0 B7R1.1 CCN1CC=CC1 6c4c19a4974c3e71b2e06f869bc9eb5b [0,1,0,0,0,0|2,0,1]=4 1 B7R1.1 FCN1CC=CC1 80d57499f25a891f36d281c50e71854c [0,1,0,0,0,0|2,0,1]=4 2 B7R1.1 OCN1CC=CC1 7ff6422db20fb244739472dbcdc32e4d [0,1,0,0,0,0|2,0,1]=4 3 B6R0.1 C=CCN(C)C=O 45f12923080415e1dfc85b1fcae28d16 [0,1,1,0,0,0|2,0,0]=4 4 B6R0.1 C=CCN(C)CO e638b434bf874996eb81f2689695f38f [0,1,1,0,0,0|1,0,1]=4 5 B6R0.4 C=C(C)CNC=O 0d0687e6ed98c39501c4c0fd9c1a287e [0,1,1,0,0,0|2,0,0]=4 6 B6R0.4 C=C(C)COCC 6d74b37620be58d1bea5b1911ab2feb1 [0,1,1,0,0,0|0,0,2]=4 7 B6R0.4 C=C(C)COCF cb102a3037e49fdd230dfa87a9a6cd9a [0,1,1,0,0,0|1,0,1]=4 8 B6R0.4 C=CCOC(C)C 041109637968f56803a7bcb6b6bd0ab7 [0,1,1,0,0,0|0,0,2]=4 9 B6R0.6 C/C=C/COCC 38bee8c8a9ca6a51c65d50ef4a373d85 [0,1,1,0,0,0|0,0,2]=4 10 B6R0.6 C/C=C\COCC ec2c513a47c68c3910a66e2b1ca05a58 [0,1,1,0,0,0|0,0,2]=4 11 B6R0.6 C=CCCOCC 6e23d9941af9b2d0c85f8cbdda9dfc6d [0,1,1,0,0,0|0,0,2]=4 12 B6R0.6 C=CCOCCC 1dbb1c31b2e886af57d9e977bbb54c80 [0,1,1,0,0,0|0,0,2]=4 13 B6R0.6 C=CCOCCF 5c80aaae5b6c5ce04c06e7032d640ec0 [0,1,1,0,0,0|0,0,2]=4 14 B6R0.6 C=CCOCCS 0645f95678036203e123867906f767b0 [0,1,1,0,0,0|0,0,2]=4 15 B6R0.6 C=CCOCOC 10a689a63bf52a96b5eea3af932877d6 [0,1,1,0,0,0|0,0,2]=4 16 B6R0.6 CC=CCNC=O 4f8730c7216653a335fe81630ffa3901 [0,1,1,0,0,0|0,0,2]=4 17 B6R0.6 CC=CCNCO c2d6aa2f6263348f8e93d5ad39fb9704 [0,1,1,0,0,0|0,0,2]=4 18 B6R0.6 CC=CCOCC 1bf4842cf68ff7130be8f9549d740c80 [0,1,1,0,0,0|0,0,2]=4 19 B6R0.6 CCOC/C=C/Cl da3696907b7fb9db442b9b20d9bcb8d2 [0,1,1,0,0,0|0,0,2]=4 20 B6R0.6 CCOCC=CCl c81d128531002285a68f4ce8014c7151 [0,1,1,0,0,0|0,0,2]=4 21 B8R1.8 CCNc1cc[nH]n1 1ec90843b0b722deac22a6d0b9230c30 [0,2,0,0,0,0|2,0,0]=4 22 B8R1.8 CCNc1cccs1 f92887221cdfe270aa88f70a5b6538c3 [0,2,0,0,0,0|0,1,0]=3 23 B8R1.8 CCNc1ccno1 c991bcc5829788fabf092ecd54bd220e [0,2,0,0,0,0|1,0,0]=3 24 B8R1.8 CCNc1ccns1 2d79a3b4135a06a1b489318190c2601d [0,2,0,0,0,0|1,1,0]=4 25 B8R1.8 CCNc1ccon1 1b2b81379cbfa300ef6ff7f035534561 [0,2,0,0,0,0|2,0,0]=4 26 B8R1.8 CCNc1ccsc1 cda8850b0edc8792e319ed7aad994bf3 [0,2,0,0,0,0|2,0,0]=4 27 B8R1.8 CCNc1cncs1 caf47a09a037d51cb6d8de3ed1ef2cd8 [0,2,0,0,0,0|1,1,0]=4 28 B8R1.8 CCNc1cocn1 d8e901dc9f64240d769713656ef981d4 [0,2,0,0,0,0|2,0,0]=4 29 B8R1.8 CCNc1cscn1 deb4d5205f2d6ad6b5aceaad6dba2646 [0,2,0,0,0,0|2,0,0]=4 30 B8R1.8 CCNc1ncc[nH]1 9c694d8670fe0b12710364903a725787 [0,2,0,0,0,0|2,0,0]=4 31 B8R1.8 CCNc1ncco1 9fef4809a1ac3d1c666a8faacb65e06b [0,2,0,0,0,0|1,0,0]=3 32 B8R1.8 CCNc1nccs1 80b16777a8c3f760bbf265ac2cdb6521 [0,2,0,0,0,0|1,1,0]=4 33 B8R1.8 CCNc1nnco1 61cc1282bfb2a7c0677bca5ed48ec5a9 [0,2,0,0,0,0|2,0,0]=4 34 B8R1.8 CCOc1c[nH]cn1 5a57d5d014ff5f703d52daf8ebbbcbe1 [0,2,0,0,0,0|2,0,0]=4 35 B8R1.8 CCOc1ccco1 e09af78840aa7c50339c3ce236ba2f4c [0,2,0,0,0,0|0,0,0]=2 36 B8R1.8 CCOc1cccs1 d21292a98c2ee3c1ea9b8b00e074b6ef [0,2,0,0,0,0|0,1,0]=3 37 B8R1.8 CCOc1ccn[nH]1 945a2fb7b2311859d19fa2575122eac5 [0,2,0,0,0,0|2,0,0]=4 38 B8R1.8 CCOc1ccsc1 e97ca04b8e5d46ec67b2ebe625463cd4 [0,2,0,0,0,0|2,0,0]=4 39 B8R1.8 CCOc1nccs1 c7bf9113a012f962fcb198e0f8e767fe [0,2,0,0,0,0|1,1,0]=4 40 B8R1.8 CCOn1cccn1 770cadc5246353a2a295ab96e14141ca [0,2,0,0,0,0|2,0,0]=4 41 B8R1.8 FCNc1cc[nH]n1 245397896a72a3b9033cc2f6c446a3cb [0,2,0,0,0,0|2,0,0]=4 42 B8R1.8 FCNc1cccs1 5e75f288d43648c29cd49234a17e1a9b [0,2,0,0,0,0|0,1,0]=3 43 B8R1.8 FCNc1ccno1 60a267bb867c822fdfdffdd946b066a7 [0,2,0,0,0,0|1,0,0]=3 44 B8R1.8 FCNc1ccns1 1d205d8beaac2d2bb93e8ea880164fc9 [0,2,0,0,0,0|1,1,0]=4 45 B8R1.8 FCNc1ccon1 dc50a6cfb14b624e96467386d6c85c34 [0,2,0,0,0,0|2,0,0]=4 46 B8R1.8 FCNc1ccsc1 2968fecc0459119bb1db4fd57037b52c [0,2,0,0,0,0|2,0,0]=4 47 B8R1.8 FCNc1cncs1 8b493dc10d152e95cc556b0e6f254623 [0,2,0,0,0,0|1,1,0]=4 48 B8R1.8 FCNc1cocn1 04d7f86bde8e318dd405b40f15c0a8cf [0,2,0,0,0,0|2,0,0]=4 49 B8R1.8 FCNc1cscn1 c731b5dcbdac42f6477d3943b0528f3a [0,2,0,0,0,0|2,0,0]=4 50 B8R1.8 FCNc1ncc[nH]1 7e1136910a31ae6119771fbba5022125 [0,2,0,0,0,0|2,0,0]=4 51 B8R1.8 FCNc1ncco1 f2516fdad5ce6b05dd015414dcc1a357 [0,2,0,0,0,0|1,0,0]=3 52 B8R1.8 FCNc1nccs1 41c06b597219efba0da515febf1d22d0 [0,2,0,0,0,0|1,1,0]=4 53 B8R1.8 FCNc1nnco1 979732b76f19677d5c6809fd1caa6c1d [0,2,0,0,0,0|2,0,0]=4 54 B8R1.8 FCOc1c[nH]cn1 83ef801dce93fa6d3822b836ca187583 [0,2,0,0,0,0|2,0,0]=4 55 B8R1.8 FCOc1ccco1 51ab89c071216f5af135b7cd9684c569 [0,2,0,0,0,0|0,0,0]=2 56 B8R1.8 FCOc1cccs1 5abe6db260cf1bf0ece10764373fe2fd [0,2,0,0,0,0|0,1,0]=3 57 B8R1.8 FCOc1ccn[nH]1 76b583cee1058f2c94eb53920a041371 [0,2,0,0,0,0|2,0,0]=4 58 B8R1.8 FCOc1ccsc1 2b33af6cc138952fed6ef6cce321adfb [0,2,0,0,0,0|2,0,0]=4 59 B8R1.8 FCOc1nccs1 52842efe331bbe4c67721511b2fb7550 [0,2,0,0,0,0|1,1,0]=4 60 B8R1.8 FCOn1cccn1 a5704e860e8834604a47e4ccc927e30f [0,2,0,0,0,0|2,0,0]=4 61 B8R1.8 O=CNc1cccs1 ba17c251fb0707a83067f3ecf6d1d996 [0,2,0,0,0,0|0,1,1]=4 62 B8R1.8 O=CNc1ccno1 aae61b9cd3ebc97474890d3f855206e4 [0,2,0,0,0,0|1,0,1]=4 63 B8R1.8 O=CNc1ncco1 6995c12eff18399819f86d155261d936 [0,2,0,0,0,0|1,0,1]=4 64 B8R1.8 OCNc1cc[nH]n1 afbc11349e53c559bd7db4069b9be398 [0,2,0,0,0,0|2,0,0]=4 65 B8R1.8 OCNc1cccs1 2c9e101236047184adb7524dbc050fa0 [0,2,0,0,0,0|0,1,0]=3 66 B8R1.8 OCNc1ccno1 478600583886de8c6682fe554d125237 [0,2,0,0,0,0|1,0,0]=3 67 B8R1.8 OCNc1ccns1 e57f2a4ef26f21fe834381dfd9a1257b [0,2,0,0,0,0|1,1,0]=4 68 B8R1.8 OCNc1ccon1 7be923090168530936e4261c53a32f20 [0,2,0,0,0,0|2,0,0]=4 69 B8R1.8 OCNc1ccsc1 baaeacb9206ca69c746a94490c876825 [0,2,0,0,0,0|2,0,0]=4 70 B8R1.8 OCNc1cncs1 6a1421c2b1d1c1d56a31b7e716ddbb04 [0,2,0,0,0,0|1,1,0]=4 71 B8R1.8 OCNc1cocn1 e1a60a0cc7051579fcf6090e396569f9 [0,2,0,0,0,0|2,0,0]=4 72 B8R1.8 OCNc1cscn1 ad7de3e895d3dc9dfaeb615236b65625 [0,2,0,0,0,0|2,0,0]=4 73 B8R1.8 OCNc1ncc[nH]1 8779228d9622538cac84c5b84482a9b7 [0,2,0,0,0,0|2,0,0]=4 74 B8R1.8 OCNc1ncco1 15920413347c3c350d4387dc3a094208 [0,2,0,0,0,0|1,0,0]=3 75 B8R1.8 OCNc1nccs1 45a5a57bb5cb8d2f68397bed9047efc5 [0,2,0,0,0,0|1,1,0]=4 76 B8R1.8 OCNc1nnco1 59ddb0b14d4c463a6b9d69bbcd410c87 [0,2,0,0,0,0|2,0,0]=4