0 B8R0.1 C=CCN(C)C/C=C\O 599d799837800c446c20c74342d353a2 [0,1,1,0,0,0|1,0,1]=4 1 B8R0.6 C=CC(=O)NCC=CC 7bfd6f39a10cac7561bd29c81bebed41 [0,1,1,0,0,0|0,0,2]=4 2 B8R0.6 C=CC(C)NC/C=C\O ac72ebe204bc13007c3e96446f0fbe89 [0,1,1,0,0,0|0,0,2]=4 3 B10R1.1 CCNc1ccc(=O)[nH]c1 cda5f6466914b9089a8f399c4d41b9f1 [0,2,0,0,0,0|1,0,1]=4 4 B10R1.1 CCNc1ccc(cc1)Br e7368b650d842df07f1a9668bf0b4031 [0,2,0,0,0,0|1,0,0]=3 5 B10R1.1 CCNc1ccc(cc1)C 5bd280a2c0e051bd626f67ade06cc665 [0,2,0,0,0,0|1,0,0]=3 6 B10R1.1 CCNc1ccc(cc1)Cl 78a77ff2de1029463881d0096e3c40b4 [0,2,0,0,0,0|1,0,0]=3 7 B10R1.1 CCNc1ccc(cc1)F 7245e23faec7214139cc638d5d7041df [0,2,0,0,0,0|1,0,0]=3 8 B10R1.1 CCNc1ccc(cc1)I 08dbf719260fe2b9101a362dcb5b3f5c [0,2,0,0,0,0|1,0,0]=3 9 B10R1.1 CCNc1ccc(cc1)S d391e984cf82ddd3585ab73e3af8af78 [0,2,0,0,0,0|0,1,0]=3 10 B10R1.1 CCNc1ccc(cn1)Br 639f883e838120d440c275f266387630 [0,2,0,0,0,0|2,0,0]=4 11 B10R1.1 CCNc1ccc(cn1)C fb256d19526c3e4e7db09097bf1226ae [0,2,0,0,0,0|2,0,0]=4 12 B10R1.1 CCNc1ccc(cn1)Cl 86942235d68fec688c4d98a640636bda [0,2,0,0,0,0|2,0,0]=4 13 B10R1.1 CCNc1ccc(cn1)F bc6bc6f1cc565acba301cdb52762e02f [0,2,0,0,0,0|2,0,0]=4 14 B10R1.1 CCNc1ccc(cn1)I 52b76d004d4ec36a1450a88eb15ee235 [0,2,0,0,0,0|2,0,0]=4 15 B10R1.1 CCNc1ccc(nc1)Br 59c1c575d4cf738922707e4ac33945e2 [0,2,0,0,0,0|2,0,0]=4 16 B10R1.1 CCNc1ccc(nc1)C c6a305032b477973c3c3fbf0a9e4e681 [0,2,0,0,0,0|2,0,0]=4 17 B10R1.1 CCNc1ccc(nc1)Cl a3742bd50e5ddc0bb8d9bcc0351dba6f [0,2,0,0,0,0|2,0,0]=4 18 B10R1.1 CCNc1ccc(nc1)F 1c8d0a2e7c3ebc9b796eced21d4d67da [0,2,0,0,0,0|2,0,0]=4 19 B10R1.1 CCNc1ccc(nc1)I b055045d2de39aafb4b6d6710f7ae0e8 [0,2,0,0,0,0|2,0,0]=4 20 B10R1.1 CCOc1ccc(cc1)Br 0e76a95a836dd2981a43d0b194227fd8 [0,2,0,0,0,0|1,0,0]=3 21 B10R1.1 CCOc1ccc(cc1)C 26efd14f9e8649940b64cdf1b3738f1b [0,2,0,0,0,0|0,0,0]=2 22 B10R1.1 CCOc1ccc(cc1)Cl 945eb2c259d4cb8905c1789c25d510a9 [0,2,0,0,0,0|1,0,0]=3 23 B10R1.1 CCOc1ccc(cc1)F 5faab7d15ff0cf2f779560e4d5e7448c [0,2,0,0,0,0|1,0,0]=3 24 B10R1.1 CCOc1ccc(cc1)I 53aa34317b2540d22d9ec7de628cac3d [0,2,0,0,0,0|1,0,0]=3 25 B10R1.1 CCOc1ccc(cc1)S 99269a211e814d9abbdc09864e525389 [0,2,0,0,0,0|0,1,0]=3 26 B10R1.1 CCOc1ccc(cn1)C f777259bf4373954cda4bbb8405a47a2 [0,2,0,0,0,0|1,0,0]=3 27 B10R1.1 CCOc1ccc(cn1)Cl cd4f070a79f4939e7eca32fa7a8d0e7f [0,2,0,0,0,0|2,0,0]=4 28 B10R1.1 CCOc1ccc(cn1)F b50f8cb60dc9806fa9d9175eac7405e9 [0,2,0,0,0,0|2,0,0]=4 29 B10R1.1 CCOc1ccc(cn1)I 134eef0ef437844eb5a79430a3f4f022 [0,2,0,0,0,0|2,0,0]=4 30 B10R1.1 CCOc1ccc(nc1)Br bac9395e09cd94d673b47afe64f445de [0,2,0,0,0,0|2,0,0]=4 31 B10R1.1 CCOc1ccc(nc1)C a681f7f0cc1b45047bb455631f3beced [0,2,0,0,0,0|1,0,0]=3 32 B10R1.1 CCOc1ccc(nc1)Cl 1b78e4b95bbcd168fec166181ff52b61 [0,2,0,0,0,0|2,0,0]=4 33 B10R1.1 CCOc1ccc(nc1)F a0e05acc1f44f1bf919de4da94e9dd90 [0,2,0,0,0,0|2,0,0]=4 34 B10R1.1 CCOc1ccc(nc1)I 131dd3afd2712c4ddfbf28645dd95597 [0,2,0,0,0,0|2,0,0]=4 35 B10R1.1 CCOc1ccc(nn1)C ee9fd1014ff64a75b92c11dd9cb2cc10 [0,2,0,0,0,0|2,0,0]=4 36 B10R1.1 CCOc1cnc(cn1)C a6786d3b21f17a52c07e0a7cd8d71436 [0,2,0,0,0,0|2,0,0]=4 37 B10R1.1 CCOc1cnc(nc1)C d7956e7814c65fdaee661cddc1d6f6d3 [0,2,0,0,0,0|2,0,0]=4 38 B10R1.1 CCOc1ncc(cn1)C 56af84268e29eb3d38823688824a5b11 [0,2,0,0,0,0|2,0,0]=4 39 B10R1.1 Cc1ccc(cc1)NC=O 744bdaf803f21c7628c38778fb4c30d0 [0,2,0,0,0,0|0,0,1]=3 40 B10R1.1 Cc1ccc(cc1)NCF bc1e070a03926f4bf6c7312d5f79c7d7 [0,2,0,0,0,0|1,0,0]=3 41 B10R1.1 Cc1ccc(cc1)NCO 626a801ae48c57fa3fcbb53e76d595f1 [0,2,0,0,0,0|0,0,0]=2 42 B10R1.1 Cc1ccc(cc1)OCF 1ff33ac4ceb2cbf44a59770aa34ca71f [0,2,0,0,0,0|0,0,0]=2 43 B10R1.1 Cc1ccc(cn1)NC=O 489ceb64e1ca1dffde423b287e55343b [0,2,0,0,0,0|1,0,1]=4 44 B10R1.1 Cc1ccc(cn1)NCF f847d1a4bbb87566340c9e5a24558a24 [0,2,0,0,0,0|2,0,0]=4 45 B10R1.1 Cc1ccc(cn1)NCO fd814a39a039a510f879e6acc6bae8ec [0,2,0,0,0,0|1,0,0]=3 46 B10R1.1 Cc1ccc(cn1)OCF 74689607a43c2a9e18ce0cd22a8d942d [0,2,0,0,0,0|1,0,0]=3 47 B10R1.1 Cc1ccc(nc1)NC=O 787d7b6b5dd94952a200592a41c8b8b9 [0,2,0,0,0,0|1,0,1]=4 48 B10R1.1 Cc1ccc(nc1)NCF fe6e1acd0e3bc2d9ee7e6564901f4999 [0,2,0,0,0,0|2,0,0]=4 49 B10R1.1 Cc1ccc(nc1)NCO a3d787a21cbcad7f0f8fd58a7dfe7945 [0,2,0,0,0,0|1,0,0]=3 50 B10R1.1 Cc1ccc(nc1)OCF 17072532157ece6c6315bad9dab956ea [0,2,0,0,0,0|1,0,0]=3 51 B10R1.1 Cc1ccc(nn1)NCO bd7dd3a5c1963b6971d3a74d1a1ad325 [0,2,0,0,0,0|2,0,0]=4 52 B10R1.1 Cc1ccc(nn1)OCF 556957aa65f55b9dee775da8edb23f19 [0,2,0,0,0,0|2,0,0]=4 53 B10R1.1 Cc1cnc(cn1)NCO 8d393161f1ce972fb638d7faa3b7e084 [0,2,0,0,0,0|2,0,0]=4 54 B10R1.1 Cc1cnc(cn1)OCF c683cab6bb972447c378bd73796cdaac [0,2,0,0,0,0|2,0,0]=4 55 B10R1.1 Cc1cnc(nc1)NCO 7c6d8463c82043ed8eb62334903e04c1 [0,2,0,0,0,0|2,0,0]=4 56 B10R1.1 Cc1cnc(nc1)OCF 94d32da9b89c7347596c60008d895f19 [0,2,0,0,0,0|2,0,0]=4 57 B10R1.1 Cc1ncc(cn1)NCO d0ddc7ade30da92e24de300fd39df6c6 [0,2,0,0,0,0|2,0,0]=4 58 B10R1.1 Cc1ncc(cn1)OCF 947b4018635fcce82d61ce43cad48f61 [0,2,0,0,0,0|2,0,0]=4 59 B10R1.1 FCNc1ccc(cc1)Br 9a61248e2cb3b89f6eda1c85794bcc18 [0,2,0,0,0,0|1,0,0]=3 60 B10R1.1 FCNc1ccc(cc1)Cl 758cd93e824e8d8fe0f2c7b44d621ed4 [0,2,0,0,0,0|1,0,0]=3 61 B10R1.1 FCNc1ccc(cc1)F 371043c79a08be334292394da386365b [0,2,0,0,0,0|1,0,0]=3 62 B10R1.1 FCNc1ccc(cc1)I c777c25d05ef7069ce73e36f40a5c833 [0,2,0,0,0,0|1,0,0]=3 63 B10R1.1 FCNc1ccc(cc1)S 4e916ab7b0222d51e372a5dff4038b6f [0,2,0,0,0,0|0,1,0]=3 64 B10R1.1 FCNc1ccc(cn1)Br 97dbb7cffe38663e2c1630b63da1c21e [0,2,0,0,0,0|2,0,0]=4 65 B10R1.1 FCNc1ccc(cn1)Cl de79e5aad07722b1392cd20e0aa769b4 [0,2,0,0,0,0|2,0,0]=4 66 B10R1.1 FCNc1ccc(cn1)F a351d2df87c785e9f4b7093ddad55a10 [0,2,0,0,0,0|2,0,0]=4 67 B10R1.1 FCNc1ccc(cn1)I cffdbc36eae146d283a876d0c15de813 [0,2,0,0,0,0|2,0,0]=4 68 B10R1.1 FCNc1ccc(nc1)Br 6261b0bc6b3ff3510bf1c71a3860f462 [0,2,0,0,0,0|2,0,0]=4 69 B10R1.1 FCNc1ccc(nc1)Cl 91c36365220c1b2120abfc67c7a4beb0 [0,2,0,0,0,0|2,0,0]=4 70 B10R1.1 FCNc1ccc(nc1)F b6ffb991ac7e44e5f6b16b3a713f9190 [0,2,0,0,0,0|2,0,0]=4 71 B10R1.1 FCNc1ccc(nc1)I 5b740bad1f8c1deefa5b346bd729bada [0,2,0,0,0,0|2,0,0]=4 72 B10R1.1 FCOc1ccc(cc1)Br bc13401ff1b5b76f437683a94bdf2ed8 [0,2,0,0,0,0|1,0,0]=3 73 B10R1.1 FCOc1ccc(cc1)Cl 4e8cdf8131543ffc8a8f19ac10dd354e [0,2,0,0,0,0|1,0,0]=3 74 B10R1.1 FCOc1ccc(cc1)F d9961c874524e60966f13168de74d68e [0,2,0,0,0,0|1,0,0]=3 75 B10R1.1 FCOc1ccc(cc1)I 31e9a7d342257542e659914127a8d1e9 [0,2,0,0,0,0|1,0,0]=3 76 B10R1.1 FCOc1ccc(cc1)S 3c6768610977ef2105a56aef384b857c [0,2,0,0,0,0|0,1,0]=3 77 B10R1.1 FCOc1ccc(cn1)Cl 61f6fd78e0abeeb2eb97b4aa2b12a9c9 [0,2,0,0,0,0|2,0,0]=4 78 B10R1.1 FCOc1ccc(cn1)F b1e868aec0faffebe89225e907274205 [0,2,0,0,0,0|2,0,0]=4 79 B10R1.1 FCOc1ccc(cn1)I 00c1ef2fd48be5d55550cc9694fd8f08 [0,2,0,0,0,0|2,0,0]=4 80 B10R1.1 FCOc1ccc(nc1)Br e3796b17ff3d2d2dd46e80f84fb6187d [0,2,0,0,0,0|2,0,0]=4 81 B10R1.1 FCOc1ccc(nc1)Cl 70a5644c7430704168998528ea5ce13b [0,2,0,0,0,0|2,0,0]=4 82 B10R1.1 FCOc1ccc(nc1)F 77ab35a2a6dcafe96de60a2128f5fe49 [0,2,0,0,0,0|2,0,0]=4 83 B10R1.1 FCOc1ccc(nc1)I 03bd4c63f213b54e5f564a7a1a2fd6ff [0,2,0,0,0,0|2,0,0]=4 84 B10R1.1 N#CNc1ccc(cc1)S 3fac1ce8a15899f909cc86420cdfee8e [0,2,0,0,0,0|0,1,1]=4 85 B10R1.1 O=CNc1ccc(cc1)Br d7ce2fc8367b9f0ab0f2e59514baf831 [0,2,0,0,0,0|1,0,1]=4 86 B10R1.1 O=CNc1ccc(cc1)Cl 6958240b257559c57e66b733208a1fd9 [0,2,0,0,0,0|1,0,1]=4 87 B10R1.1 O=CNc1ccc(cc1)F bd58d24daf145acc5a6089d95f60a456 [0,2,0,0,0,0|1,0,1]=4 88 B10R1.1 O=CNc1ccc(cc1)I 477097145ec69bf5f94c911c47fa12c8 [0,2,0,0,0,0|1,0,1]=4 89 B10R1.1 O=CNc1ccc(cc1)S 4a89cce61b79984a4f73e03ba9acee66 [0,2,0,0,0,0|0,1,1]=4 90 B10R1.1 O=c1ccc(c[nH]1)NCF 71b898b20012e241ac720b84250f933c [0,2,0,0,0,0|1,0,1]=4 91 B10R1.1 O=c1ccc(c[nH]1)NCO 6c49f3fcbfcda41856e9a3ef89f0e0b2 [0,2,0,0,0,0|1,0,1]=4 92 B10R1.1 OCNc1ccc(cc1)Br 8a6f77c6bbe9ea4e056c3d8d66d7853d [0,2,0,0,0,0|1,0,0]=3 93 B10R1.1 OCNc1ccc(cc1)Cl 86437eba67664b7a79a0b9f1be727594 [0,2,0,0,0,0|1,0,0]=3 94 B10R1.1 OCNc1ccc(cc1)F 713130e1345d066522caa5c40a69b374 [0,2,0,0,0,0|1,0,0]=3 95 B10R1.1 OCNc1ccc(cc1)I b3ec7df4f137e654c56c2616ca2d7a8a [0,2,0,0,0,0|1,0,0]=3 96 B10R1.1 OCNc1ccc(cc1)S a2d81e6a6f1ccdc29f69d5fbee093f77 [0,2,0,0,0,0|0,1,0]=3 97 B10R1.1 OCNc1ccc(cn1)Br df4ffeb7d3426fa3f30c970836be5a07 [0,2,0,0,0,0|2,0,0]=4 98 B10R1.1 OCNc1ccc(cn1)Cl d8643f93dc56c4026f45d75600865cf1 [0,2,0,0,0,0|2,0,0]=4 99 B10R1.1 OCNc1ccc(cn1)F c678380a06127762dfcfe4f997000000 [0,2,0,0,0,0|2,0,0]=4 100 B10R1.1 OCNc1ccc(cn1)I 4da26305a3e4c2d76ed4b2a820524344 [0,2,0,0,0,0|2,0,0]=4 101 B10R1.1 OCNc1ccc(nc1)Br 399f860b3f8af2a89c07a3b0752fb11e [0,2,0,0,0,0|2,0,0]=4 102 B10R1.1 OCNc1ccc(nc1)Cl d6034f7aa3e9576c3befbcbc74c36153 [0,2,0,0,0,0|2,0,0]=4 103 B10R1.1 OCNc1ccc(nc1)F 9c48cfa9cdfaaee705bc9f41b078a0e2 [0,2,0,0,0,0|2,0,0]=4 104 B10R1.1 OCNc1ccc(nc1)I 115f65afea3289921087b1ab2d1633ed [0,2,0,0,0,0|2,0,0]=4