e01d17b562d2a2f08b5d [1,1,0,0,0,0|1,0,0]=3 309 B10R0.77 C#CC(CC)OCC=C(C)Cl 0853bbc6575f79b3fe3f03c160ed8e0c [1,1,0,0,0,0|2,0,0]=4 310 B10R0.77 C#CC(CC)OCC=C(C)I c5812115ae57eb482cf3204732c8fd33 [1,1,0,0,0,0|2,0,0]=4 311 B10R0.77 CCC(C#N)OCC=C(C)C 43438d4e8c26c1308c142006d9e63e42 [1,1,0,0,0,0|2,0,0]=4 312 B10R0.82 C#CC(C)NCC(=O)C(=O)C 840e126465778f6889abf53148808752 [1,1,0,0,0,0|2,0,0]=4 313 B10R0.82 C#CC(C)NCC(=O)C(C)C 9d38c31af2100750216f6ca1d0d36da4 [1,1,0,0,0,0|1,0,1]=4 314 B10R0.82 C#CC(C)NCC(=O)N(C)C a4eb83b15dafcf01a8b53a38f8065ff5 [1,1,0,0,0,0|2,0,0]=4 315 B10R0.82 C#CC(C)OCC(=O)C(=O)C 6e06f8568da1e294c65d8c93351496b8 [1,1,0,0,0,0|2,0,0]=4 316 B10R0.82 C#CC(C)OCC(=O)C(C)C fca5e70a57155672d7d727490adc7978 [1,1,0,0,0,0|1,0,1]=4 317 B10R0.82 C#CC(C)OCC(=O)N(C)C 78951102064913a6aede74a85f2f84f0 [1,1,0,0,0,0|2,0,0]=4 318 B10R0.82 C#C[C@@H](C)NCC(=O)C(=O)C 6162c22b53c6d2db72db4c850f0e4b1f [1,1,0,0,0,0|2,0,0]=4 319 B10R0.82 C#C[C@@H](C)NCC(=O)C(C)C 53bf08ee551cfe90f7a03ed00c644132 [1,1,0,0,0,0|1,0,1]=4 320 B10R0.82 C#C[C@@H](C)NCC(=O)N(C)C 07df96455c2e9f964f26e3e7a650acaa [1,1,0,0,0,0|2,0,0]=4 321 B10R0.82 C#C[C@@H](C)OCC(=O)C(=O)C 3fc43e0e2dca75b769adce5b593064ab [1,1,0,0,0,0|2,0,0]=4 322 B10R0.82 C#C[C@@H](C)OCC(=O)C(C)C 4cf7d6a373e1ed6fad812fbb880698c3 [1,1,0,0,0,0|1,0,1]=4 323 B10R0.82 C#C[C@@H](C)OCC(=O)N(C)C 04cec1d78a6eb5148bfa4bb486e49a7e [1,1,0,0,0,0|2,0,0]=4 324 B10R0.82 C#C[C@H](C)NCC(=O)C(=O)C eb4942cd0a7fc19181b29a8ce26c02b4 [1,1,0,0,0,0|2,0,0]=4 325 B10R0.82 C#C[C@H](C)NCC(=O)C(C)C 616a9e236f5047dd4395b7233f80438e [1,1,0,0,0,0|1,0,1]=4 326 B10R0.82 C#C[C@H](C)NCC(=O)N(C)C 0447bb94a0319ad213deb10839bbba14 [1,1,0,0,0,0|2,0,0]=4 327 B10R0.82 C#C[C@H](C)OCC(=O)C(=O)C d0931d51abd2ee251f2401f45a56f3fe [1,1,0,0,0,0|2,0,0]=4 328 B10R0.82 C#C[C@H](C)OCC(=O)C(C)C e2f2bc44e767fd166c0149e2275e4931 [1,1,0,0,0,0|1,0,1]=4 329 B10R0.82 C#C[C@H](C)OCC(=O)N(C)C b0839e65852f07f5830e890b1e98f835 [1,1,0,0,0,0|2,0,0]=4 330 B10R0.62 C#CC(C)(C)COC/C=C/C c07377d62252dc675d62718ce9008c72 [1,1,0,0,0,0|1,0,0]=3 331 B10R0.62 C#CC(C)(C)COC/C=C/Cl 6572f19e01dffbea0c8878feed7bed44 [1,1,0,0,0,0|2,0,0]=4 332 B10R0.62 C#CC(C)(C)COC/C=C\C 587647542be08a5da2f9c23b76a9c2c0 [1,1,0,0,0,0|1,0,0]=3 333 B10R0.62 C#CC(C)(C)COC/C=C\Cl e9b5d95aa5e5ebd7d3edc7b1f9b1dde1 [1,1,0,0,0,0|2,0,0]=4 334 B10R0.62 C#CC(C)(C)NC/C=C/CC d72c5f25a699335add66f5da92431be6 [1,1,0,0,0,0|2,0,0]=4 335 B10R0.62 C/C=C/CNCC(C)(C)C#N ec77275b72214ac37d5a32888de93509 [1,1,0,0,0,0|2,0,0]=4 336 B10R0.62 C/C=C/CNCC(C)(O)CC 8f34dbbad6ad6bb91bcecf4baa311f65 [1,1,0,0,0,0|0,0,2]=4 337 B10R0.62 C/C=C/COCC(C)(C)C#N 751bba7739dcfbb38426c4052cb23a0a [1,1,0,0,0,0|2,0,0]=4 338 B10R0.62 C/C=C\CNCC(C)(C)C#N 197015b522f84a508363c220bbb4b966 [1,1,0,0,0,0|2,0,0]=4 339 B10R0.62 C/C=C\CNCC(C)(O)CC 72ebfad3a0d9afbec959cc7dc0ded126 [1,1,0,0,0,0|0,0,2]=4 340 B10R0.62 C/C=C\COCC(C)(C)C#N 79f76ce32810755ea98d3e25b74d87a5 [1,1,0,0,0,0|2,0,0]=4 341 B10R0.62 CC=CCNCC(C)(C)C#N 14a9c747ab3b8fc2d3469a8d6d099040 [1,1,0,0,0,0|2,0,0]=4 342 B10R0.62 CC=CCOCC(C)(C)C#N 67ed2737921cb7ebefe5e839021e6308 [1,1,0,0,0,0|2,0,0]=4 343 B10R0.157 C#CC(C)(CC)NC/C=C/C abcb0c142517e9c6858073ba97f1a9e0 [1,1,0,0,0,0|2,0,0]=4 344 B10R0.157 C#CC(C)(CC)NC/C=C\C 4e281d7d0673ab1272902f52d6670afb [1,1,0,0,0,0|2,0,0]=4 345 B12R0.172 CC(=CCOCC(C)(C)CC#N)C 99281da190b1cd856ef1a7dc6a2ecd97 [0,1,0,0,0,1|1,0,1]=4 346 B12R0.172 CCCC(C)(O)CNCC=C(C)C eff0a1aa5db3f8de0e9bc18cf827e0e3 [0,1,0,0,0,1|0,0,2]=4 347 B12R0.172 COCC(C)(O)CNCC=C(C)C d7d43ccf61d63edbc101209134520e6d [0,1,0,0,0,1|0,0,2]=4 348 B12R0.209 C#CC(C)(C)COCC(=O)C(=O)C 8b6386594d1642942454178aba94f99e [0,1,0,0,0,1|2,0,0]=4 349 B12R0.209 C#CC(C)(C)COCC(=O)C(C)C f6658e8cf92d6dde169f42328f656c62 [0,1,0,0,0,1|1,0,1]=4 350 B12R0.209 C#CC(C)(C)COCC(=O)N(C)C 4d9fd0f5954f2819d2d92887a3f31973 [0,1,0,0,0,1|2,0,0]=4 351 B12R0.209 C#CC(C)(C)NCCC(=O)N(C)C a5446b1711ebee561111767c9791d87c [0,1,0,0,0,1|2,0,0]=4 352 B12R0.595 C#CC(C)(C)NC(=O)CC=C(C)C 9499ca556a55d4a59acddffc1761a2a2 [0,1,0,0,0,1|1,0,1]=4 353 B12R0.692 CC(=CCNCC(C)(O)C(=O)O)C 25126572ad786ae1aa3172b7dac88afa [0,1,0,0,0,1|1,0,1]=4 354 B12R0.692 CC(=CCNC[C@@](C)(O)C(=O)O)C 909dae19fadc765fe8c0f70a53e3082d [0,1,0,0,0,1|1,0,1]=4 355 B12R0.692 CC(=CCNC[C@](C)(O)C(=O)O)C 81e421c501dc5c9c8b9f68325795f74c [0,1,0,0,0,1|1,0,1]=4 356 B12R0.692 CC(=CCOCC(C)(O)C(=O)O)C e63d7fea0fabde55a383cae5925c63bb [0,1,0,0,0,1|1,0,1]=4 357 B12R0.692 CC(=CCOC[C@@](C)(O)C(=O)O)C d356fa143caec9bf700545340b79eda0 [0,1,0,0,0,1|1,0,1]=4 358 B12R0.692 CC(=CCOC[C@](C)(O)C(=O)O)C fee4cd832196b6dd0d6668f5e8d5864a [0,1,0,0,0,1|1,0,1]=4 359 B12R0.777 C#CC(C)(CC)NCCC=C(C)C 0aa81adbb1ff91795c8faeff72b1972a [0,1,0,0,0,1|1,0,0]=3 360 B12R0.777 CC(=CCCNC(C)(CO)CO)C 0458d1155e60f2c41a7041523b2c4eff [0,1,0,0,0,1|1,0,1]=4 361 B12R0.777 CCC(C)(C#N)NCCC=C(C)C 0135f610e2860c50f43459292cf0ec3c [0,1,0,0,0,1|2,0,0]=4 362 B12R0.777 CCC(C)(CO)NCCC=C(C)C e7f8247202ef11438048fd657b7dc619 [0,1,0,0,0,1|0,0,2]=4 363 B12R0.777 CCC(O)(CC)CNCC=C(C)C 3c51448bc1df736f1ba3ef6ad99ee0e2 [0,1,0,0,0,1|0,0,2]=4 364 B12R0.777 COC(C)(CNCC=C(C)C)OC ee1bf5fdea5562e76986dc6baf6112f1 [0,1,0,0,0,1|1,0,1]=4 365 B12R0.777 COC(C)(COCC=C(C)C)OC 0e964256753b5f1c2fc02dfe9b5c1f43 [0,1,0,0,0,1|1,0,1]=4 366 B12R0.38 C#CC(CC)(CC)NCC=C(C)C c382c149255d8ef3a83bb6caf6889878 [0,2,0,0,0,0|2,0,0]=4 367 B10R1.31 C#CC1CCN(C1)C(=O)C dc97f80027fe77b2a0ff1bbeb578b0f0 [1,0,0,1,0,0|2,0,0]=4 368 B10R1.31 C#CC1CCN(C1)C(C)C a32682f9be40b30774cf17c72d148142 [1,0,0,1,0,0|1,0,1]=4 369 B10R1.156 C#C[C@H]1C[C@H]1COC(C)C 6b59376a532a7d0a14b11480404cb5ee [1,0,0,1,0,0|1,0,1]=4 370 B10R1.459 C#CC1(CC1)NC/C=C/C 45a4880ec80a3a81a3efc09791b47969 [1,0,0,1,0,0|2,0,0]=4 371 B10R1.459 C#CC1(CC1)NC/C=C\C 7c9e5c2d4f00accc23b9c7ca188c16e3 [1,0,0,1,0,0|2,0,0]=4 372 B12R1.671 C#CC1(CC1)COC/C=C(/C)\I 2eae036455dfa55c12efa4e42eb6a91c [0,0,0,1,0,1|2,0,0]=4 373 B12R1.671 C#CC1(CC1)COC/C=C(\C)/Cl e48273b51dc6a3c714011125dd93bfec [0,0,0,1,0,1|2,0,0]=4 374 B12R1.671 C#CC1(CC1)COCC=C(C)C 7a77698d39d05532edc9d9017924b867 [0,0,0,1,0,1|1,0,0]=3 375 B12R1.671 C#CC1(CC1)COCC=C(C)Cl 499a735af0adb376672bdef5fa534ce3 [0,0,0,1,0,1|2,0,0]=4 376 B12R1.671 C#CC1(CC1)COCC=C(C)I 7600e26014d1ffe2024e71b9d94e5f7b [0,0,0,1,0,1|2,0,0]=4 377 B12R1.671 C#CC1(CC1)NCCC=C(C)C 65476e95876aa56a808b51c829fd7827 [0,0,0,1,0,1|1,0,0]=3 378 B12R1.671 CC(=CCCNC1(CC1)C#N)C a915cb17b41454797fcced9b0b596620 [0,0,0,1,0,1|2,0,0]=4 379 B12R1.671 CC(=CCNCC1(CC1)C#N)C 9b97cf7923b01e49e9ad0526b921568f [0,0,0,1,0,1|2,0,0]=4 380 B12R1.671 CC(=CCOCC1(CC1)C#N)C 8f247cad6cf0e43345f784a65c56a94c [0,0,0,1,0,1|2,0,0]=4 381 B12R1.1806 CC(=CCN1CCC(C1)(C)O)C bbd3b22b5f717969def15145e365cded [0,0,0,1,0,1|0,0,2]=4 382 B12R1.1806 CC(=CCN1CC[C@@](C1)(C)O)C 75d403f83834855c6c7931ce921310d6 [0,0,0,1,0,1|0,0,2]=4 383 B12R1.1806 CC(=CCN1CC[C@](C1)(C)O)C c1bc2ef581362d2ea2b4a11afc0f90d8 [0,0,0,1,0,1|0,0,2]=4 384 B12R1.2795 CC(=CCNCC1(CCC1)O)C 6407f922233ffe987a224ba353afe567 [0,0,0,1,0,1|0,0,2]=4 385 B12R1.2795 CC(=CCNCC1(CCO1)C)C 0cae957315cf556135f8b1efac62a320 [0,0,0,1,0,1|0,0,2]=4 386 B12R1.2795 CC(=CCNCC1(COC1)O)C 413e8f9f4193694acc86d11dc34c24d2 [0,0,0,1,0,1|1,0,1]=4 387 B12R1.2795 CC(=CCNC[C@@]1(CCO1)C)C 26248f814d91ef524ceaa161f14d8a1b [0,0,0,1,0,1|0,0,2]=4 388 B12R1.2795 CC(=CCOCC1(CCO1)C)C 41791dbe6a3f30f2b1e2ae555afdff58 [0,0,0,1,0,1|0,0,2]=4 389 B12R1.2795 CC(=CCOC[C@@]1(CCO1)C)C 0e11f63276fa530516a40508e1a73069 [0,0,0,1,0,1|0,0,2]=4 390 B12R1.2795 CC(=CCOC[C@]1(CCO1)C)C 46e96c61f56b050458f23122a776260a [0,0,0,1,0,1|0,0,2]=4 391 B12R1.2372 C#CC1(CCC1)NCC=C(C)C 7bcc4ff58cf57c4cb109a335cfca586c [0,1,0,1,0,0|2,0,0]=4 392 B12R1.2372 CC(=CCNC1(COC1)C#N)C 38d5dda91bdf23373d62da8bd47d634b [0,1,0,1,0,0|2,0,0]=4 393 B12R1.3825 C#CC1(CCN(CC1)C(=O)C)O ba08a583ad326c7a47fe89105a00638c [0,1,0,1,0,0|2,0,0]=4 394 B12R1.3825 C#CC1(CCN(CC1)C(C)C)O 2a3eda78f6ee8158d58ba5bf5107c686 [0,1,0,1,0,0|1,0,1]=4 395 B8R0.9 C#CC(C)NCC(=C)C 3c758ba66f1d4e22728571c79086a78d [1,0,0,0,1,0|1,0,1]=4 396 B8R0.9 C#CC(C)NCC(=O)C 2ad4abc709ed22d0c1fc1e2c701880d0 [1,0,0,0,1,0|2,0,0]=4 397 B8R0.9 C#CC(C)NCC(C)C cfe23ec62a3911082f3ed433c3ee66ea [1,0,0,0,1,0|1,0,1]=4 398 B8R0.9 C#CC(C)NCN(C)C 6aad76689671f32329e84262d28f10a3 [1,0,0,0,1,0|2,0,0]=4 399 B8R0.9 C#CC(C)OCC(=C)C 432afa141f4d1c48f573032fcced50ce [1,0,0,0,1,0|1,0,1]=4 400 B8R0.9 C#CC(C)OCC(=O)C 882d251e5156962e635e367fb9e2389a [1,0,0,0,1,0|2,0,0]=4 401 B8R0.9 C#CC(C)OCC(C)C 4e1770b79e2f61d0e14aeb5599c8e220 [1,0,0,0,1,0|1,0,1]=4 402 B8R0.9 C#CC(C)OCN(C)C b90e1ef250f4b9707ea34af1f3e17240 [1,0,0,0,1,0|2,0,0]=4 403 B8R0.9 C#C[C@@H](C)NCC(=C)C 8482d686ae65a2ca7dff67042ac29f41 [1,0,0,0,1,0|1,0,1]=4 404 B8R0.9 C#C[C@@H](C)NCC(C)C 3ce0c7192faaabd606400fd4e57b375b [1,0,0,0,1,0|1,0,1]=4 405 B8R0.9 C#C[C@@H](C)NCN(C)C f29cba85f76f94ad40e6cd68054d2799 [1,0,0,0,1,0|2,0,0]=4 406 B8R0.9 C#C[C@@H](C)OCC(=C)C 2d968489af824d2a5009d0b6f33687cb [1,0,0,0,1,0|1,0,1]=4 407 B8R0.9 C#C[C@@H](C)OCC(C)C 17261cccf0d6bcb756dde6b084074aff [1,0,0,0,1,0|1,0,1]=4 408 B8R0.9 C#C[C@@H](C)OCN(C)C 72b62fe6bdc4544eda2b4267ed991db5 [1,0,0,0,1,0|2,0,0]=4 409 B8R0.9 C#C[C@H](C)NCC(=C)C 29e1ce6d9d2c5511b3a4eb39b7ee92ab [1,0,0,0,1,0|1,0,1]=4 410 B8R0.9 C#C[C@H](C)NCC(C)C 1b0066db888c517794f7b221736c35c4 [1,0,0,0,1,0|1,0,1]=4 411 B8R0.9 C#C[C@H](C)NCN(C)C 198970a5f11df83523107a9d8d883c85 [1,0,0,0,1,0|2,0,0]=4 412 B8R0.9 C#C[C@H](C)OCC(=C)C c7ee8e98fca87cc82a9a1ca56d44b7dd [1,0,0,0,1,0|1,0,1]=4 413 B8R0.9 C#C[C@H](C)OCC(C)C f2136a220d3845725721b2d249ed75d8 [1,0,0,0,1,0|1,0,1]=4 414 B8R0.9 C#C[C@H](C)OCN(C)C 057feae5df2fe86e3a9b4069303dc41a [1,0,0,0,1,0|2,0,0]=4 415 B10R0.55 C#CC(C)NC/C=C/C(C)C 3a15902e95fe84cfd70ea88e6beae599 [1,0,0,0,0,1|0,0,2]=4 416 B10R0.55 C#CC(C)NCCC=C(C)C 2c271b6edaa7e3752660239b2a9be78b [1,0,0,0,0,1|0,0,0]=2 417 B10R0.55 C#CC(C)NCCC=C(F)F 94c92631b9ade23cf416e80c2440a708 [1,0,0,0,0,1|2,0,0]=4 418 B10R0.55 C#CC(C)NCCCC(=C)C fbeec4d2ced39242b2959a4079d427aa [1,0,0,0,0,1|0,0,2]=4 419 B10R0.55 C#CC(C)NCCCC(=O)C d58c0f43d0cbf1325e07f044050b4cd9 [1,0,0,0,0,1|1,0,1]=4 420 B10R0.55 C#CC(C)NCCCC(C)C b995678ac4e53466c2251c03c626682d [1,0,0,0,0,1|0,0,2]=4 421 B10R0.55 C#CC(C)NCCCN(C)C b20e21933dd7ec606fc00e1251157973 [1,0,0,0,0,1|1,0,1]=4 422 B10R0.55 C#CC(C)NCCNC(=O)C 397c8c2f935314357657779641f9472c [1,0,0,0,0,1|2,0,0]=4 423 B10R0.55 C#CC(C)NCCOC(=O)C 60bff41439a85bdb848740cf737a506e [1,0,0,0,0,1|2,0,0]=4 424 B10R0.55 C#CC(C)NCCOC(C)C c694d2bdf83cd97a9e0297d7bed1ef71 [1,0,0,0,0,1|1,0,1]=4 425 B10R0.55 C#CC(C)NCCSC(=O)C 6698236fb5f68116f1d77e2ecf455155 [1,0,0,0,0,1|2,0,0]=4 426 B10R0.55 C#CC(C)NCCSC(C)C c38091a8c38110daccb0674d1227472d [1,0,0,0,0,1|1,0,1]=4 427 B10R0.55 C#CC(C)OC/C=C/C(C)C bd134e1a35dfc5d4f554c4c5c04ebc48 [1,0,0,0,0,1|0,0,2]=4 428 B10R0.55 C#CC(C)OCCC=C(C)C 6dce8f1b1029b5bc211373829fa6df2e [1,0,0,0,0,1|0,0,0]=2 429 B10R0.55 C#CC(C)OCCC=C(F)F 50fe939f4f9e3ae8515584b8f5e0b884 [1,0,0,0,0,1|2,0,0]=4 430 B10R0.55 C#CC(C)OCCCC(=C)C 980e1a339b1c5e76edf9a77003ba257f [1,0,0,0,0,1|0,0,2]=4 431 B10R0.55 C#CC(C)OCCCC(=O)C ca999004048c9bd6f0105ee0be748061 [1,0,0,0,0,1|1,0,1]=4 432 B10R0.55 C#CC(C)OCCCC(C)C 9b7f82e0653dde55228d0eb36e7e1776 [1,0,0,0,0,1|0,0,2]=4 433 B10R0.55 C#CC(C)OCCCN(C)C d73f7ebfe93ba33143f53499c27eb514 [1,0,0,0,0,1|1,0,1]=4 434 B10R0.55 C#CC(C)OCCNC(=O)C 13a77d017b6956df606161c31fa98281 [1,0,0,0,0,1|2,0,0]=4 435 B10R0.55 C#CC(C)OCCOC(=O)C c34cdbf4d9bc9d28e2ee1c8f993fa497 [1,0,0,0,0,1|2,0,0]=4 436 B10R0.55 C#CC(C)OCCOC(C)C ac985770f5b395d471eaba104140decb [1,0,0,0,0,1|1,0,1]=4 437 B10R0.55 C#CC(C)OCCSC(=O)C 935686a74d13bc1a2749938f11e54143 [1,0,0,0,0,1|2,0,0]=4 438 B10R0.55 C#CC(C)OCCSC(C)C 4899cc6300adf61521b2e5c37904d1a3 [1,0,0,0,0,1|1,0,1]=4 439 B10R0.55 C#C[C@@H](C)NC/C=C/C(C)C dc080472306f0080a56c20a1d5ef1876 [1,0,0,0,0,1|0,0,2]=4 440 B10R0.55 C#C[C@@H](C)NCCC=C(C)C 07fdb021f7b7bcced3b54ecca5577728 [1,0,0,0,0,1|0,0,0]=2 441 B10R0.55 C#C[C@@H](C)NCCC=C(F)F 9a233c9f5403406842e8d65a4e5ec6f7 [1,0,0,0,0,1|2,0,0]=4 442 B10R0.55 C#C[C@@H](C)NCCCC(=C)C c04a5f89516e4830ac91c3ffc6b4d51c [1,0,0,0,0,1|0,0,2]=4 443 B10R0.55 C#C[C@@H](C)NCCCC(=O)C 3461826145678749a7a0f0d6b7fe5bcd [1,0,0,0,0,1|1,0,1]=4 444 B10R0.55 C#C[C@@H](C)NCCCC(C)C e17ce58939c103bf7bcd01a916d8db41 [1,0,0,0,0,1|0,0,2]=4 445 B10R0.55 C#C[C@@H](C)NCCCN(C)C 6eb51a8c3d17252826df6ae4d0dac53e [1,0,0,0,0,1|1,0,1]=4 446 B10R0.55 C#C[C@@H](C)NCCNC(=O)C 10b084f5535392af618d12f47bfdae07 [1,0,0,0,0,1|2,0,0]=4 447 B10R0.55 C#C[C@@H](C)NCCOC(=O)C 5975aa57e96b0637e094701838299545 [1,0,0,0,0,1|2,0,0]=4 448 B10R0.55 C#C[C@@H](C)NCCOC(C)C ab97d025c0a4cfaa828216d8891de986 [1,0,0,0,0,1|1,0,1]=4 449 B10R0.55 C#C[C@@H](C)NCCSC(=O)C 996d103bdce9b8c066a5b7820ef2cffc [1,0,0,0,0,1|2,0,0]=4 450 B10R0.55 C#C[C@@H](C)NCCSC(C)C db6ea72ed42b8c9fe569aa229f949d7f [1,0,0,0,0,1|1,0,1]=4 451 B10R0.55 C#C[C@@H](C)OC/C=C/C(C)C 2c2d2f2f6a15bed572e8c2212fce9e0e [1,0,0,0,0,1|0,0,2]=4 452 B10R0.55 C#C[C@@H](C)OCCC=C(C)C 9e2fbca83e65dcfa5fa31b374102b214 [1,0,0,0,0,1|0,0,0]=2 453 B10R0.55 C#C[C@@H](C)OCCC=C(F)F b790d40446b81eeb27b6fd20d5ae45b9 [1,0,0,0,0,1|2,0,0]=4 454 B10R0.55 C#C[C@@H](C)OCCCC(=C)C 05dddfea28921435c31bb5d2cadd6912 [1,0,0,0,0,1|0,0,2]=4 455 B10R0.55 C#C[C@@H](C)OCCCC(=O)C a60b595cd836eb22e1a58ce9c15a803d [1,0,0,0,0,1|1,0,1]=4 456 B10R0.55 C#C[C@@H](C)OCCCC(C)C df12cc8e9075bee5305898eb1b7bb313 [1,0,0,0,0,1|0,0,2]=4 457 B10R0.55 C#C[C@@H](C)OCCCN(C)C f28d043b28285d725d4b4a6abb113388 [1,0,0,0,0,1|1,0,1]=4 458 B10R0.55 C#C[C@@H](C)OCCNC(=O)C 63d49b075c001b97ede374c691732fad [1,0,0,0,0,1|2,0,0]=4 459 B10R0.55 C#C[C@@H](C)OCCOC(=O)C 6f1ce9a389283c58b66ffdde48cc66ba [1,0,0,0,0,1|2,0,0]=4 460 B10R0.55 C#C[C@@H](C)OCCOC(C)C 6a57f71977398e8b53ac93b31c05cf42 [1,0,0,0,0,1|1,0,1]=4 461 B10R0.55 C#C[C@@H](C)OCCSC(=O)C 6f5d23250ffc38dc304dfa49bb54f35f [1,0,0,0,0,1|2,0,0]=4 462 B10R0.55 C#C[C@@H](C)OCCSC(C)C 0ddd01c92ee0aa49a1d72a6dc698305f [1,0,0,0,0,1|1,0,1]=4 463 B10R0.55 C#C[C@H](C)NC/C=C/C(C)C 206faf0eac2afd64d8e6359b620f94b0 [1,0,0,0,0,1|0,0,2]=4 464 B10R0.55 C#C[C@H](C)NCCC=C(C)C 2a8894f24cd8a1ea318ebf061d859e11 [1,0,0,0,0,1|0,0,0]=2 465 B10R0.55 C#C[C@H](C)NCCC=C(F)F 21d7c3c511d5e601dfb4eb589cbe4e2c [1,0,0,0,0,1|2,0,0]=4 466 B10R0.55 C#C[C@H](C)NCCCC(=C)C 8d7ff853f9b6b478f1d7214d9031fa75 [1,0,0,0,0,1|0,0,2]=4 467 B10R0.55 C#C[C@H](C)NCCCC(=O)C 3d5cbdc980ff3af380492e0523175722 [1,0,0,0,0,1|1,0,1]=4 468 B10R0.55 C#C[C@H](C)NCCCC(C)C 9a32a05563c81d41f285e875b20796d9 [1,0,0,0,0,1|0,0,2]=4 469 B10R0.55 C#C[C@H](C)NCCCN(C)C 038f1247b06095e65102cf590aafb55d [1,0,0,0,0,1|1,0,1]=4 470 B10R0.55 C#C[C@H](C)NCCNC(=O)C 4d737a8e702466767adcfd39943b576f [1,0,0,0,0,1|2,0,0]=4 471 B10R0.55 C#C[C@H](C)NCCOC(=O)C 51981f1684fbee0a50d0303a81794d4a [1,0,0,0,0,1|2,0,0]=4 472 B10R0.55 C#C[C@H](C)NCCOC(C)C 193dec9fa756ad1ce22358bd79f194d0 [1,0,0,0,0,1|1,0,1]=4 473 B10R0.55 C#C[C@H](C)NCCSC(=O)C b8b2e4d30e3b9fd79082f155b1ec4dc7 [1,0,0,0,0,1|2,0,0]=4 474 B10R0.55 C#C[C@H](C)NCCSC(C)C 65f6bd9799e9f7e7db7bfb9da80536e9 [1,0,0,0,0,1|1,0,1]=4 475 B10R0.55 C#C[C@H](C)OC/C=C/C(C)C 5a194420275a0d932ff58dd0561ef214 [1,0,0,0,0,1|0,0,2]=4 476 B10R0.55 C#C[C@H](C)OCCC=C(C)C ae6d21eef6be54c153d1b3f1bc3211b5 [1,0,0,0,0,1|0,0,0]=2 477 B10R0.55 C#C[C@H](C)OCCC=C(F)F c705f7b0cf328eb600f79e784d5f0b3f [1,0,0,0,0,1|2,0,0]=4 478 B10R0.55 C#C[C@H](C)OCCCC(=C)C f9f8bcd660a1d30782fa5c13e6c9121c [1,0,0,0,0,1|0,0,2]=4 479 B10R0.55 C#C[C@H](C)OCCCC(=O)C 4c4868b9089273daaaee6de18ed5d28a [1,0,0,0,0,1|1,0,1]=4 480 B10R0.55 C#C[C@H](C)OCCCC(C)C 33172805aa44d0a78e38ab41fdcbbdc1 [1,0,0,0,0,1|0,0,2]=4 481 B10R0.55 C#C[C@H](C)OCCCN(C)C c8163bfbd99de1d2d12841b67bb29636 [1,0,0,0,0,1|1,0,1]=4 482 B10R0.55 C#C[C@H](C)OCCNC(=O)C 22b68788d91ef2736132440811663795 [1,0,0,0,0,1|2,0,0]=4 483 B10R0.55 C#C[C@H](C)OCCOC(=O)C 865c44970efa43489c96181723ac9919 [1,0,0,0,0,1|2,0,0]=4 484 B10R0.55 C#C[C@H](C)OCCOC(C)C d33db88f85d7be58bf974f3aadef5c28 [1,0,0,0,0,1|1,0,1]=4 485 B10R0.55 C#C[C@H](C)OCCSC(=O)C a99f3721de7702934f9952d9e6f0cc01 [1,0,0,0,0,1|2,0,0]=4 486 B10R0.55 C#C[C@H](C)OCCSC(C)C ec56f0a2e1965312b2d785c4e15d6f25 [1,0,0,0,0,1|1,0,1]=4 487 B10R0.55 C/C(=C/CNCC(C)C#N)/I 0d5cb0682acb20f7e2514de3e49f1608 [1,0,0,0,0,1|2,0,0]=4 488 B10R0.55 C/C(=C/COCC(C)C#N)/Cl 4ef372b1d4868ef556ae6da841c61b65 [1,0,0,0,0,1|2,0,0]=4 489 B10R0.55 C/C(=C/COCC(C)C#N)/I d381a983198f987db370364a424ac305 [1,0,0,0,0,1|2,0,0]=4 490 B10R0.55 C/C(=C\CNCC(C)C#N)/Cl 3831cc484710b8f358aabf2e925190f6 [1,0,0,0,0,1|2,0,0]=4 491 B10R0.55 C/C(=C\COCC(C)C#N)/Cl 6e9db845b132b6a16d77408d33a51f2a [1,0,0,0,0,1|2,0,0]=4 492 B10R0.55 C=CC(C)COCC=C(C)C 5f58ea9a4f68397773c52e5acd7bd11a [1,0,0,0,0,1|0,0,2]=4 493 B10R0.55 C=CC(C)NCCC=C(C)C cbc634ae1b03b65d1fec8e950540ebe0 [1,0,0,0,0,1|0,0,2]=4 494 B10R0.55 C=CC(C)OCCC=C(C)C 4e94195491f18db55d379be00231e486 [1,0,0,0,0,1|0,0,2]=4 495 B10R0.55 C=CC(O)CNCC=C(C)C 1514391fe1cf062040d0e570dbffa9de [1,0,0,0,0,1|0,0,2]=4 496 B10R0.55 C=C[C@H](C)OCCC=C(C)C d352fbc0dcfd0cb763614da79cd21375 [1,0,0,0,0,1|0,0,2]=4 497 B10R0.55 CC(=CCCNC(C)C#N)C 633724e7886837ffbf005d9f04f01135 [1,0,0,0,0,1|1,0,0]=3 498 B10R0.55 CC(=CCCNC(C)CO)C 7d126b735c99295d528e280edfd2a888 [1,0,0,0,0,1|1,0,1]=4 499 B10R0.55 CC(=CCCN[C@@H](C)CO)C d086d807f183e6a194da5b993d35cc0b [1,0,0,0,0,1|1,0,1]=4 500 B10R0.55 CC(=CCCN[C@H](C)CO)C ab1cd57c53c23a5e88fa24d13286b4a0 [1,0,0,0,0,1|1,0,1]=4 501 B10R0.55 CC(=CCCOC(C)C=O)C 2ba9aedd9ca5c23db256a7b333b91370 [1,0,0,0,0,1|1,0,1]=4 502 B10R0.55 CC(=CCCOC(C)CF)C 4332a7b91b7bd6817faf81f947cf049e [1,0,0,0,0,1|1,0,1]=4 503 B10R0.55 CC(=CCCOC(C)CS)C f32e949c155560cdad7d126662a278e9 [1,0,0,0,0,1|1,0,1]=4 504 B10R0.55 CC(=CCCO[C@H](C)CS)C 2c64bb5cc1d9db7e1613782f70287ec5 [1,0,0,0,0,1|1,0,1]=4 505 B10R0.55 CC(=CCNCC(C)C#N)C eece33f7286530f7ea7503a0ffd63da7 [1,0,0,0,0,1|1,0,0]=3 506 B10R0.55 CC(=CCNCC(C)C#N)Cl 4a8c0d6fe8faeb0a1608ccb645e8907b [1,0,0,0,0,1|2,0,0]=4 507 B10R0.55 CC(=CCNCC(C)C#N)I 0efab93e3e24508df40fc61ccfe30d40 [1,0,0,0,0,1|2,0,0]=4 508 B10R0.55 CC(=CCNCC(C)CO)C be35f7c59acb862ef88dc20e563d1cad [1,0,0,0,0,1|1,0,1]=4 509 B10R0.55 CC(=CCNCC(O)CF)C 1a98221c463183090d6b529e9cbe426f [1,0,0,0,0,1|1,0,1]=4 510 B10R0.55 CC(=CCNCC(O)CO)C 13d46259b039bf532a2ffe2d84c96a03 [1,0,0,0,0,1|1,0,1]=4 511 B10R0.55 CC(=CCNC[C@@H](C)CO)C 8366945f9b50e0ee0f85a0ff8c196436 [1,0,0,0,0,1|1,0,1]=4 512 B10R0.55 CC(=CCNC[C@@H](O)CO)C 1005bc927fa6dd6e75499a7a4b56f605 [1,0,0,0,0,1|1,0,1]=4 513 B10R0.55 CC(=CCNC[C@H](C)CO)C 00fd4b2088356517fba96b6eeea82094 [1,0,0,0,0,1|1,0,1]=4 514 B10R0.55 CC(=CCNC[C@H](O)CO)C eb7caa8ab6317817befd2678011409fc [1,0,0,0,0,1|1,0,1]=4 515 B10R0.55 CC(=CCOCC(C)C#N)C 474ee143f194720f78e67c5521296fb7 [1,0,0,0,0,1|1,0,0]=3 516 B10R0.55 CC(=CCOCC(C)C#N)Cl 75244785119166400c806fc9cbe82a8e [1,0,0,0,0,1|2,0,0]=4 517 B10R0.55 CC(=CCOCC(C)C#N)I c523e2150bbf92094355299aa900238b [1,0,0,0,0,1|2,0,0]=4 518 B10R0.55 CC(=CCOCC(O)CO)C 3a7e344c5a2e9a3aeced13ed6066dec7 [1,0,0,0,0,1|1,0,1]=4 519 B10R0.55 CC(=CCOC[C@@H](O)CO)C f9255eededd5302e5ad9c23de823e915 [1,0,0,0,0,1|1,0,1]=4 520 B10R0.55 CC(=CCOC[C@H](O)CO)C e37353fbecd9f71b350ef5043d833919 [1,0,0,0,0,1|1,0,1]=4 521 B10R0.55 CCC(C)CNCC=C(C)C ffa701d3d34a865cd1ecb23e3ebbdaa3 [1,0,0,0,0,1|0,0,2]=4 522 B10R0.55 CCC(C)COCC=C(C)C 99a635a6f6a5714acbb0b00c9414a1b6 [1,0,0,0,0,1|0,0,2]=4 523 B10R0.55 CCC(C)NCCC=C(C)C ba3dc1a87c3553e1c0bacc83f640dd4d [1,0,0,0,0,1|0,0,2]=4 524 B10R0.55 CCC(C)OCCC=C(C)C 5cea97fc6782ef84fa429a124dab70c0 [1,0,0,0,0,1|0,0,2]=4 525 B10R0.55 CCC(O)CNCC=C(C)C f202571dfa60cc6e9c60e97601011604 [1,0,0,0,0,1|0,0,2]=4 526 B10R0.55 CC[C@@H](C)CNCC=C(C)C 7f4c145fc9e75ce19b53dc7b3fb9723d [1,0,0,0,0,1|0,0,2]=4 527 B10R0.55 CC[C@@H](C)COCC=C(C)C ebd9ecbff29c416f359c5cc5ed259a5d [1,0,0,0,0,1|0,0,2]=4 528 B10R0.55 CC[C@@H](C)NCCC=C(C)C 5c134060e89a54d0b3d7fe82bf44e921 [1,0,0,0,0,1|0,0,2]=4 529 B10R0.55 CC[C@@H](C)OCCC=C(C)C 9b3684505e197a206fdd6de8c7108917 [1,0,0,0,0,1|0,0,2]=4 530 B10R0.55 CC[C@@H](O)CNCC=C(C)C 47c0856cf8ccdd48a6bd885536d0d5da [1,0,0,0,0,1|0,0,2]=4 531 B10R0.55 CC[C@H](C)CNCC=C(C)C 8722d36aa8c54ca9fa9e4f41cf0f5bac [1,0,0,0,0,1|0,0,2]=4 532 B10R0.55 CC[C@H](C)COCC=C(C)C 51b90520c22f6a76c29b07b45947b9d2 [1,0,0,0,0,1|0,0,2]=4 533 B10R0.55 CC[C@H](C)NCCC=C(C)C bf71572a55829c6e656f7b5a583789fd [1,0,0,0,0,1|0,0,2]=4 534 B10R0.55 CC[C@H](C)OCCC=C(C)C 850ba5da341dd7dccfc56d41e13bee03 [1,0,0,0,0,1|0,0,2]=4 535 B10R0.55 COC(C)CNCC=C(C)C 7850434b51e803978476de556a650d38 [1,0,0,0,0,1|1,0,1]=4 536 B10R0.55 COC(C)COCC=C(C)C dd1aebbb4fde80105b9fb1c2c85ee13c [1,0,0,0,0,1|1,0,1]=4 537 B10R0.55 CO[C@@H](C)CNCC=C(C)C 8d9aa5332da96f1fca02122bf5f64f16 [1,0,0,0,0,1|1,0,1]=4 538 B10R0.55 CO[C@@H](C)COCC=C(C)C ce95d6372a8725f32ffc3ce459e6deae [1,0,0,0,0,1|1,0,1]=4 539 B10R0.55 CO[C@H](C)CNCC=C(C)C 5d6571984dedd5d7760e51a60d26a92a [1,0,0,0,0,1|1,0,1]=4 540 B10R0.55 CO[C@H](C)COCC=C(C)C a158de9285cf031a5ba709f2b3177d70 [1,0,0,0,0,1|1,0,1]=4 541 B10R0.15 C/C(=C/CNCC(C)(C)O)/I 47fd0a8d9cbc761d6075f1989dd5daaf [1,0,0,0,0,1|1,0,1]=4 542 B10R0.15 C/C(=C/COCC(C)(C)O)/Cl 84a5c61e722039be4e117609e18596b6 [1,0,0,0,0,1|1,0,1]=4 543 B10R0.15 C/C(=C/COCC(C)(C)O)/I d762c0939b8a048a0503787ffa457f2e [1,0,0,0,0,1|1,0,1]=4 544 B10R0.15 C/C(=C\CNCC(C)(C)O)/Cl 04808bd301687f093b5a47785f8fa745 [1,0,0,0,0,1|1,0,1]=4 545 B10R0.15 CC(=CCCNC(C)(C)C)C 5a93b78b9c792d905389eef51459f1c2 [1,0,0,0,0,1|1,0,1]=4 546 B10R0.15 CC(=CCNCC(C)(C)C)C eed8d2f5c4869cb80f34ab148d118d97 [1,0,0,0,0,1|1,0,1]=4 547 B10R0.15 CC(=CCNCC(C)(C)F)C d7d4c642e689232ddd43c8fe5313959b [1,0,0,0,0,1|1,0,1]=4 548 B10R0.15 CC(=CCNCC(C)(C)O)C e1278f1d77025ec40a3ff0a7e5b7231c [1,0,0,0,0,1|0,0,1]=3 549 B10R0.15 CC(=CCNCC(C)(C)O)Cl 0a86769fdb9c46854a6c94383c11ec32 [1,0,0,0,0,1|1,0,1]=4 550 B10R0.15 CC(=CCNCC(C)(C)O)I ff6f255a97d2a5ca289c96b491ba9647 [1,0,0,0,0,1|1,0,1]=4 551 B10R0.15 CC(=CCNCC(C)(F)F)C d5b624b5272ccfe00f55e2581267faf3 [1,0,0,0,0,1|2,0,0]=4 552 B10R0.15 CC(=CCOCC(C)(C)Br)C 9e9d9bfe773f418337c929511afe198e [1,0,0,0,0,1|1,0,1]=4 553 B10R0.15 CC(=CCOCC(C)(C)C)C a3255ef4174f70951bda5a8a496293c4 [1,0,0,0,0,1|1,0,1]=4 554 B10R0.15 CC(=CCOCC(C)(C)F)C d759813bbeddff8112ec06f9f5e1fe39 [1,0,0,0,0,1|1,0,1]=4 555 B10R0.15 CC(=CCOCC(C)(C)O)C 2ba4c1f029a488e0ab6030ed314d8c3e [1,0,0,0,0,1|0,0,1]=3 556 B10R0.15 CC(=CCOCC(C)(C)O)I e019eabc7f4c901f9cdd60dc5a1bc661 [1,0,0,0,0,1|1,0,1]=4 557 B10R0.15 CC(=CCOCC(C)(C)S)C f93aeb302903a1329cf93d662cdb63a3 [1,0,0,0,0,1|0,1,1]=4 558 B10R0.15 CC(=CCOCC(C)(F)F)C ba16dc036735f1605ef0fab0c6d850be [1,0,0,0,0,1|2,0,0]=4 559 B12R0.210 C#CC(C)(C)COC/C=C/C(C)C 4c4e7f2b2817dabae73794426548a19a [0,0,0,0,0,2|1,0,1]=4 560 B12R0.210 C#CC(C)(C)COCCC=C(C)C 91ab0d41479202183b12421af0029316 [0,0,0,0,0,2|1,0,0]=3 561 B12R0.210 CC(=CCCNCC(C)(C)C#N)C 4df2cd34f6171f1aa97b7bd5d2104c23 [0,0,0,0,0,2|2,0,0]=4 562 B12R0.210 CC(=CCCOCC(C)(C)C#N)C bf571cc13303216a8383dfeee1e20fb3 [0,0,0,0,0,2|2,0,0]=4 563 B12R0.210 CC(=CCOCCC(C)(C)C#N)C 8f3ca726d2baac61ca89f767ca8ae3c7 [0,0,0,0,0,2|2,0,0]=4 564 B12R0.210 CCC(C)(O)CNCCC=C(C)C 2f4850fe6e365dd6a4b013b1d5b4e892 [0,0,0,0,0,2|0,0,2]=4