0 B9R1.2 CC1CCCN(C1)C=O 5a06aa6b42e18f18aee9823269dae409 [0,1,0,0,0,0|1,0,0]=2 1 B9R1.2 CC1CCCN(C1)CF b691638e4475db7509438452c0a1551a [0,1,0,0,0,0|2,0,0]=3 2 B9R1.2 CC1CCCN(C1)CO 26652d230bcc9a1195d63435a97c512d [0,1,0,0,0,0|1,0,1]=3 3 B9R1.2 CC1CN(CCO1)C=O 419911434d41e805d16780cbe76cce9d [0,1,0,0,0,0|2,0,0]=3 4 B9R1.2 CC1CN(CCO1)CF 5604e0e287f758cadf8b3a47139435e2 [0,1,0,0,0,0|3,0,0]=4 5 B9R1.2 CC1CN(CCO1)CO 778a26868977a5891e9594a8c31c0b2b [0,1,0,0,0,0|2,0,1]=4 6 B9R1.2 CCN1CCCC(=O)C1 b0afeee675d5ec52ec51d9d2cdcf36a5 [0,1,0,0,0,0|1,0,0]=2 7 B9R1.2 CCN1CCCC(C1)C bb28da9a5acb28960c4ccbfa24bf8789 [0,1,0,0,0,0|2,0,0]=3 8 B9R1.2 CCN1CCCC(C1)F f34071e85de22867d954ce820be49898 [0,1,0,0,0,0|2,0,1]=4 9 B9R1.2 CCN1CCCC(C1)O 01dd02e5bf6117a7fa48ae871f4642c4 [0,1,0,0,0,0|1,0,2]=4 10 B9R1.2 CCN1CCC[C@@H](C1)C 60c8c16bbe3ec0bdd85a0ab469564b45 [0,1,0,0,0,0|2,0,0]=3 11 B9R1.2 CCN1CCC[C@@H](C1)F 4bc82a27cb24b8d929f4ba749eb6afe0 [0,1,0,0,0,0|2,0,1]=4 12 B9R1.2 CCN1CCC[C@@H](C1)O d6e6558187b53da928a88c93a11d40fa [0,1,0,0,0,0|1,0,2]=4 13 B9R1.2 CCN1CCC[C@H](C1)C 7a8da6e9090318009a7decadd340bca1 [0,1,0,0,0,0|2,0,0]=3 14 B9R1.2 CCN1CCC[C@H](C1)F 16c2e2d7a2b96adf6d95208ff0d9f05f [0,1,0,0,0,0|2,0,1]=4 15 B9R1.2 CCN1CCC[C@H](C1)O 9fb116abf81f3b2aa3dfe9efc1670b96 [0,1,0,0,0,0|1,0,2]=4 16 B9R1.2 CCN1CCNC(=O)C1 8ee087b200f253c3cbe099e9fc72a94a [0,1,0,0,0,0|2,0,0]=3 17 B9R1.2 CCN1CCOC(=O)C1 3f4941c9ffb61ce7dcae55397d747220 [0,1,0,0,0,0|2,0,0]=3 18 B9R1.2 CCN1CCOC(C1)C 728c54cb68ad3e7e596277403e524930 [0,1,0,0,0,0|3,0,0]=4 19 B9R1.2 CCN1CCO[C@@H](C1)C 6773a2926bf65cf454f86f72394acd18 [0,1,0,0,0,0|3,0,0]=4 20 B9R1.2 CCN1CCO[C@H](C1)C 2830584cb78b6db06594fe0e084d9b83 [0,1,0,0,0,0|3,0,0]=4 21 B9R1.2 C[C@@H]1CCCN(C1)C=O b5e680c9235a8f69b3718f41b577e428 [0,1,0,0,0,0|1,0,0]=2 22 B9R1.2 C[C@@H]1CCCN(C1)CF cac6b7b5fb4001646643abf50489bbdb [0,1,0,0,0,0|2,0,0]=3 23 B9R1.2 C[C@@H]1CCCN(C1)CO 6675ecf83c8b49544e3561e3282b0e83 [0,1,0,0,0,0|1,0,1]=3 24 B9R1.2 C[C@@H]1CN(CCO1)C=O b5db532eab9a99bf3ba15375dd3b6f02 [0,1,0,0,0,0|2,0,0]=3 25 B9R1.2 C[C@@H]1CN(CCO1)CF 3b82e6ab612ad0d331b047e2904a7f87 [0,1,0,0,0,0|3,0,0]=4 26 B9R1.2 C[C@@H]1CN(CCO1)CO 11017e5ee62e4fd7346d2d1374c88c4c [0,1,0,0,0,0|2,0,1]=4 27 B9R1.2 C[C@H]1CCCN(C1)C=O 4dab749a75683c45748ebdcac3ae2c8b [0,1,0,0,0,0|1,0,0]=2 28 B9R1.2 C[C@H]1CCCN(C1)CF c41858f8ae1d9653339e528e6cb2c0eb [0,1,0,0,0,0|2,0,0]=3 29 B9R1.2 C[C@H]1CCCN(C1)CO 612f7806a77df61f3b60bf95e73ba9e6 [0,1,0,0,0,0|1,0,1]=3 30 B9R1.2 C[C@H]1CN(CCO1)C=O df29ae4feffabe0da5bd47bb2c69d059 [0,1,0,0,0,0|2,0,0]=3 31 B9R1.2 C[C@H]1CN(CCO1)CF e69c1008d59a2450179733e0300d4744 [0,1,0,0,0,0|3,0,0]=4 32 B9R1.2 C[C@H]1CN(CCO1)CO d21afa11a092c2202f863301c8e7ddd7 [0,1,0,0,0,0|2,0,1]=4 33 B9R1.2 FCN1CCCC(C1)F 82519f4199c56ff234e45d04d55a74d4 [0,1,0,0,0,0|2,0,1]=4 34 B9R1.2 FCN1CCC[C@@H](C1)F f40dae0651dcf4cd6b3ab3203208d466 [0,1,0,0,0,0|2,0,1]=4 35 B9R1.2 FCN1CCC[C@H](C1)F ea6001a32faacf160a7f22d56b28ce6a [0,1,0,0,0,0|2,0,1]=4 36 B9R1.2 O=C1CCCN(C1)CF 4a3aadad28924fa951595c84af73b014 [0,1,0,0,0,0|1,0,0]=2 37 B9R1.2 O=C1CCCN(C1)CO 6d0678682a57a081022f992f70f98004 [0,1,0,0,0,0|1,0,0]=2 38 B9R1.2 O=C1CN(CCN1)CF 5bafb41e77e8fcc47f20b3f5b7855411 [0,1,0,0,0,0|2,0,0]=3 39 B9R1.2 O=C1CN(CCN1)CO 0ce2c3b0e7d808508a34999d9467140c [0,1,0,0,0,0|2,0,0]=3 40 B9R1.2 O=C1CN(CCO1)CF c923694c0bf9f6f1496b855a5b8b01b2 [0,1,0,0,0,0|2,0,0]=3 41 B9R1.2 O=C1CN(CCO1)CO 8db94e8adcec68c019e224a8c72e73db [0,1,0,0,0,0|2,0,0]=3 42 B9R1.2 O=CN1CCCC(=O)C1 853ed8a7ea6d407efd205be254a69349 [0,1,0,0,0,0|1,0,1]=3 43 B9R1.2 O=CN1CCCC(C1)F 04917882399611fcb80fb86df59a89e2 [0,1,0,0,0,0|2,0,0]=3 44 B9R1.2 O=CN1CCCC(C1)O 0df930667a84d8d3d91a613bfd57f133 [0,1,0,0,0,0|2,0,0]=3 45 B9R1.2 O=CN1CCC[C@@H](C1)F 8bf0e6ef9ed8e1b7cb36e4499af92a58 [0,1,0,0,0,0|2,0,0]=3 46 B9R1.2 O=CN1CCC[C@@H](C1)O 50e0b44fd1f0b47772960747a9d4dc2e [0,1,0,0,0,0|2,0,0]=3 47 B9R1.2 O=CN1CCC[C@H](C1)F ec017dd9294189577b258dfb95fb493e [0,1,0,0,0,0|2,0,0]=3 48 B9R1.2 O=CN1CCC[C@H](C1)O 1099b25f2d4ea20dc0b6d23f3ff3e4f6 [0,1,0,0,0,0|2,0,0]=3 49 B9R1.2 O=CN1CCNC(=O)C1 a083308c4a8c428300c3ea6f5614b72e [0,1,0,0,0,0|2,0,1]=4 50 B9R1.2 O=CN1CCOC(=O)C1 64e52dc909f50b8e1649c1cdcf0cde99 [0,1,0,0,0,0|2,0,1]=4 51 B9R1.2 OC1CCCN(C1)CF 4df59c67f1dddf0d33cb5fbf9fb2d841 [0,1,0,0,0,0|1,0,2]=4 52 B9R1.2 OCN1CCCC(C1)F c961438756a97ac71c25ac8244d6a7a3 [0,1,0,0,0,0|2,0,1]=4 53 B9R1.2 OCN1CCCC(C1)O a1a4b503369ffbeead5dbdfde67130ff [0,1,0,0,0,0|1,0,2]=4 54 B9R1.2 OCN1CCC[C@@H](C1)F 86e2abc91290abd055bfb691fa5f12d9 [0,1,0,0,0,0|2,0,1]=4 55 B9R1.2 OCN1CCC[C@@H](C1)O 44839fbaefbedf7952c40f3e445b2f37 [0,1,0,0,0,0|1,0,2]=4 56 B9R1.2 OCN1CCC[C@H](C1)F d473717ba6ccce88f32fe4c5f2bce4c0 [0,1,0,0,0,0|2,0,1]=4 57 B9R1.2 OCN1CCC[C@H](C1)O 958b5d72e374ab873500994771487a3a [0,1,0,0,0,0|1,0,2]=4 58 B9R1.2 O[C@@H]1CCCN(C1)CF 3a01270ddce23eb98da92fdec4d1eb7c [0,1,0,0,0,0|1,0,2]=4 59 B9R1.2 O[C@H]1CCCN(C1)CF 517eff8a3f41933ce4b79695b3ea6e98 [0,1,0,0,0,0|1,0,2]=4 60 B7R0.2 C#CC(C)NC(=O)C 30a91f9e689320cab67e7176279a027a [0,0,1,0,0,0|1,0,2]=4 61 B7R0.2 C#C[C@@H](C)NC(=O)C b5f4cb4c2ca82f0d4e132f2977db08a6 [0,0,1,0,0,0|1,0,2]=4 62 B7R0.2 C#C[C@H](C)NC(=O)C adfc3d71c946a289355ab55f3775ec5f [0,0,1,0,0,0|1,0,2]=4 63 B7R0.2 C=C(Br)CN(C)CC a95e900b3ccec6668bc411630f5decf3 [0,0,1,0,0,0|2,0,1]=4 64 B7R0.2 C=C(C)CN(C)CC f46aa4737385fde5ecca127cfe0fb11b [0,0,1,0,0,0|2,0,0]=3 65 B7R0.2 C=C(Cl)CN(C)CC 85a42652568d865a3db0ed61404dde1c [0,0,1,0,0,0|2,0,1]=4 66 B7R0.2 C=CC(C)NC(=O)C da0f45e746fe5ddfb85b752dba1a7d5c [0,0,1,0,0,0|1,0,2]=4 67 B7R0.2 CC(=O)NC(C)C#N 5c82a898464bc97e12136e75988ac4b5 [0,0,1,0,0,0|2,0,1]=4 68 B7R0.2 CC(=O)NC(C)CO 5b33fe0ccef9f04a2ffcb97aafaea882 [0,0,1,0,0,0|2,0,0]=3 69 B7R0.2 CC(=O)N[C@@H](C)CO 6858caa5d94a6988c3c1bcaa83d0b2b8 [0,0,1,0,0,0|2,0,0]=3 70 B7R0.2 CC(=O)N[C@H](C)CO 0b20f01b94b45fad0762ce944038f07e [0,0,1,0,0,0|2,0,0]=3 71 B7R0.2 CC(C)CN(C)CF f2a6b79f5877628929a1b31fd183a5d0 [0,0,1,0,0,0|3,0,0]=4 72 B7R0.2 CC(C)CN(C)CO 0b6bf7cc82aa91188fc000497729e3d4 [0,0,1,0,0,0|3,0,0]=4 73 B7R0.2 CCC(C)NC(=O)C d52a9bb324dcdb60d53e4e9e2013cb50 [0,0,1,0,0,0|1,0,0]=2 74 B7R0.2 CCC(C)NC(C)C 0cb605662148972b343a2865e41d2f95 [0,0,1,0,0,0|2,0,1]=4 75 B7R0.2 CCC(C)OC(C)C 06c7f52afdb28395f9fa9574a364e474 [0,0,1,0,0,0|2,0,1]=4 76 B7R0.2 CCN(C)CC(=O)N 58c4f2962e11e395e9dd8c9fccee33dd [0,0,1,0,0,0|2,0,0]=3 77 B7R0.2 CCN(C)CC(=O)O ed00a192e609f5d5786e1c989c44eb8f [0,0,1,0,0,0|2,0,0]=3 78 B7R0.2 CCN(C)CC(C)C b1801f5d5c3a2fe65e0c5338da1b288f [0,0,1,0,0,0|2,0,0]=3 79 B7R0.2 CCN(C)CC(C)O 22c796f149474196e01f5a861b83c652 [0,0,1,0,0,0|1,0,2]=4 80 B7R0.2 CCN(C)CN(C)C f99659c98f126cf47210322e6b249111 [0,0,1,0,0,0|3,0,0]=4 81 B7R0.2 CCN(C)C[C@@H](C)O e1fc7c21afedf382169569842ae9d9da [0,0,1,0,0,0|1,0,2]=4 82 B7R0.2 CCN(C)C[C@H](C)O 2fe5de7e3e442679b65eac3f37bae166 [0,0,1,0,0,0|1,0,2]=4 83 B7R0.2 CCN(C)C[N+](=O)[O-] 1747c815c0bddd9b3eea2e8a91b60fbe [0,0,1,0,0,0|3,0,0]=4 84 B7R0.2 CC[C@@H](C)NC(=O)C c6d5d80303dcfd2ae6eb945ac41b31c0 [0,0,1,0,0,0|1,0,0]=2 85 B7R0.2 CC[C@@H](C)NC(C)C fbd46dfde63f10a9f545bd04d72d3565 [0,0,1,0,0,0|2,0,1]=4 86 B7R0.2 CC[C@@H](C)OC(C)C be2816eab25b2a9101da766270106c57 [0,0,1,0,0,0|2,0,1]=4 87 B7R0.2 CC[C@H](C)NC(=O)C 96d2ad332d2a7d6643a2730e644df4f3 [0,0,1,0,0,0|1,0,0]=2 88 B7R0.2 CC[C@H](C)NC(C)C df85b8e0c4ded03d149c43327f4a7c4a [0,0,1,0,0,0|2,0,1]=4 89 B7R0.2 CC[C@H](C)OC(C)C 2c6d159b250df3bb005afd7417a4b5dc [0,0,1,0,0,0|2,0,1]=4 90 B7R0.2 CN(CF)CC(=O)N 35f09c99eb4485b888503c93a96568a5 [0,0,1,0,0,0|3,0,0]=4 91 B7R0.2 CN(CF)CC(=O)O 7d1eb1d71c500640f6029a70869bff49 [0,0,1,0,0,0|3,0,0]=4 92 B7R0.2 CN(CO)CC(=O)N 731e626c7cf4b35c02c8b97f3321d2b5 [0,0,1,0,0,0|3,0,0]=4 93 B7R0.2 CN(CO)CC(=O)O e8788fe9a5132c43f9e5136dbe3278ce [0,0,1,0,0,0|3,0,0]=4 94 B7R0.4 C#CCCNC(=O)C e103f6c630df1c8bc942f7cd96221f16 [0,0,1,0,0,0|1,0,2]=4 95 B7R0.4 C#CCCNC(C)C 4f43d4aa609bb85ba1ce2df12e95dc64 [0,0,1,0,0,0|2,0,1]=4 96 B7R0.4 C#CCCOC(C)C 742a793a3d568179dfa9ddcdeebb6426 [0,0,1,0,0,0|2,0,1]=4 97 B7R0.4 C#CCNCC(=O)C 5de972c5592516dd50641220afa1c072 [0,0,1,0,0,0|1,0,2]=4 98 B7R0.4 C#CCNCC(C)C 211a4a57c09fb23261da854e91255de6 [0,0,1,0,0,0|2,0,1]=4 99 B7R0.4 C#CCOCC(=O)C a3c93320b56e3e358d63fbc9e6735009 [0,0,1,0,0,0|1,0,2]=4 100 B7R0.4 C#CCOCC(C)C 7b3dff03c4339e6282faa453495ddd1d [0,0,1,0,0,0|2,0,1]=4 101 B7R0.4 C/C=C/COC(C)C 9aa0010d7f93a3506d4a773cf3ec644e [0,0,1,0,0,0|2,0,1]=4 102 B7R0.4 C/C=C\COC(C)C 0fabad7d11b4d0a5e5a55e0264bdae1c [0,0,1,0,0,0|2,0,1]=4 103 B7R0.4 C=C(Br)CCOCC cc4fc6a1af0a8e14aface9bf14962130 [0,0,1,0,0,0|2,0,1]=4 104 B7R0.4 C=C(Br)CNCCC fa829c84ae21852cc8a84c5b2b04c392 [0,0,1,0,0,0|2,0,1]=4 105 B7R0.4 C=C(Br)COCCC 5863f2e2fc458f31ad6edaa914f592f2 [0,0,1,0,0,0|2,0,1]=4 106 B7R0.4 C=C(C)CCNC=O 4d615a3112b965fa05f258614a56fe4d [0,0,1,0,0,0|1,0,2]=4 107 B7R0.4 C=C(C)CCNCC 496668f773ae381b7253fe5c2e31b849 [0,0,1,0,0,0|2,0,0]=3 108 B7R0.4 C=C(C)CCNCF d9277e4b518036e504534a47b4d2c8d3 [0,0,1,0,0,0|3,0,0]=4 109 B7R0.4 C=C(C)CCNCO 1d4b0607e3d83a5f4006eff6bc7727ff [0,0,1,0,0,0|3,0,0]=4 110 B7R0.4 C=C(C)CCOCC be6e22e1c69b2a68ed5204ad177f8dbf [0,0,1,0,0,0|2,0,0]=3 111 B7R0.4 C=C(C)CCOCF 57a19209df87575c4f19afbce5b99e6c [0,0,1,0,0,0|3,0,0]=4 112 B7R0.4 C=C(C)CNCC=O 9d28817af531c4aeff91a0e804528258 [0,0,1,0,0,0|1,0,2]=4 113 B7R0.4 C=C(C)CNCCBr 2a71f14abd6d980bb31a1c9bc14c70f0 [0,0,1,0,0,0|3,0,0]=4 114 B7R0.4 C=C(C)CNCCC 9338ac3992e47efae82e0b1fb1732dd0 [0,0,1,0,0,0|2,0,0]=3 115 B7R0.4 C=C(C)CNCCF 147c63cc249cacaac64968cb85a45eaf [0,0,1,0,0,0|3,0,0]=4 116 B7R0.4 C=C(C)CNCCI 5db841d6ee2087586757d7c691268e13 [0,0,1,0,0,0|3,0,0]=4 117 B7R0.4 C=C(C)CNCCO 7142f744ef151de1633254d1c7f42004 [0,0,1,0,0,0|3,0,0]=4 118 B7R0.4 C=C(C)CNCCS b56ce23cba380640f2babb6ed5fa0d2e [0,0,1,0,0,0|3,0,0]=4 119 B7R0.4 C=C(C)CNCOC 56824e1f14264a8b23f8809f8827c008 [0,0,1,0,0,0|3,0,0]=4 120 B7R0.4 C=C(C)CNCSC 16720dfae312e14188787cb1eaf510d4 [0,0,1,0,0,0|3,0,0]=4 121 B7R0.4 C=C(C)COCC=O ac319c323600422cf8ad488ebe56732b [0,0,1,0,0,0|1,0,2]=4 122 B7R0.4 C=C(C)COCCC 76f9760152185d12d96d255aaf2df59a [0,0,1,0,0,0|2,0,0]=3 123 B7R0.4 C=C(C)COCCF 2393b781abe28f80c22ecc5054861ab3 [0,0,1,0,0,0|3,0,0]=4 124 B7R0.4 C=C(C)COCCS 49de4109ab241775eb4f5124e18dde45 [0,0,1,0,0,0|3,0,0]=4 125 B7R0.4 C=C(C)COCOC 43819766e7dcc16b61a9eda64a28704b [0,0,1,0,0,0|3,0,0]=4 126 B7R0.4 C=C(C)COCSC 57a3672b412662e92be8fefea10a5b74 [0,0,1,0,0,0|3,0,0]=4 127 B7R0.4 C=C(Cl)CNCCC e211f531740b4a6af99c40dd77a72224 [0,0,1,0,0,0|2,0,1]=4 128 B7R0.4 C=C(Cl)COCCC 8abcd6ae9b62bc4ff24e78f1b1637d62 [0,0,1,0,0,0|2,0,1]=4 129 B7R0.4 C=C(F)CNCCC 4667877133a3f36f4c10609c396b250b [0,0,1,0,0,0|2,0,1]=4 130 B7R0.4 C=C(F)COCCC 16c2ba6933f26fb577f08eb88fa11a89 [0,0,1,0,0,0|2,0,1]=4 131 B7R0.4 C=C(I)COCCC 0f8c92f8408141dde0e1a21bfdcf65bf [0,0,1,0,0,0|2,0,1]=4 132 B7R0.4 C=CCCNC(=O)C 479f81177c8b7d1f361bf6380aad1391 [0,0,1,0,0,0|1,0,2]=4 133 B7R0.4 C=CCCNC(C)C b52c7765f384ae2bfbfea60738f06e8b [0,0,1,0,0,0|2,0,0]=3 134 B7R0.4 C=CCCOC(C)C 1236c8c26ebbecb079980edfed00132c [0,0,1,0,0,0|2,0,0]=3 135 B7R0.4 C=CCNCC(=O)C c379877cdd29970c778896dc66ad00a6 [0,0,1,0,0,0|1,0,2]=4 136 B7R0.4 C=CCNCC(C)C 7f73adb711a665b808680f9f4e975092 [0,0,1,0,0,0|2,0,0]=3 137 B7R0.4 C=CCNCC(C)O dde411813044e811a6123a529ae27585 [0,0,1,0,0,0|3,0,0]=4 138 B7R0.4 C=CCNC[C@@H](C)O ec4536a6022457f632f6d265caa69d4d [0,0,1,0,0,0|3,0,0]=4 139 B7R0.4 C=CCNC[C@H](C)O 42afe3d5f35955757d07afc6e0f5adfa [0,0,1,0,0,0|3,0,0]=4 140 B7R0.4 C=CCOCC(=O)C 6cc60c3b69d2e2990673da8a49479ff3 [0,0,1,0,0,0|1,0,2]=4 141 B7R0.4 C=CCOCC(C)C 430e26f15a2ffd69e16a09cb44866cd6 [0,0,1,0,0,0|2,0,0]=3 142 B7R0.4 C=CCOCC(C)F db539a456bd6752ebe10d7b23c41a2c2 [0,0,1,0,0,0|3,0,0]=4 143 B7R0.4 C=CCOCC(C)S c0443280688281fff6bac011768c9c1b [0,0,1,0,0,0|3,0,0]=4 144 B7R0.4 C=CCOC[C@@H](C)F 6fbef7cd23b7ad6df74ff1c9ada25c26 [0,0,1,0,0,0|3,0,0]=4 145 B7R0.4 C=CCOC[C@H](C)F ee8f1a8a998027f3ef4fed8e2898cb78 [0,0,1,0,0,0|3,0,0]=4 146 B7R0.4 CC#CCNC(=O)C 0b9b1f8c1419bc28dc48ec1c6507ca3d [0,0,1,0,0,0|1,0,2]=4 147 B7R0.4 CC(=CCNC=O)C aa6f8132c2b4d81390aba70f51f750c7 [0,0,1,0,0,0|1,0,2]=4 148 B7R0.4 CC(=O)CCNC#N 4c80be72e90144dac156b66101e47221 [0,0,1,0,0,0|2,0,1]=4 149 B7R0.4 CC(=O)CCOCF 82d7d90cce95d3fcb1e3ec26261601b7 [0,0,1,0,0,0|2,0,0]=3 150 B7R0.4 CC(=O)CNCC#N 3143039d9319d06def2c85775b65f22b [0,0,1,0,0,0|2,0,1]=4 151 B7R0.4 CC(=O)CNCC=O 5be6de3ce66e561a4ff39c69208f9195 [0,0,1,0,0,0|2,0,1]=4 152 B7R0.4 CC(=O)CNCCF 037d57d4c47ace4be0a5087eec27dc1a [0,0,1,0,0,0|2,0,0]=3 153 B7R0.4 CC(=O)CNCCO 86398d1823d67bf69cb8819c5f41ae7a [0,0,1,0,0,0|2,0,0]=3 154 B7R0.4 CC(=O)CNCCS 7ce62300907f9ccd0384e405866d6aaa [0,0,1,0,0,0|2,0,0]=3 155 B7R0.4 CC(=O)COCC#N f6d942d7fed48c56b84b1cfe40ac78c5 [0,0,1,0,0,0|2,0,1]=4 156 B7R0.4 CC(=O)COCC=O 465b1cf75d509df2704309fff91522d1 [0,0,1,0,0,0|2,0,1]=4 157 B7R0.4 CC(=O)COCCF 44a64beb94b3f52bac0afdbbbb0c27fe [0,0,1,0,0,0|2,0,0]=3 158 B7R0.4 CC(=O)COCCS aaf6880c5768e2a52385922f009f4e73 [0,0,1,0,0,0|2,0,0]=3 159 B7R0.4 CC(=O)NCCC#N e30d62b714eb5f35b52a5a0ddd2a52a2 [0,0,1,0,0,0|2,0,1]=4 160 B7R0.4 CC(=O)NCCCCl a50262f9e3620db3f540afde4066de77 [0,0,1,0,0,0|2,0,0]=3 161 B7R0.4 CC(=O)NCCCO cd01194a1a55a891decb932ba2d96e97 [0,0,1,0,0,0|2,0,0]=3 162 B7R0.4 CC(=O)NCCON b144d6b267eb86a17759cca31656c8af [0,0,1,0,0,0|3,0,0]=4 163 B7R0.4 CC(=O)NCOCF bbf9571051543191a8870eae955bf479 [0,0,1,0,0,0|3,0,0]=4 164 B7R0.4 CC(C)CCNC#N 7936536f733b5b6191344eccb1c2de4e [0,0,1,0,0,0|2,0,1]=4 165 B7R0.4 CC(C)CCNC=O 8fb8d2f77b8e7548ff10a901f65a6a2b [0,0,1,0,0,0|1,0,0]=2 166 B7R0.4 CC(C)CCNCF 7f725eaafe57b21e0294a49a9a15ea60 [0,0,1,0,0,0|2,0,1]=4 167 B7R0.4 CC(C)CCNCO 55d154c6198aa4781c1600237013f9c3 [0,0,1,0,0,0|1,0,2]=4 168 B7R0.4 CC(C)CCOCF 5c4beb2cb4fc50a6f233dfe91cf9c945 [0,0,1,0,0,0|2,0,1]=4 169 B7R0.4 CC(C)CNCC#N adf92d7ae9fba28ad17a528a9bd32f1b [0,0,1,0,0,0|2,0,1]=4 170 B7R0.4 CC(C)CNCC=O e2e655e4d2528bc07c0e7e73f520729a [0,0,1,0,0,0|1,0,0]=2 171 B7R0.4 CC(C)CNCCBr 92559cb2ebacf0b0f5c92d38f861f670 [0,0,1,0,0,0|2,0,1]=4 172 B7R0.4 CC(C)CNCCF 14de296bc1a413c56debcce38ccc407f [0,0,1,0,0,0|2,0,1]=4 173 B7R0.4 CC(C)CNCCI 0dda19f31a767f7ffd847981f58c8b5f [0,0,1,0,0,0|2,0,1]=4 174 B7R0.4 CC(C)CNCCO bc40b3ae5c3a6adde3dd753071b81161 [0,0,1,0,0,0|1,0,2]=4 175 B7R0.4 CC(C)CNCCS 0f3531c02e7e4d73732ad308afcb17e1 [0,0,1,0,0,0|1,1,1]=4 176 B7R0.4 CC(C)COCC#N 7cb07814ea2e3e867e4666ea75f57343 [0,0,1,0,0,0|2,0,1]=4 177 B7R0.4 CC(C)COCC=O bd41a1e672abb592bd026a120b038c2b [0,0,1,0,0,0|1,0,0]=2 178 B7R0.4 CC(C)COCCF 83bb949d8c551562556937d0600d6efb [0,0,1,0,0,0|2,0,1]=4 179 B7R0.4 CC(C)COCCS 84ea4ff8f634d7739886cdbaa6625a00 [0,0,1,0,0,0|1,1,1]=4 180 B7R0.4 CC(C)NCCC#N d4400c07b449260898c72fb360a960eb [0,0,1,0,0,0|2,0,1]=4 181 B7R0.4 CC(C)NCCCCl 1f7b6a1eb64f799a69aafcb62f78849f [0,0,1,0,0,0|2,0,1]=4 182 B7R0.4 CC(C)NCCCO 8da9f776dfc6acc6ee817ae96d2c50e4 [0,0,1,0,0,0|1,0,2]=4 183 B7R0.4 CC(C)NCCON 0430106bca7b178ac757feef5057edc3 [0,0,1,0,0,0|3,0,0]=4 184 B7R0.4 CC(C)OC/C=C/Cl 91491ffbe45b122c593493ce1ec28e21 [0,0,1,0,0,0|2,0,1]=4 185 B7R0.4 CC(C)OC/C=C\Cl 1e6b64e528b3b312db8e7f5d9f5e401f [0,0,1,0,0,0|2,0,1]=4 186 B7R0.4 CC(C)OCC=CCl 05c2ee32f696ac6fe468daf78fa733c3 [0,0,1,0,0,0|2,0,1]=4 187 B7R0.4 CC(C)OCCC#N fd21c0fde146e79c4d1d9956f568a2be [0,0,1,0,0,0|2,0,1]=4 188 B7R0.4 CC(C)OCCC=O ccbf2d62dbd49bddcfe1567d50bb806b [0,0,1,0,0,0|1,0,0]=2 189 B7R0.4 CC(C)OCCCF 4d070417a783226fcc67bd342ecf7613 [0,0,1,0,0,0|2,0,1]=4 190 B7R0.4 CC(C)OCCCS 3817134d1cec338c192448359f8580cb [0,0,1,0,0,0|1,1,1]=4 191 B7R0.4 CC(F)COCC=O b46e29d4101a17f157843c4bdc730f6e [0,0,1,0,0,0|2,0,0]=3 192 B7R0.4 CC(O)CCNC=O 7d16a38d54e5204f080aee8a4fea20ce [0,0,1,0,0,0|2,0,0]=3 193 B7R0.4 CC(O)CNCC=O 944b3483ce03d29e552c3844291f44b6 [0,0,1,0,0,0|2,0,0]=3 194 B7R0.4 CC(S)COCC=O 15ebcb7a251dae8d81b8432f521474d6 [0,0,1,0,0,0|2,0,0]=3 195 B7R0.4 CC=CCNC(=O)C dc3e1d71e731895ff638118e5c964c13 [0,0,1,0,0,0|1,0,2]=4 196 B7R0.4 CC=CCNC(C)C fbbab91c5c0fa912c14bc0d774686380 [0,0,1,0,0,0|2,0,1]=4 197 B7R0.4 CC=CCOC(C)C 1ffcebdd116c02bae4b2efc3a6b36695 [0,0,1,0,0,0|2,0,1]=4 198 B7R0.4 CCCCNC(=O)C 0949c76abd7904d01e0aead7cd919e16 [0,0,1,0,0,0|1,0,0]=2 199 B7R0.4 CCCCNC(C)C 9cc424b21c3c2f75d1871abbaf0e1d28 [0,0,1,0,0,0|2,0,1]=4 200 B7R0.4 CCCCOC(C)C eb1bac952091f26d8e354583c355080c [0,0,1,0,0,0|2,0,1]=4 201 B7R0.4 CCCNCC(=O)C 99413200ab301de7320a2958deb213a6 [0,0,1,0,0,0|1,0,0]=2 202 B7R0.4 CCCNCC(=O)N c6bdb30f5ce304ac84a3a29975920160 [0,0,1,0,0,0|2,0,0]=3 203 B7R0.4 CCCNCC(=O)O 1172f6559bfe8e46309ea809f909cc38 [0,0,1,0,0,0|2,0,0]=3 204 B7R0.4 CCCNCC(C)C 639a6b9872838fc9d4295ca1293ac6f5 [0,0,1,0,0,0|2,0,1]=4 205 B7R0.4 CCCNCC(C)O daf3f68aedcfe9daf2326198322724f7 [0,0,1,0,0,0|1,0,2]=4 206 B7R0.4 CCCNCN(C)C 6cfa8606f274157e5146a9a1a1e43db8 [0,0,1,0,0,0|3,0,0]=4 207 B7R0.4 CCCNC[C@@H](C)O 69c59cd948a0a2ada3b8c8ccb896baca [0,0,1,0,0,0|1,0,2]=4 208 B7R0.4 CCCNC[C@H](C)O 72915868db71c51258a7b619113cc692 [0,0,1,0,0,0|1,0,2]=4 209 B7R0.4 CCCNC[N+](=O)[O-] 419587d101301b41277d69884923c893 [0,0,1,0,0,0|3,0,0]=4 210 B7R0.4 CCCOCC(=O)C 96075066d7d27bc87eaacf968c44bcad [0,0,1,0,0,0|1,0,0]=2 211 B7R0.4 CCCOCC(=O)N 96a8c77dd39980465075569d7697e39d [0,0,1,0,0,0|2,0,0]=3 212 B7R0.4 CCCOCC(=O)O 23aff310a77cf1d0723d729060ccc5ab [0,0,1,0,0,0|2,0,0]=3 213 B7R0.4 CCCOCC(=S)N de4cf6b87e1a0924ce6659273b2f578f [0,0,1,0,0,0|2,1,0]=4 214 B7R0.4 CCCOCC(C)C 519497356751b621892cf233de56054b [0,0,1,0,0,0|2,0,1]=4 215 B7R0.4 CCCOCC(C)F dd29a194f54e9c80d8edf1f9d80b8d74 [0,0,1,0,0,0|2,0,1]=4 216 B7R0.4 CCCOCC(C)S be744eae5a3365df2c9fc241f88d0c34 [0,0,1,0,0,0|1,1,1]=4 217 B7R0.4 CCCOCN(C)C 36ffd2679676671661da29a84172c95d [0,0,1,0,0,0|3,0,0]=4 218 B7R0.4 CCCOCS(=O)O 0f12db2563a680e281a3900efd4625e1 [0,0,1,0,0,0|3,0,0]=4 219 B7R0.4 CCCOC[C@@H](C)F 3e309754c30a5b79d5dc25a5081557ca [0,0,1,0,0,0|2,0,1]=4 220 B7R0.4 CCCOC[C@H](C)F 383eac738512a675ea10661fb503a531 [0,0,1,0,0,0|2,0,1]=4 221 B7R0.4 CCCOC[N+](=O)[O-] 57fc1d5897b3bb3312e1a8c9c07caf8c [0,0,1,0,0,0|3,0,0]=4 222 B7R0.4 CCNCC=C(C)C babbecd9a4b03d10475bf665994a7cc4 [0,0,1,0,0,0|2,0,1]=4 223 B7R0.4 CCNCCC(=O)N 41bbba81e733b9d1286775aca2565c1c [0,0,1,0,0,0|2,0,0]=3 224 B7R0.4 CCNCCC(=O)O 88c0515bc1747e6ea081f59eb14f48f3 [0,0,1,0,0,0|2,0,0]=3 225 B7R0.4 CCNCCC(=S)N 76a84de3aae7ce57b9732b2228d88da8 [0,0,1,0,0,0|2,1,0]=4 226 B7R0.4 CCNCCC(C)C 2bf33aa7c5d7ca27e591c3649dacf1c3 [0,0,1,0,0,0|2,0,1]=4 227 B7R0.4 CCNCCC(C)O 5c499b0d9d47b4ec3e33a3826caf6cf9 [0,0,1,0,0,0|1,0,2]=4 228 B7R0.4 CCNCCN(C)C 623f50aa4be9ebc8f28d6a0c3c6ed1a7 [0,0,1,0,0,0|3,0,0]=4 229 B7R0.4 CCNCCS(=O)C 6adfbd2d8fb4ec32091a9ce07fb581f6 [0,0,1,0,0,0|2,0,0]=3 230 B7R0.4 CCNCCS(=O)O 128b1e77080fe0113eae546bdfad2510 [0,0,1,0,0,0|3,0,0]=4 231 B7R0.4 CCNCC[C@@H](C)O 813fcf5ff2ae94275024925d2e59da87 [0,0,1,0,0,0|1,0,2]=4 232 B7R0.4 CCNCC[C@H](C)O ad44c8835227c03e0dd7a910fcfe11b6 [0,0,1,0,0,0|1,0,2]=4 233 B7R0.4 CCOC/C=C(/C)\Cl a79883948efe387ccbf8035e4bbbf803 [0,0,1,0,0,0|2,0,1]=4 234 B7R0.4 CCOC/C=C(/C)\I 31046cb5ab0b5fce8af568a1edb154c5 [0,0,1,0,0,0|2,0,1]=4 235 B7R0.4 CCOCC=C(C)C 24a34a23a06cf18457415c98f967840a [0,0,1,0,0,0|2,0,1]=4 236 B7R0.4 CCOCC=C(C)I 79d9eb8c50caa3a3f2106cdc9cdd7c84 [0,0,1,0,0,0|2,0,1]=4 237 B7R0.4 CCOCCC(=O)C cbf951a39aabdc9cae79b2b81520e5d8 [0,0,1,0,0,0|1,0,0]=2 238 B7R0.4 CCOCCC(=O)N 6008011299c8bcf06da6d1d485db82cf [0,0,1,0,0,0|2,0,0]=3 239 B7R0.4 CCOCCC(=O)O b43dd4fe6d8527741fde301ee2762516 [0,0,1,0,0,0|2,0,0]=3 240 B7R0.4 CCOCCC(C)C a81ef4c75f60509d0095bacdc570a8e6 [0,0,1,0,0,0|2,0,1]=4 241 B7R0.4 CCOCCN(C)C ea980176db95d583c8d1c23fca0674af [0,0,1,0,0,0|3,0,0]=4 242 B7R0.4 CCOCCS(=O)C 8e6e406da58bf76b276c249a0b39af9d [0,0,1,0,0,0|2,0,0]=3 243 B7R0.4 CCOCC[N+](=O)[O-] 8e5e0c25af9383a49962ecbafeaf1cdb [0,0,1,0,0,0|3,0,0]=4 244 B7R0.4 CCOCNC(=O)C b051a792d6529617bfbfb0a9edc5ad16 [0,0,1,0,0,0|2,0,0]=3 245 B7R0.4 CCOCNC(=O)N 7f110a3bce734439d6da5de9a8afdb1c [0,0,1,0,0,0|3,0,0]=4 246 B7R0.4 CN(C)CCNC=O f6c5ad5f38b9716c3e69f7010da88e20 [0,0,1,0,0,0|2,0,0]=3 247 B7R0.4 COCCNC(=O)C e9eb3353d96003a03a149314e2f5662c [0,0,1,0,0,0|2,0,0]=3 248 B7R0.4 COCCNC(C)C 0e10ac0a5c18c9b5426d9b26a3199f23 [0,0,1,0,0,0|3,0,0]=4 249 B7R0.4 COCCOC(C)C 66ff9033a5dadbe3413ec342d9a7c9fe [0,0,1,0,0,0|3,0,0]=4 250 B7R0.4 COCNCC(=O)C 1d22e2faae89557d184e6b77c70e18b9 [0,0,1,0,0,0|2,0,0]=3 251 B7R0.4 COCNCC(=O)N 5eb60c0a5f3dc108975679a2e84d9e64 [0,0,1,0,0,0|3,0,0]=4 252 B7R0.4 COCNCC(=O)O 63e693e6a6943d7d076b731aa43d021d [0,0,1,0,0,0|3,0,0]=4 253 B7R0.4 COCNCC(C)C 8a41f842449ec7e26a630827b8975a34 [0,0,1,0,0,0|3,0,0]=4 254 B7R0.4 COCOCC(=O)C 6ffd083eff8647662229227253b2a8dc [0,0,1,0,0,0|2,0,0]=3 255 B7R0.4 COCOCC(=O)N a86a9c95c6a98739f4d98d0cd39ad842 [0,0,1,0,0,0|3,0,0]=4 256 B7R0.4 COCOCC(=O)O a468e60279d972337d82cd5f7b4a85c0 [0,0,1,0,0,0|3,0,0]=4 257 B7R0.4 COCOCC(C)C 61a68151721001e97ead89f074e554c8 [0,0,1,0,0,0|3,0,0]=4 258 B7R0.4 CS(=O)CCNC=O 16cc205a7133a7d223ff6dc33bd772e5 [0,0,1,0,0,0|3,0,0]=4 259 B7R0.4 CS(=O)CCNCF d9c1484515d26db91a75e89c525299ec [0,0,1,0,0,0|3,0,0]=4 260 B7R0.4 CS(=O)CCNCO fdcf9e99993e02a092ff2e9d4ac90523 [0,0,1,0,0,0|3,0,0]=4 261 B7R0.4 CS(=O)CCOCF 834c76934e51318a147a2d0ae2e7b4a6 [0,0,1,0,0,0|3,0,0]=4 262 B7R0.4 CSCCNC(=O)C d94327ff4326745067a7a93e58177af9 [0,0,1,0,0,0|2,0,0]=3 263 B7R0.4 CSCCNC(C)C 145dbc599c93a8d182d58abe78ded108 [0,0,1,0,0,0|3,0,0]=4 264 B7R0.4 CSCCOC(C)C 898b6e38b775cb6892ffe8b724ad6a1f [0,0,1,0,0,0|3,0,0]=4 265 B7R0.4 CSCNCC(=O)C 45bb082b9a0036036408483af8cc43e5 [0,0,1,0,0,0|2,0,0]=3 266 B7R0.4 CSCNCC(=O)N 25bde4292d4cdcaec203d3d8eb65b798 [0,0,1,0,0,0|3,0,0]=4 267 B7R0.4 CSCNCC(=O)O 5c5440b473179a79f0a0bde7f261b934 [0,0,1,0,0,0|3,0,0]=4 268 B7R0.4 CSCNCC(C)C af947b38f43b5b920a6aa47378596e00 [0,0,1,0,0,0|3,0,0]=4 269 B7R0.4 CSCOCC(=O)C a99e30955cce4bbe9c0c1e4d13a22534 [0,0,1,0,0,0|2,0,0]=3 270 B7R0.4 CSCOCC(=O)N 26834a3c15e8ab4b1f28f8e0ba47eea5 [0,0,1,0,0,0|3,0,0]=4 271 B7R0.4 CSCOCC(=O)O bc53fc5d2082b4879e00ca1b9daacd0d [0,0,1,0,0,0|3,0,0]=4 272 B7R0.4 CSCOCC(C)C 2e75b1421641e4cf6bcc7f6e6907b733 [0,0,1,0,0,0|3,0,0]=4 273 B7R0.4 C[C@@H](F)COCC=O dfd322669411a585629980eb6b5be0dd [0,0,1,0,0,0|2,0,0]=3 274 B7R0.4 C[C@@H](O)CCNC=O 063b940170a2cb4a98efeca14a33a52e [0,0,1,0,0,0|2,0,0]=3 275 B7R0.4 C[C@@H](O)CNCC=O ae52f375140c99168e4849031ee267c7 [0,0,1,0,0,0|2,0,0]=3 276 B7R0.4 C[C@H](F)COCC=O 41a7eddb5d50f5c0a8a1cffec2a2d618 [0,0,1,0,0,0|2,0,0]=3 277 B7R0.4 C[C@H](O)CCNC=O cef20fefdcc1f37d90fc224277e1f868 [0,0,1,0,0,0|2,0,0]=3 278 B7R0.4 C[C@H](O)CNCC=O 58f727508ba2f4be3dc454ceda8497a8 [0,0,1,0,0,0|2,0,0]=3 279 B7R0.4 NC(=O)CCNCF 20ec4b7c637071ae24e3cdf4bbdc4bb7 [0,0,1,0,0,0|3,0,0]=4 280 B7R0.4 NC(=O)CCNCO 8d6a6b05e8f134f68517fe004903b837 [0,0,1,0,0,0|3,0,0]=4 281 B7R0.4 NC(=O)CCOCF 7d212825caf98dd8861bf8614019cc84 [0,0,1,0,0,0|3,0,0]=4 282 B7R0.4 NC(=O)CNCCBr efd5ac610f3bf0af030019a2a0ff4ee3 [0,0,1,0,0,0|3,0,0]=4 283 B7R0.4 NC(=O)CNCCF 88409f29ce1f997fc9276ae451d20bd9 [0,0,1,0,0,0|3,0,0]=4 284 B7R0.4 NC(=O)CNCCI 0c80ee12c3f6bb203c2aa04fa4e00ea0 [0,0,1,0,0,0|3,0,0]=4 285 B7R0.4 NC(=O)CNCCO 02184e14b25877b3290e4ad2b4992b8c [0,0,1,0,0,0|3,0,0]=4 286 B7R0.4 NC(=O)CNCCS eabeface6d5825fa54ff76a59eda8562 [0,0,1,0,0,0|3,0,0]=4 287 B7R0.4 NC(=O)COCCF d469c79637b991c6fca3d07cba643bba [0,0,1,0,0,0|3,0,0]=4 288 B7R0.4 NC(=O)COCCS cb3082506d52145df233a7d6870ad15a [0,0,1,0,0,0|3,0,0]=4 289 B7R0.4 O=C(O)CCNCF 05f9560a9c5090f2158d127e76253bb5 [0,0,1,0,0,0|3,0,0]=4 290 B7R0.4 O=C(O)CCNCO 4eda81a5ddb9ef19630be70331f35e71 [0,0,1,0,0,0|3,0,0]=4 291 B7R0.4 O=C(O)CCOCF 47a2f1a64d70f1fd70ee05dd145bf666 [0,0,1,0,0,0|3,0,0]=4 292 B7R0.4 O=C(O)CNCCBr 8130f29cad0df7ca3ee5b483ea3f0ae7 [0,0,1,0,0,0|3,0,0]=4 293 B7R0.4 O=C(O)CNCCF 6ae595578428cb8e8437866b629b8546 [0,0,1,0,0,0|3,0,0]=4 294 B7R0.4 O=C(O)CNCCI b126f2904311dc397f067e9011020ab9 [0,0,1,0,0,0|3,0,0]=4 295 B7R0.4 O=C(O)CNCCO 8a2a254c2a92a8e0b0d875df2fbb7a98 [0,0,1,0,0,0|3,0,0]=4 296 B7R0.4 O=C(O)CNCCS a3afb9ba49fa1ab4342d38d48d1d7ee5 [0,0,1,0,0,0|3,0,0]=4 297 B7R0.4 O=C(O)COCCF 0bf6b93a21a854bfb19752b49752a6aa [0,0,1,0,0,0|3,0,0]=4 298 B7R0.4 O=C(O)COCCS d255bc31bb2be8a37fe42b47fabd36dd [0,0,1,0,0,0|3,0,0]=4 299 B7R0.4 O=CCNCC(F)F 824b7b6840181b3cfa0b763b1d812fba [0,0,1,0,0,0|3,0,0]=4 300 B7R0.4 O=CCOCC(F)F e1093cd74239d1a778019e251c691d5f [0,0,1,0,0,0|3,0,0]=4 301 B7R0.4 O=CNCCC(F)F 877595b7c20a3f088e215ffd3de33ece [0,0,1,0,0,0|3,0,0]=4 302 B7R0.7 C#CCC(C)OCC c1f6c314cdd73a7fa8ad58ddb797863b [0,0,1,0,0,0|2,0,1]=4 303 B7R0.7 C#CCN(C)CC=O dff01d702c39ab67a4f96703b4d65557 [0,0,1,0,0,0|1,0,2]=4 304 B7R0.7 C#CCN(C)CCC 612e0a8dc259a7d3bd70bcd5ce21a061 [0,0,1,0,0,0|2,0,1]=4 305 B7R0.7 C/C=C/C(C)OCC 2ab4f7797f6c67b991e2e31923687bf2 [0,0,1,0,0,0|2,0,1]=4 306 B7R0.7 C=CCC(C)OCC e661cd10cce572a7601633678f7f6510 [0,0,1,0,0,0|2,0,0]=3 307 B7R0.7 C=CCC(C)OCF 2ea57e9504db84bdaa251cea2b6d235a [0,0,1,0,0,0|3,0,0]=4 308 B7R0.7 C=CCN(C)CC=O 0a0a0470779380dc482d888ec7270821 [0,0,1,0,0,0|1,0,2]=4 309 B7R0.7 C=CCN(C)CCC 4db190253ad01fc85a9136b104142548 [0,0,1,0,0,0|2,0,0]=3 310 B7R0.7 C=CCN(C)CCF b31bc09de38c09b7eacc67cab349dd8e [0,0,1,0,0,0|3,0,0]=4 311 B7R0.7 C=CCN(C)CCO 979ac659399c5cc5526a5ffaafb300dd [0,0,1,0,0,0|3,0,0]=4 312 B7R0.7 C=CCN(C)CCS 39ef2c909095bde90a27bd83d01eb339 [0,0,1,0,0,0|3,0,0]=4 313 B7R0.7 C=CCN(C)COC 36534bf3b31eb577cc61ba87a9d55a6b [0,0,1,0,0,0|3,0,0]=4 314 B7R0.7 C=CCN(C)CSC f1be06c214da72bca84cecc462a1a3ad [0,0,1,0,0,0|3,0,0]=4 315 B7R0.7 C=CC[C@@H](C)OCC 077d825b2d79fe5b7d34cfc8a591b694 [0,0,1,0,0,0|2,0,0]=3 316 B7R0.7 C=CC[C@@H](C)OCF 51977b3390daf4ec7d8c8b67e41f6ec4 [0,0,1,0,0,0|3,0,0]=4 317 B7R0.7 C=CC[C@H](C)OCC 67560b27043d123cb27b1dfe36dce4bb [0,0,1,0,0,0|2,0,0]=3 318 B7R0.7 C=CC[C@H](C)OCF e1a26aac47576e318dc06827e291df9a [0,0,1,0,0,0|3,0,0]=4 319 B7R0.7 CC(CC#N)NC=O dfc1f8290024fbf8549fe517f54abe5f [0,0,1,0,0,0|2,0,1]=4 320 B7R0.7 CC(CCO)NC=O 892cc7a0d08c79535b8216399ec9a52d [0,0,1,0,0,0|2,0,0]=3 321 B7R0.7 CC=CC(C)OCC 5361522f2e573115d5b96113c76c93d1 [0,0,1,0,0,0|2,0,1]=4 322 B7R0.7 CCCC(=O)NC#N 766b016c5624be50103f3a22e25698f4 [0,0,1,0,0,0|2,0,1]=4 323 B7R0.7 CCCC(=S)OCC 1c7e19bdea536ef2f89edad836560238 [0,0,1,0,0,0|1,1,0]=3 324 B7R0.7 CCCC(=S)OCF 8dc901968f3491ced45b3f4cde755440 [0,0,1,0,0,0|2,1,0]=4 325 B7R0.7 CCCC(C)NC#N 6ccb4a7f9bfbd442a47f4d4e2e5f0f39 [0,0,1,0,0,0|2,0,1]=4 326 B7R0.7 CCCC(C)NC=O 3b3fdc3aff176c80def2c27de1055661 [0,0,1,0,0,0|1,0,0]=2 327 B7R0.7 CCCC(C)NCC 30687af6c4de8dad0ff98831d5157fbe [0,0,1,0,0,0|2,0,1]=4 328 B7R0.7 CCCC(C)NCF 6fe7178c87e8240823259ce8a94eea0d [0,0,1,0,0,0|2,0,1]=4 329 B7R0.7 CCCC(C)NCO a80a7e4a0f1d75fc2436d616e073099f [0,0,1,0,0,0|1,0,2]=4 330 B7R0.7 CCCC(C)OCC f8a13dff786165aad9d4cfd77470c868 [0,0,1,0,0,0|2,0,1]=4 331 B7R0.7 CCCC(C)OCF e53aa9a0be571d844376e05ef43b0243 [0,0,1,0,0,0|2,0,1]=4 332 B7R0.7 CCCN(C)CC#N c34e551c8e457e324f03b5cf2a22f014 [0,0,1,0,0,0|2,0,1]=4 333 B7R0.7 CCCN(C)CC=O 1c62a002dac50aaed88f0fc6ab9f5e8c [0,0,1,0,0,0|1,0,0]=2 334 B7R0.7 CCCN(C)CCC e4ba1afb5991f60dfc5178c264d147ac [0,0,1,0,0,0|2,0,0]=3 335 B7R0.7 CCCN(C)CCF 20bdd855ba3f41de089f8838592d613e [0,0,1,0,0,0|2,0,1]=4 336 B7R0.7 CCCN(C)CCO 78d0d1ebbc45bccd6d086b71283c0541 [0,0,1,0,0,0|1,0,2]=4 337 B7R0.7 CCCN(C)CCS b66b0b7cd1a916850f3ad9b440f8c270 [0,0,1,0,0,0|1,1,1]=4 338 B7R0.7 CCCN(C)COC 1bec3c8fb3df3a096c65e4d1b6c5e3f1 [0,0,1,0,0,0|3,0,0]=4 339 B7R0.7 CCCN(C)CSC 08af67ba2c61bafd912a4ccbd1478a94 [0,0,1,0,0,0|3,0,0]=4 340 B7R0.7 CCC[C@@H](C)OCC ad566fabe40b68a5eff8830d607c6d5f [0,0,1,0,0,0|2,0,1]=4 341 B7R0.7 CCC[C@@H](C)OCF 7663802c803efdb5ffdb71e415c741b7 [0,0,1,0,0,0|2,0,1]=4 342 B7R0.7 CCC[C@H](C)NC=O d7593154c1a9fc5db070af269735e419 [0,0,1,0,0,0|1,0,0]=2 343 B7R0.7 CCC[C@H](C)NCC 753d5a7572fe2b9f2fd164a2491a308c [0,0,1,0,0,0|2,0,1]=4 344 B7R0.7 CCC[C@H](C)NCF bb5a2f2a6bcb2a0616cca7690ac17090 [0,0,1,0,0,0|2,0,1]=4 345 B7R0.7 CCC[C@H](C)NCO b51a8cc4d30d5ddff8232517fc6ea6d0 [0,0,1,0,0,0|1,0,2]=4 346 B7R0.7 CCC[C@H](C)OCC 1fee3bcf808f20e21cce64abf5182523 [0,0,1,0,0,0|2,0,1]=4 347 B7R0.7 CCC[C@H](C)OCF aaf4041a99f006e154459098e0beb231 [0,0,1,0,0,0|2,0,1]=4 348 B7R0.7 CCNC(C)CC#N 896c231cd495c6357e72819fab470c66 [0,0,1,0,0,0|2,0,1]=4 349 B7R0.7 CCNC(C)CCO 6d74a4cbe1e8603263eb7a06e9e0b8fd [0,0,1,0,0,0|1,0,2]=4 350 B7R0.7 CCNC(C)COC af3d09b9c16b18b44031a6b489b2fd56 [0,0,1,0,0,0|3,0,0]=4 351 B7R0.7 CCN[C@@H](C)CCO 120d76e4d5f3a5851fb1fd775a67dcd3 [0,0,1,0,0,0|1,0,2]=4 352 B7R0.7 CCN[C@@H](C)COC 3587673ce83b198299c531f233570bde [0,0,1,0,0,0|3,0,0]=4 353 B7R0.7 CCN[C@H](C)CCO d88e997127477e2d2a92514b9d55e900 [0,0,1,0,0,0|1,0,2]=4 354 B7R0.7 CCN[C@H](C)COC 769259f23e0c7be858a9664721e9e588 [0,0,1,0,0,0|3,0,0]=4 355 B7R0.7 CCOC(C)CC#N 74c7ff950e02e978c381dad00f0222ea [0,0,1,0,0,0|2,0,1]=4 356 B7R0.7 CCOC(C)COC fe243350564a7dc6ae1ae7113d5524f6 [0,0,1,0,0,0|3,0,0]=4 357 B7R0.7 CCOC(C)CSC e325c79726bf48130f9e676fa3908dca [0,0,1,0,0,0|3,0,0]=4 358 B7R0.7 CCO[C@@H](C)CC#N 79f640333f75719e0019c555e2ed7c25 [0,0,1,0,0,0|2,0,1]=4 359 B7R0.7 CCO[C@@H](C)COC f439908527642fb0fb69029fa9f8bc89 [0,0,1,0,0,0|3,0,0]=4 360 B7R0.7 CCO[C@H](C)CC#N 853352ce16f989e76716e5f2635f2407 [0,0,1,0,0,0|2,0,1]=4 361 B7R0.7 CCO[C@H](C)COC 9a86a7ea1ccd0f751a8074ffc2bb4277 [0,0,1,0,0,0|3,0,0]=4 362 B7R0.7 CN(CC#N)CC=O 12ba89d8d84c8f98fbf202698aed3177 [0,0,1,0,0,0|2,0,1]=4 363 B7R0.7 CN(CC=O)CCF e000d0184f9f374c5d6d2759945d9138 [0,0,1,0,0,0|2,0,0]=3 364 B7R0.7 CN(CC=O)CCO c9392a8ee79c46afd21599c8df016274 [0,0,1,0,0,0|2,0,0]=3 365 B7R0.7 COCC(C)NC=O 45a0b649e4600219d555cc1f9498bdc8 [0,0,1,0,0,0|2,0,0]=3 366 B7R0.7 COC[C@@H](C)NC=O d1500602ed7da53624fa7ed4337a50c3 [0,0,1,0,0,0|2,0,0]=3 367 B7R0.7 COC[C@H](C)NC=O 9ace0af38b8cac4dc5e5d6d9564d36a8 [0,0,1,0,0,0|2,0,0]=3 368 B7R0.7 C[C@@H](CCO)NC=O eb95ec52954fcdf5dbae515a1b580040 [0,0,1,0,0,0|2,0,0]=3 369 B7R0.7 C[C@H](CCO)NC=O b74e456417922c93cc7901b1f7160ec1 [0,0,1,0,0,0|2,0,0]=3 370 B6R0.1 C=CC(C)NCC 948c94c892befefe9756783e6d4a372c [1,0,1,0,0,0|1,0,1]=4 371 B6R0.1 C=CC(C)OCC 56eed946f70859c9519e59c17b27f8ec [1,0,1,0,0,0|1,0,1]=4 372 B6R0.1 C=CCN(C)CC 66590de6b708bb2b2b2945a656dd0b8f [1,0,1,0,0,0|1,0,1]=4 373 B6R0.1 C=C[C@H](C)OCC 1f2a0e5dd56f9e416c2e4c2822c0bb6e [1,0,1,0,0,0|1,0,1]=4 374 B6R0.1 CC(C=O)OCF 65789c25ac421199f1e20366eb603500 [1,0,1,0,0,0|2,0,0]=4 375 B6R0.1 CC(CO)NC=O 6cb3b07738b3559c75de386eaa588767 [1,0,1,0,0,0|2,0,0]=4 376 B6R0.1 CCC(C)NC=O b39ff0b918608a651b17fb1bcfe748b2 [1,0,1,0,0,0|1,0,0]=3 377 B6R0.1 CCCN(C)C=O f55d615150194d8a2881f113e75957ad [1,0,1,0,0,0|1,0,0]=3 378 B6R0.1 CCCN(C)CC 063caa89be0fdd356f6455d1751457ac [1,0,1,0,0,0|1,0,1]=4 379 B6R0.1 CCCN(C)CF 5c995bfd39cfefd185b6001ca8e730f3 [1,0,1,0,0,0|2,0,0]=4 380 B6R0.1 CCCN(C)CO fa8c399923bf908abe4d1198e252c43d [1,0,1,0,0,0|1,0,1]=4 381 B6R0.1 CCN(C)CC=O 027065f0dd139518bb2cdfff7d6533ae [1,0,1,0,0,0|1,0,0]=3 382 B6R0.1 CCN(C)COC 2dba1e0fec030895fe26248c793df52e [1,0,1,0,0,0|2,0,0]=4 383 B6R0.1 CCN(C)CSC 613c63b39ee46a6bdda90b076e70e35a [1,0,1,0,0,0|2,0,0]=4 384 B6R0.1 CCNC(C)CC 396d13a5c682c09283d5fcc86ff55a86 [1,0,1,0,0,0|1,0,1]=4 385 B6R0.1 CCNC(C)CO 31c32677d35319c7bce72f49aa59533d [1,0,1,0,0,0|1,0,1]=4 386 B6R0.1 CCN[C@@H](C)CC 8864275bc593322b499f8ffa253a175e [1,0,1,0,0,0|1,0,1]=4 387 B6R0.1 CCN[C@@H](C)CO 1b5cec79590e2129f58d3514073a1390 [1,0,1,0,0,0|1,0,1]=4 388 B6R0.1 CCN[C@H](C)CC 2ca98ce961a0f1b51c5b9bb18e4cf730 [1,0,1,0,0,0|1,0,1]=4 389 B6R0.1 CCN[C@H](C)CO 4334eb4497c625ddabbfceeac7d82066 [1,0,1,0,0,0|1,0,1]=4 390 B6R0.1 CCOC(C)C=O 4021b7076259f80e1751543881198165 [1,0,1,0,0,0|1,0,0]=3 391 B6R0.1 CCOC(C)CC 56a4de537882754d70714e008cda003f [1,0,1,0,0,0|1,0,1]=4 392 B6R0.1 CCOC(C)CF 65f06da7a639a9baf133860813b79ea3 [1,0,1,0,0,0|2,0,0]=4 393 B6R0.1 CCOC(C)CS eb3404d1a98d8fb6f364ecf6e98ac96e [1,0,1,0,0,0|1,1,0]=4 394 B6R0.1 CCO[C@@H](C)CC 1c34d8425f39e9be808db66bb381a14c [1,0,1,0,0,0|1,0,1]=4 395 B6R0.1 CCO[C@H](C)CC 08a1e8fcc5a32008da3650c30e1472a7 [1,0,1,0,0,0|1,0,1]=4 396 B6R0.1 CCO[C@H](C)CS 7d1ac13ead965fd5112ee05598239ca1 [1,0,1,0,0,0|1,1,0]=4 397 B6R0.1 CC[C@@H](C)NC=O b2daaabeaf297395c554f58ded1a06ac [1,0,1,0,0,0|1,0,0]=3 398 B6R0.1 CC[C@H](C)NC=O de5ee03736ab09026768085a3122631f [1,0,1,0,0,0|1,0,0]=3 399 B6R0.1 CN(C=O)CCF 566a91d7f905563b8be9527ff042caf1 [1,0,1,0,0,0|2,0,0]=4 400 B6R0.1 CN(C=O)CCO dd7ac64299075a3391875b374e6c88cd [1,0,1,0,0,0|2,0,0]=4 401 B6R0.1 C[C@@H](CO)NC=O ec3f1323844b2b166f286f44082a1734 [1,0,1,0,0,0|2,0,0]=4 402 B6R0.1 C[C@H](CO)NC=O 3cbedcbe22de2e07327f619fdeffeaec [1,0,1,0,0,0|2,0,0]=4 403 B6R0.4 C=C(C)CNCC ebc18c3c665b43c324efb5852b5613cc [1,0,1,0,0,0|2,0,0]=4 404 B6R0.4 C=C(C)COCC 6d74b37620be58d1bea5b1911ab2feb1 [1,0,1,0,0,0|2,0,0]=4 405 B6R0.4 C=CCOC(C)C 041109637968f56803a7bcb6b6bd0ab7 [1,0,1,0,0,0|1,0,1]=4 406 B6R0.4 CC(=O)CNCF b7881e88fb8b8e6cf10e5a033e11f317 [1,0,1,0,0,0|2,0,0]=4 407 B6R0.4 CC(=O)CNCO 088e087d20fb510bb88def586900e34f [1,0,1,0,0,0|2,0,0]=4 408 B6R0.4 CC(=O)COCF dfbfbe0c756744937aaeae603856ac60 [1,0,1,0,0,0|2,0,0]=4 409 B6R0.4 CC(=O)NCCBr a50b84b8e00a5eea33926a7cde86e5c2 [1,0,1,0,0,0|2,0,0]=4 410 B6R0.4 CC(=O)NCCF 40474d3cc8ff0aef7c3ef76344b9eebb [1,0,1,0,0,0|2,0,0]=4 411 B6R0.4 CC(=O)NCCI baf3590450994f173452759880fb646a [1,0,1,0,0,0|2,0,0]=4 412 B6R0.4 CC(=O)NCCO c7b03ecf194f0f03f4d08fd319920ef5 [1,0,1,0,0,0|2,0,0]=4 413 B6R0.4 CC(=O)NCCS 3cdd66626928bc1a9bac11e682b344a1 [1,0,1,0,0,0|2,0,0]=4 414 B6R0.4 CC(C)CNC=O e82c18370445f70bde3f0aa61f9296e6 [1,0,1,0,0,0|1,0,0]=3 415 B6R0.4 CC(C)CNCF 8978b44d87fa42438515590def89eb79 [1,0,1,0,0,0|2,0,0]=4 416 B6R0.4 CC(C)CNCO c3b5fde83cdd81c2f0ea167064fd2c5c [1,0,1,0,0,0|1,0,1]=4 417 B6R0.4 CC(C)COCF b089fa536e65fca20df885ea5dacd9f2 [1,0,1,0,0,0|2,0,0]=4 418 B6R0.4 CC(C)NCCBr a3900e505497b08f4c9baca17b4fa185 [1,0,1,0,0,0|2,0,0]=4 419 B6R0.4 CC(C)NCCF 3152aefd56bd5a8bc9f6ac7f33a6fcdb [1,0,1,0,0,0|2,0,0]=4 420 B6R0.4 CC(C)NCCI 61300b723cb63b92262a59e1c054336d [1,0,1,0,0,0|2,0,0]=4 421 B6R0.4 CC(C)NCCO 3b0ca7166ca7093e2a2ed1b091b6c5af [1,0,1,0,0,0|1,0,1]=4 422 B6R0.4 CC(C)NCCS cdea7056049e21082f31ef0c239da6f7 [1,0,1,0,0,0|1,1,0]=4 423 B6R0.4 CC(C)OCC=O 656e3e823b109ec9cd57494110924cc8 [1,0,1,0,0,0|1,0,0]=3 424 B6R0.4 CC(C)OCCF 102209588400e8045c1b7317560b3baf [1,0,1,0,0,0|2,0,0]=4 425 B6R0.4 CC(C)OCCS 9f8fcde0a26cdc1f53f7ed80bebd9fd6 [1,0,1,0,0,0|1,1,0]=4 426 B6R0.4 CC(O)CNC=O 8669f80d50d055de0db4e7936b8a26b4 [1,0,1,0,0,0|2,0,0]=4 427 B6R0.4 CCCNC(=O)C 2a730f252c249036b45b0d2d9cd73ca4 [1,0,1,0,0,0|1,0,0]=3 428 B6R0.4 CCCNC(C)C 4cc952815a9d9d6816d0fb90ac14a178 [1,0,1,0,0,0|1,0,1]=4 429 B6R0.4 CCCOC(C)C 9e8901dd10ed96aa593b6a5525365a05 [1,0,1,0,0,0|1,0,1]=4 430 B6R0.4 CCNCC(=O)C f174d94c45d739e3b909d0bcb7f774b6 [1,0,1,0,0,0|1,0,0]=3 431 B6R0.4 CCNCC(=O)N 9af72e08b410c4df60bd96241a267974 [1,0,1,0,0,0|2,0,0]=4 432 B6R0.4 CCNCC(=O)O 4ff54ca579c6d0dc364629f4b9806db8 [1,0,1,0,0,0|2,0,0]=4 433 B6R0.4 CCNCC(C)C 7e39c7f79a4a74429f1ae559b7eef67a [1,0,1,0,0,0|1,0,0]=3 434 B6R0.4 CCNCC(C)O 23f38b24d1514a42c01693786c45a1e6 [1,0,1,0,0,0|2,0,0]=4 435 B6R0.4 CCNC[C@@H](C)O 72a96453a23c9791f4ab7ea0647d5c76 [1,0,1,0,0,0|2,0,0]=4 436 B6R0.4 CCNC[C@H](C)O 8a893664491d34251811ef315cfcf0f6 [1,0,1,0,0,0|2,0,0]=4 437 B6R0.4 CCOCC(=O)C 810b545b1a0c4af358d406c93928b4de [1,0,1,0,0,0|1,0,0]=3 438 B6R0.4 CCOCC(=O)N 8c3995d7bbe4bbb5793da2590cf6473e [1,0,1,0,0,0|2,0,0]=4 439 B6R0.4 CCOCC(=O)O ebe16b0612391447f19756491b2bd7a3 [1,0,1,0,0,0|2,0,0]=4 440 B6R0.4 CCOCC(C)C 2ccacce0745bb2fe2e67c6f95de49a4c [1,0,1,0,0,0|1,0,0]=3 441 B6R0.4 CCOCC(C)F 44ebcc9497b122666f7d5bc3ab3ef961 [1,0,1,0,0,0|2,0,0]=4 442 B6R0.4 CCOCC(C)S 1b6e2c538b0c5040f1c381953bd73f14 [1,0,1,0,0,0|2,0,0]=4 443 B6R0.4 CCOC[C@@H](C)F 2d70ac2d3ad9d2770f50309e83cd9521 [1,0,1,0,0,0|2,0,0]=4 444 B6R0.4 CCOC[C@H](C)F b1411946299fa054261b7f4dedb203a5 [1,0,1,0,0,0|2,0,0]=4 445 B6R0.4 C[C@@H](O)CNC=O 893e330470131b7f4e3b63b1afe5eaa3 [1,0,1,0,0,0|2,0,0]=4 446 B6R0.4 C[C@H](O)CNC=O 3f425a15e29afb471d950c9316d4c9b2 [1,0,1,0,0,0|2,0,0]=4 447 B6R0.6 C/C=C/COCC 38bee8c8a9ca6a51c65d50ef4a373d85 [1,0,1,0,0,0|1,0,1]=4 448 B6R0.6 C/C=C\COCC ec2c513a47c68c3910a66e2b1ca05a58 [1,0,1,0,0,0|1,0,1]=4 449 B6R0.6 C=CCCNCC e2aebda5e16fd2d2916f2bc1829c315b [1,0,1,0,0,0|1,0,1]=4 450 B6R0.6 C=CCCOCC 6e23d9941af9b2d0c85f8cbdda9dfc6d [1,0,1,0,0,0|1,0,1]=4 451 B6R0.6 C=CCNCCC 4ba17ed70ce803f63c3c4c2f245e9995 [1,0,1,0,0,0|1,0,1]=4 452 B6R0.6 C=CCOCCC 1dbb1c31b2e886af57d9e977bbb54c80 [1,0,1,0,0,0|1,0,1]=4 453 B6R0.6 CC=CCNCC bcab2e681f9487cbafa8d0c52ed70b5a [1,0,1,0,0,0|1,0,1]=4 454 B6R0.6 CC=CCOCC 1bf4842cf68ff7130be8f9549d740c80 [1,0,1,0,0,0|1,0,1]=4 455 B6R0.6 CCCCNC=O 1d6cf15c52b7bdddc1e5bbdb0b9deb3d [1,0,1,0,0,0|1,0,0]=3 456 B6R0.6 CCCCNCC 92b5580e2e0a5bde623d85d4114fa5b8 [1,0,1,0,0,0|1,0,1]=4 457 B6R0.6 CCCCOCC 95dd02bf16a1c429e6d73e015abd355f [1,0,1,0,0,0|1,0,1]=4 458 B6R0.6 CCCNCC=O 6f90aab08cc8a4799f8c9819fe03dcf0 [1,0,1,0,0,0|1,0,0]=3 459 B6R0.6 CCCNCCBr 4580e94d6156274002f94ca88fed008a [1,0,1,0,0,0|2,0,0]=4 460 B6R0.6 CCCNCCC 1b094650055fd0b18522f92a665c0499 [1,0,1,0,0,0|1,0,0]=3 461 B6R0.6 CCCNCCF 735cf6bc8c20816e92fa14d59534e4a3 [1,0,1,0,0,0|2,0,0]=4 462 B6R0.6 CCCNCCI 005cf13853f56eac57a7dac0ea522018 [1,0,1,0,0,0|2,0,0]=4 463 B6R0.6 CCCNCCO 6b27698ebbebd4cb74f83b272f0d15e6 [1,0,1,0,0,0|2,0,0]=4 464 B6R0.6 CCCNCCS 99a3fb47b747dc1242515be7d85bbd80 [1,0,1,0,0,0|2,0,0]=4 465 B6R0.6 CCCNCOC e97c2d5a22ce001afa1236daa1cad7bc [1,0,1,0,0,0|2,0,0]=4 466 B6R0.6 CCCNCSC 9d2bba1337aa149b0d3e1fa022653bf5 [1,0,1,0,0,0|2,0,0]=4 467 B6R0.6 CCCOCC=O a311990c6ea11edb5945b3bbc64330c1 [1,0,1,0,0,0|1,0,0]=3 468 B6R0.6 CCCOCCC 0a4e87c7914309a78635e74e08d2777c [1,0,1,0,0,0|1,0,0]=3 469 B6R0.6 CCCOCCF 89739e8ca8e097a040faf9b1b5d8fe97 [1,0,1,0,0,0|2,0,0]=4 470 B6R0.6 CCCOCCS 0132493e794a98d77c26358a94dc4e29 [1,0,1,0,0,0|2,0,0]=4 471 B6R0.6 CCCOCOC c11e71c41afe194d616e687f4176c864 [1,0,1,0,0,0|2,0,0]=4 472 B6R0.6 CCCOCSC 1c1d3e4eeaee5d66440c30d368585d8f [1,0,1,0,0,0|2,0,0]=4 473 B6R0.6 CCNCCOC f1fb223c89b0752d151e88a41e5b29d9 [1,0,1,0,0,0|2,0,0]=4 474 B6R0.6 CCNCCSC 3a09ff3676749a10d2a9ca69484831c2 [1,0,1,0,0,0|2,0,0]=4 475 B6R0.6 CCOCCC=O d3b853feb6192f624a9d6e96cbf29efa [1,0,1,0,0,0|1,0,0]=3 476 B6R0.6 CCOCCOC dd0438a106c25c5532b546a1007f90ac [1,0,1,0,0,0|2,0,0]=4 477 B6R0.6 CCOCCSC 5ebca3b7e051ee8b31eb2b56fedcebce [1,0,1,0,0,0|2,0,0]=4 478 B6R0.6 COCCNC=O a492c5e448492de86be811dda47a14fa [1,0,1,0,0,0|2,0,0]=4 479 B6R0.6 COCOCC=O 8fbd0ca4cabb5e823c04e12302889616 [1,0,1,0,0,0|2,0,0]=4 480 B6R0.6 CSCCNC=O 64c5f2b7b4373c36dc6e266bf8eaef67 [1,0,1,0,0,0|2,0,0]=4 481 B6R0.6 O=CCCOCF 8caf1bfe380e15fd4f770dc31d80b710 [1,0,1,0,0,0|2,0,0]=4 482 B6R0.6 O=CCNCCBr 7f568f9e360d41a253fcf8819356fa07 [1,0,1,0,0,0|2,0,0]=4 483 B6R0.6 O=CCNCCF dd3d83ca6df75c2a1eb5d1658b3a79f1 [1,0,1,0,0,0|2,0,0]=4 484 B6R0.6 O=CCNCCI 6fab095304600b7f13dbb8e04b2ca4cb [1,0,1,0,0,0|2,0,0]=4 485 B6R0.6 O=CCNCCO e6f1437c7e7236c4dcd52e0503433b68 [1,0,1,0,0,0|2,0,0]=4 486 B6R0.6 O=CCNCCS 370a4d5b8fa12c00fc5b9baca6825542 [1,0,1,0,0,0|2,0,0]=4 487 B6R0.6 O=CCOCCF 52eac958c7e22959ee04b75c2f64dd9f [1,0,1,0,0,0|2,0,0]=4 488 B6R0.6 O=CCOCCS 87be380c7b8a8ef700f2d28d409dd9de [1,0,1,0,0,0|2,0,0]=4 489 B6R0.6 O=CNCCCCl 3c2b93c26ca4c02fdf2ab75c703ceca5 [1,0,1,0,0,0|2,0,0]=4 490 B6R0.6 O=CNCCCO a96c8d7ee94dc67d16d365c33488e6be [1,0,1,0,0,0|2,0,0]=4 491 B8R0.2 CC(=O)N(C)C(C)CO 954909c32608c887b20279d0f2f3780c [0,1,1,0,0,0|2,0,0]=4 492 B8R0.2 CC(=O)N(C)[C@@H](C)CO 225dc8a4ffcea4cd61a90a38a4080118 [0,1,1,0,0,0|2,0,0]=4 493 B8R0.2 CC(=O)N(C)[C@H](C)CO de33b62e9836c68164793809e4e8e5b1 [0,1,1,0,0,0|2,0,0]=4 494 B8R0.2 CC(C)N(C)C(=O)CO d1898419d3ec12ff050916a4a6cb896f [0,1,1,0,0,0|2,0,0]=4 495 B8R0.2 CCC(=O)N(C)C(C)C 3feb699597734e703dbc4fe539ecb6bb [0,1,1,0,0,0|1,0,0]=3 496 B8R0.2 CCC(C)N(C)C(=O)C 086f7eb815f719734067083abba6aada [0,1,1,0,0,0|1,0,0]=3 497 B8R0.2 CCN(C)C(=O)C(=O)C f60b3512bf731817ed8f594771284a74 [0,1,1,0,0,0|1,0,1]=4 498 B8R0.2 CCN(C)C(C)C(=O)C b0aebe8e13e2528b49b039e15b578c7c [0,1,1,0,0,0|1,0,0]=3 499 B8R0.2 CCN(C)C(C)C(=O)N c9d5fe87f550d78b666f9d69e7149698 [0,1,1,0,0,0|2,0,0]=4 500 B8R0.2 CCN(C)C(C)C(=O)O 6f2a7033474106426aec9bd9ed3b37aa [0,1,1,0,0,0|2,0,0]=4 501 B8R0.2 CCN(C)C(C)C(C)C 63bc6c1ea4030c348ad97e4229fb9c6b [0,1,1,0,0,0|2,0,0]=4 502 B8R0.2 CCN(C)C(F)C(=O)N 38943317264fb5f4bb1b8ecb07aa912e [0,1,1,0,0,0|2,0,0]=4 503 B8R0.2 CCN(C)[C@@H](C)C(=O)N e92486f9a20f42ba27598bb897bbfb89 [0,1,1,0,0,0|2,0,0]=4 504 B8R0.2 CCN(C)[C@@H](C)C(=O)O ccda40b7947e3ec868172b2d11a39e32 [0,1,1,0,0,0|2,0,0]=4 505 B8R0.2 CCN(C)[C@H](C)C(=O)N 00061aa619b17a93e01c3e5051412b52 [0,1,1,0,0,0|2,0,0]=4 506 B8R0.2 CCN(C)[C@H](C)C(=O)O a423cd91a719c568f85e9128b6162ae1 [0,1,1,0,0,0|2,0,0]=4 507 B8R0.5 C=C(C)CN(C)CCC 67a547626d9fe48bc4d555dd9d8ee25d [0,1,1,0,0,0|2,0,0]=4 508 B8R0.5 C=C(C)CN(C)CCF a4346fde4025c5db2d5e6bbfb7c0c985 [0,1,1,0,0,0|2,0,0]=4 509 B8R0.5 C=C(C)CN(C)CCO 3d91c7b5e7811a5d832abe616ae4a280 [0,1,1,0,0,0|2,0,0]=4 510 B8R0.5 CC(=O)NC(C)CC#N 4c1eec26fa88af811b86b8c3ab1a2be6 [0,1,1,0,0,0|1,0,1]=4 511 B8R0.5 CC(=O)NC(C)CCO 31015bb8805fb64762d130a6b4b7d734 [0,1,1,0,0,0|1,0,0]=3 512 B8R0.5 CC(=O)N[C@@H](C)CCO 4818866c214b230552dc5531d2d7dacb [0,1,1,0,0,0|1,0,0]=3 513 B8R0.5 CC(=O)N[C@H](C)CCO d4f1175f550aed36e673eb7917598f76 [0,1,1,0,0,0|1,0,0]=3 514 B8R0.5 CC(C)CC(=O)NC#N e0f6c1c62407c36da220e653124131f5 [0,1,1,0,0,0|1,0,1]=4 515 B8R0.5 CC(C)CN(C)CCF 710152e558acdec66d05a66b002702bb [0,1,1,0,0,0|2,0,0]=4 516 B8R0.5 CC(C)CN(C)CCO 88c09d521cd5d8864d09de40f53a5749 [0,1,1,0,0,0|2,0,0]=4 517 B8R0.5 CC(C)CN(C)CCS 0b3ba8d7f9060567fc9ae93ef8f9a73d [0,1,1,0,0,0|2,0,0]=4 518 B8R0.5 CC(CC(=O)N)OCF 3e264f2c27636c1a0f540c1f468797f4 [0,1,1,0,0,0|2,0,0]=4 519 B8R0.5 CC(CC(=O)O)NCF 84d4be16e4ac304aaa68ed4d36823324 [0,1,1,0,0,0|2,0,0]=4 520 B8R0.5 CC(CC(=O)O)NCO 10996b09f91fab84edb45bd9880e2318 [0,1,1,0,0,0|2,0,0]=4 521 B8R0.5 CC(CC(=O)O)OCF 14e16352da0b978e8e37b50cbc803026 [0,1,1,0,0,0|2,0,0]=4 522 B8R0.5 CCCC(=S)OC(C)C 79ff90d7e7d68c5664ea5acd6b8154a5 [0,1,1,0,0,0|1,1,0]=4 523 B8R0.5 CCCC(C)NC(=O)C 1ed0caa6bab6b1d79a8ed0b0c0e539ad [0,1,1,0,0,0|1,0,0]=3 524 B8R0.5 CCCN(C)CC(=O)N eac556bb053ce72a83d81df49c8f321b [0,1,1,0,0,0|2,0,0]=4 525 B8R0.5 CCCN(C)CC(=O)O afce971a9549e09777d29f9620e7b765 [0,1,1,0,0,0|2,0,0]=4 526 B8R0.5 CCCN(C)CC(C)C 2b43726cfeef4d65e0d306fc15d81329 [0,1,1,0,0,0|2,0,0]=4 527 B8R0.5 CCC[C@H](C)NC(=O)C 95c9eaebbb0a0de223f5b617f08585d8 [0,1,1,0,0,0|1,0,0]=3 528 B8R0.5 CCNC(C)CC(=O)O 29ac9bd89e468a34801bb550215ba942 [0,1,1,0,0,0|1,0,0]=3 529 B8R0.5 CCNC(C)CC(C)C 865caec34869d14200fe8a23ded15c61 [0,1,1,0,0,0|1,0,1]=4 530 B8R0.5 CCNC(C)CC(C)O 43b202ae8ff1647314607d5a8e6eab62 [0,1,1,0,0,0|0,0,2]=4 531 B8R0.5 CCNC(C)CN(C)C 3647b655ca2afa948df2daf8e7b3863a [0,1,1,0,0,0|2,0,0]=4 532 B8R0.5 CCN[C@@H](C)CC(=O)O 40a529d5929c8901c8f2b9599ed898cd [0,1,1,0,0,0|1,0,0]=3 533 B8R0.5 CCN[C@@H](C)CN(C)C 73dbe197bb194ada6ceef16a3da0165d [0,1,1,0,0,0|2,0,0]=4 534 B8R0.5 CCN[C@H](C)CC(=O)O 2f28d4f7bc57f1ad1bf5a4eebcdf11f3 [0,1,1,0,0,0|1,0,0]=3 535 B8R0.5 CCN[C@H](C)CN(C)C a51baa1074a724bab895601c4ea99cae [0,1,1,0,0,0|2,0,0]=4 536 B8R0.5 CCOC(C)CC(=O)N a247fc098cd9bc50b0c7b9371cf4fcb5 [0,1,1,0,0,0|1,0,0]=3 537 B8R0.5 CCOC(C)CC(=O)O 20f52735b4f115013d658aa30fd851a1 [0,1,1,0,0,0|1,0,0]=3 538 B8R0.5 CCOC(C)CC(C)C 30e2f8e558cfdda4b507d2297dd2dc70 [0,1,1,0,0,0|1,0,1]=4 539 B8R0.5 CCOC(C)CN(C)C 37b413e4bc800fbab3da37dd4e9fe161 [0,1,1,0,0,0|2,0,0]=4 540 B8R0.5 CCOC(C)C[N+](=O)[O-] b27ec23ecb023bda7a5b2b5d22939688 [0,1,1,0,0,0|2,0,0]=4 541 B8R0.5 CCO[C@@H](C)CC(=O)O 2297bbd28bfec2b7a3315f1a1eca242e [0,1,1,0,0,0|1,0,0]=3 542 B8R0.5 CCO[C@@H](C)CC(C)C 1e2bdc5c56411fd3cd17ac1c2858063c [0,1,1,0,0,0|1,0,1]=4 543 B8R0.5 CCO[C@@H](C)CN(C)C ae40d79a21e92f2f1cf9ae60d7945b2b [0,1,1,0,0,0|2,0,0]=4 544 B8R0.5 CCO[C@H](C)CC(=O)O ccc8e46cafa360247330bb81a3001d13 [0,1,1,0,0,0|1,0,0]=3 545 B8R0.5 CCO[C@H](C)CC(C)C 914881db7ee4a9dab17d292ad412afd8 [0,1,1,0,0,0|1,0,1]=4 546 B8R0.5 CCO[C@H](C)CN(C)C 28a6b24d1c425360d0b5ae251533cba1 [0,1,1,0,0,0|2,0,0]=4 547 B8R0.5 CN(CCF)CC(=O)N d26c9ff0c6aeb9650633740b8e8fbdd2 [0,1,1,0,0,0|2,0,0]=4 548 B8R0.5 CN(CCF)CC(=O)O 378a586b4ce9b0291e7e9d64e15c1748 [0,1,1,0,0,0|2,0,0]=4 549 B8R0.5 CN(CCO)CC(=O)N 0888a0a37efb8cd042350a61e8c75fb4 [0,1,1,0,0,0|2,0,0]=4 550 B8R0.5 CN(CCO)CC(=O)O e22eedcab85615a7cb9a01481995f5a1 [0,1,1,0,0,0|2,0,0]=4 551 B8R0.5 CN(CCS)CC(=O)N ac27f0a2a25a3457ae9c334515a984f5 [0,1,1,0,0,0|2,0,0]=4 552 B8R0.5 CN(CCS)CC(=O)O 20a126cdeaa5b2f572a540b4b00dcdb8 [0,1,1,0,0,0|2,0,0]=4 553 B8R0.5 COCC(C)NC(=O)C d3030be71efb57415a6640caba792cb5 [0,1,1,0,0,0|1,0,0]=3 554 B8R0.5 COCN(C)CC(=O)N 883b5fd21ac0fa4c080e391aedf41537 [0,1,1,0,0,0|2,0,0]=4 555 B8R0.5 COCN(C)CC(=O)O 38182438be3a4fb938d35352c6bcaa17 [0,1,1,0,0,0|2,0,0]=4 556 B8R0.5 COCN(C)CC(C)C ccfc06333099a194fdf9a9972dfaab0f [0,1,1,0,0,0|2,0,0]=4 557 B8R0.5 COC[C@@H](C)NC(=O)C e26de4ebd7327dac480ea010b3a6df2f [0,1,1,0,0,0|1,0,0]=3 558 B8R0.5 COC[C@H](C)NC(=O)C 4d6a771b34650f584286aeb4b67fe92b [0,1,1,0,0,0|1,0,0]=3 559 B8R0.5 CSCN(C)CC(=O)N 95b0cce82a1be92513ca60f76f2c4e94 [0,1,1,0,0,0|2,0,0]=4 560 B8R0.5 CSCN(C)CC(=O)O f4126c72edd8ab40e4f0e1149e0c0772 [0,1,1,0,0,0|2,0,0]=4 561 B8R0.5 CSCN(C)CC(C)C b4880058f7b62851863b99827752cd7e [0,1,1,0,0,0|2,0,0]=4 562 B8R0.5 C[C@@H](CC(=O)O)NCF 7b4409b263377324cee992cead4d4496 [0,1,1,0,0,0|2,0,0]=4 563 B8R0.5 C[C@@H](CC(=O)O)NCO 6f9af837429cbf13d74a82abb33116db [0,1,1,0,0,0|2,0,0]=4 564 B8R0.5 C[C@@H](CC(=O)O)OCF 3a1dfbb8c5aec4e4079809a87b6b3981 [0,1,1,0,0,0|2,0,0]=4 565 B8R0.5 C[C@H](CC(=O)O)NCF 6a82f1327e74ba81c2a6e57eb4cb9aac [0,1,1,0,0,0|2,0,0]=4 566 B8R0.5 C[C@H](CC(=O)O)NCO 3ee6882c6b18b0aec7272fad595282f5 [0,1,1,0,0,0|2,0,0]=4 567 B8R0.5 C[C@H](CC(=O)O)OCF 913e08b306bc95c6771408b42aad5ed2 [0,1,1,0,0,0|2,0,0]=4 568 B8R0.16 C=C(C)CN(CC)CC 5e7edabf5a8714e74a2bb1ad7dd94499 [0,1,1,0,0,0|2,0,0]=4 569 B8R0.16 C=C(C)CN(CC)CF fb462ba98ce1838dd4d16ae3abcf2592 [0,1,1,0,0,0|2,0,0]=4 570 B8R0.16 C=C(C)CN(CC)CO d3e5e60a1b260bb44f4da36f7d5b093a [0,1,1,0,0,0|2,0,0]=4 571 B8R0.16 CC(=O)NC(CO)CO b933289767d5f896480a48145d3e5dd9 [0,1,1,0,0,0|2,0,0]=4 572 B8R0.16 CCC(C=O)OC(C)C 64971e54da0bc5dd8c61368ff4482427 [0,1,1,0,0,0|1,0,1]=4 573 B8R0.16 CCC(CC)NC(=O)C 4ed89f720f0f05324cf79f8a98baf869 [0,1,1,0,0,0|1,0,0]=3 574 B8R0.16 CCC(CO)NC(=O)C 0fc969f502a685ac3a30dff22859fa62 [0,1,1,0,0,0|1,0,0]=3 575 B8R0.16 CCN(C=O)CC(C)C a0d4f7e2b09765b708dd4f00ebe2d340 [0,1,1,0,0,0|1,0,0]=3 576 B8R0.16 CCN(C=O)CC(C)O 2437be87a2e81f295f09928becec40c6 [0,1,1,0,0,0|2,0,0]=4 577 B8R0.16 CCN(C=O)C[C@H](C)O 1f7ddfd4388d4f78b5345d6a6e9121a1 [0,1,1,0,0,0|2,0,0]=4 578 B8R0.16 CCN(CC)CC(=O)O 6fed7892c18c8ce9f89dfe191b146fca [0,1,1,0,0,0|2,0,0]=4 579 B8R0.16 CCN(CC)CC(C)C 87a5706d2b796b063f175db9c5e79998 [0,1,1,0,0,0|2,0,0]=4 580 B8R0.16 CCN(CF)CC(=O)O 1572f10e4b030a4a402c19f513bf28bb [0,1,1,0,0,0|2,0,0]=4 581 B8R0.16 CCN(CF)CC(C)C 744b366c959b404d2df0a0600b06b37b [0,1,1,0,0,0|2,0,0]=4 582 B8R0.16 CCN(CO)CC(=O)O af04d4435f9e87502f4960e4fa163dc7 [0,1,1,0,0,0|2,0,0]=4 583 B8R0.16 CCN(CO)CC(C)C f806f0f6352a8332de429236acf734d1 [0,1,1,0,0,0|1,0,1]=4 584 B8R0.16 CC[C@@H](CO)NC(=O)C ec21a63ea250126e0e8e11da71f403ff [0,1,1,0,0,0|1,0,0]=3 585 B8R0.16 CC[C@H](CO)NC(=O)C 6d8228e87e113704ba8a910f796088e1 [0,1,1,0,0,0|1,0,0]=3 586 B8R0.19 C#CC(=O)NC(C)CC 61d9b7eb83f4ff7eb7086f9d7e1ae285 [0,1,1,0,0,0|1,0,1]=4 587 B8R0.19 C#CC(=O)N[C@@H](C)CC e4430e1df3d27e1f60bfd6ac8cb2107b [0,1,1,0,0,0|1,0,1]=4 588 B8R0.19 C#CC(=O)N[C@H](C)CC 4b809239b5091186dfbcfe36ab818a64 [0,1,1,0,0,0|1,0,1]=4 589 B8R0.19 C#CC(C)NC(=O)CC b3d62cd02b21ed8b92bc6b4f40f79ec6 [0,1,1,0,0,0|1,0,1]=4 590 B8R0.19 C#C[C@@H](C)NC(=O)CC 4b8ef19bb31b8f4e485e026e78b7f5f3 [0,1,1,0,0,0|1,0,1]=4 591 B8R0.19 C#C[C@H](C)NC(=O)CC 82b030abf3ba07e5b870033df09c7669 [0,1,1,0,0,0|1,0,1]=4 592 B8R0.19 C=C(C=O)OC(C)CC c5f7d9036a8fdea0d25979e46bb39add [0,1,1,0,0,0|1,0,1]=4 593 B8R0.19 C=C(CC)CN(C)CC a5edac56bd516c3e08abe80274b2ef4e [0,1,1,0,0,0|2,0,0]=4 594 B8R0.19 C=C(CN(C)CC)OC ae7aed41eaced6b8d6d4f4656a97dade [0,1,1,0,0,0|2,0,0]=4 595 B8R0.19 C=C(CO)CN(C)CC 9c16b8a0e80d8cd55610766797cfa55c [0,1,1,0,0,0|2,0,0]=4 596 B8R0.19 C=CC(=O)NC(C)CC 618b63daf38e12edf0af1cf418a0bd56 [0,1,1,0,0,0|1,0,1]=4 597 B8R0.19 C=CC(=O)N[C@@H](C)CC a3ffc6e9f98d3fec0068c30de1c1aa9d [0,1,1,0,0,0|1,0,1]=4 598 B8R0.19 C=CC(=O)N[C@H](C)CC 7381476a5c4cd38996f0fa157a298c50 [0,1,1,0,0,0|1,0,1]=4 599 B8R0.19 C=CC(C)NC(=O)CC 839432ec7d3f0e80c7881e3c8ea6f7fd [0,1,1,0,0,0|1,0,1]=4 600 B8R0.19 CC(CO)CN(C)C=O 1651f97b326ac36e19f9ffe26a720260 [0,1,1,0,0,0|2,0,0]=4 601 B8R0.19 CC(CO)NC(=O)CF ef2266eb5061b2bffbd30285b120264a [0,1,1,0,0,0|2,0,0]=4 602 B8R0.19 CC(CO)NC(=O)CO 36e7f0a9d41f765505ec00dee787948b [0,1,1,0,0,0|2,0,0]=4 603 B8R0.19 CC(CO)NC(=O)CS 4ca68b24b40823bba6f492cc34b6d41b [0,1,1,0,0,0|2,0,0]=4 604 B8R0.19 CCC(=O)CN(C)CC 5ff470863ab78226aff558b26acaa6bb [0,1,1,0,0,0|1,0,0]=3 605 B8R0.19 CCC(=O)NC(C)C#N 12108e2444e1ebb9139d2cf557129000 [0,1,1,0,0,0|1,0,1]=4 606 B8R0.19 CCC(=O)NC(C)CC 276f63d9911911bef583b63399d6babf [0,1,1,0,0,0|1,0,0]=3 607 B8R0.19 CCC(=O)NC(C)CO 31f73ee0dabaaa5a17015c929f45f2fd [0,1,1,0,0,0|1,0,0]=3 608 B8R0.19 CCC(=O)N[C@@H](C)CC 5015556f6119dada9330f459ef8b4a95 [0,1,1,0,0,0|1,0,0]=3 609 B8R0.19 CCC(=O)N[C@@H](C)CO a3bcc6db0615cc40ae6703cd20d3dc45 [0,1,1,0,0,0|1,0,0]=3 610 B8R0.19 CCC(=O)N[C@H](C)CC 0aeecce7ca86d9a6cf7c4003d6b8deb5 [0,1,1,0,0,0|1,0,0]=3 611 B8R0.19 CCC(=O)N[C@H](C)CO 3449d5b097ace6785d86df28155e11e4 [0,1,1,0,0,0|1,0,0]=3 612 B8R0.19 CCC(C)CN(C)CC c97a2f07dd5fecc0e91af558e8842f65 [0,1,1,0,0,0|2,0,0]=4 613 B8R0.19 CCC(C)NC(=O)C=O d87e951102d767f8f5aa3b902ef92349 [0,1,1,0,0,0|1,0,1]=4 614 B8R0.19 CCC(C)NC(=O)CF be99e999222b335d1cb75f36b6d9cd45 [0,1,1,0,0,0|1,0,0]=3 615 B8R0.19 CCC(C)NC(=O)CO 33a44afa4449469b04b268f3719a3e59 [0,1,1,0,0,0|1,0,0]=3 616 B8R0.19 CCC(C)NC(=O)CS 2bbecd1472ce4a0c07af9c3693119c31 [0,1,1,0,0,0|1,0,0]=3 617 B8R0.19 CCC(C)NC(C)C=O 610b4a8ffb3807f31c76d2eb3d0b9780 [0,1,1,0,0,0|1,0,1]=4 618 B8R0.19 CCC(C)N[C@H](C)C=O bcb94071dd29361c15a01b7c88596d57 [0,1,1,0,0,0|1,0,1]=4 619 B8R0.19 CCC(C)OC(C)C=O eff298f26322e5014e51cb58e37ec95a [0,1,1,0,0,0|1,0,1]=4 620 B8R0.19 CCC(C)O[C@H](C)C=O 8b0db61f6f95e4e0ee500a8429036305 [0,1,1,0,0,0|1,0,1]=4 621 B8R0.19 CCC(O)CN(C)C=O a5ca11d122e7bb722666ea345a9e6e66 [0,1,1,0,0,0|2,0,0]=4 622 B8R0.19 CCN(C)CC(=O)CO cfedb43af4bce24aac2f06a8534d30e0 [0,1,1,0,0,0|1,0,0]=3 623 B8R0.19 CCN(C)CC(=O)NC 8baa1dde5886fc0147e3d3c2a9f34306 [0,1,1,0,0,0|1,0,0]=3 624 B8R0.19 CCN(C)CC(=O)OC dc6eaad4d2fa330c4e11c97ae3abe5a3 [0,1,1,0,0,0|1,0,0]=3 625 B8R0.19 CCN(C)CC(C)CO 57aed0ddb41a49ac36f9f8539801655e [0,1,1,0,0,0|2,0,0]=4 626 B8R0.19 CCN(C)CC(C)OC 377b6e41a65d04757b988ceba2b54f82 [0,1,1,0,0,0|2,0,0]=4 627 B8R0.19 CCN(C)C[C@@H](C)CO ddade9d6e3ba337d6b393a00c773647d [0,1,1,0,0,0|2,0,0]=4 628 B8R0.19 CCN(C)C[C@@H](C)OC 423ec57342e946c8b4839b0ec5409baa [0,1,1,0,0,0|2,0,0]=4 629 B8R0.19 CCN(C)C[C@H](C)CO 0a9476f9cc602f73744eac4366c36b7c [0,1,1,0,0,0|2,0,0]=4 630 B8R0.19 CCN(C)C[C@H](C)OC fbb444e22eeeab9bc96df09d063788d3 [0,1,1,0,0,0|2,0,0]=4 631 B8R0.19 CC[C@@H](C)CN(C)CC c7c9b5c0068d5d12f050f43bd2f96d97 [0,1,1,0,0,0|2,0,0]=4 632 B8R0.19 CC[C@@H](C)NC(=O)C=O 21ac8ac32e78a362dc133e8e3bbda567 [0,1,1,0,0,0|1,0,1]=4 633 B8R0.19 CC[C@@H](C)NC(=O)CF 972ccf96eab46daa18ae78e952074e33 [0,1,1,0,0,0|1,0,0]=3 634 B8R0.19 CC[C@@H](C)NC(=O)CO 102bc53795a33daa61b0e6c2cdbc40e6 [0,1,1,0,0,0|1,0,0]=3 635 B8R0.19 CC[C@@H](C)NC(=O)CS 6576ffdd87c3ad0b66c846698b8c9218 [0,1,1,0,0,0|1,0,0]=3 636 B8R0.19 CC[C@@H](C)NC(C)C=O abf2de4d64d8367bf152827fa19c8747 [0,1,1,0,0,0|1,0,1]=4 637 B8R0.19 CC[C@@H](C)N[C@H](C)C=O 3342a1648b9263897ca0c454c43aa5e6 [0,1,1,0,0,0|1,0,1]=4 638 B8R0.19 CC[C@@H](C)OC(C)C=O 665da496f78ef9cbb93bd2fbabb6c4bb [0,1,1,0,0,0|1,0,1]=4 639 B8R0.19 CC[C@@H](C)O[C@H](C)C=O 89b33ea7698450df463669e4946abea4 [0,1,1,0,0,0|1,0,1]=4 640 B8R0.19 CC[C@H](C)CN(C)CC a2f007d5d2fc9c89853c614ebf5a2522 [0,1,1,0,0,0|2,0,0]=4 641 B8R0.19 CC[C@H](C)NC(=O)C=O e638670223a406eb6167bccd4c1dfde1 [0,1,1,0,0,0|1,0,1]=4 642 B8R0.19 CC[C@H](C)NC(=O)CF 4effc7db6392db0aa027693c9704097d [0,1,1,0,0,0|1,0,0]=3 643 B8R0.19 CC[C@H](C)NC(=O)CO 7070ce3ef500a05442ee4538ea055e46 [0,1,1,0,0,0|1,0,0]=3 644 B8R0.19 CC[C@H](C)NC(=O)CS 035bd81fae7cc99474ceaac0a841b71d [0,1,1,0,0,0|1,0,0]=3 645 B8R0.19 CC[C@H](C)NC(C)C=O 018c527e97f5ffc308f69037c7d3a009 [0,1,1,0,0,0|1,0,1]=4 646 B8R0.19 CC[C@H](C)N[C@H](C)C=O d64bf9f3a5fe53c581afe2fb82ccfd54 [0,1,1,0,0,0|1,0,1]=4 647 B8R0.19 CC[C@H](C)OC(C)C=O 0ca2a7fbf13c00f26ded9cafaaef3a1d [0,1,1,0,0,0|1,0,1]=4 648 B8R0.19 CC[C@H](C)O[C@H](C)C=O 65f006b95602312ad77964961ea5b1e5 [0,1,1,0,0,0|1,0,1]=4 649 B8R0.19 CNC(=O)CN(C)CF c4335c7de1ec7a5bdf4619e54da80079 [0,1,1,0,0,0|2,0,0]=4 650 B8R0.19 CNC(=O)CN(C)CO 5e5aacc592b2dd5b7a781dd38b53445b [0,1,1,0,0,0|2,0,0]=4 651 B8R0.19 COC(=O)CN(C)CF 315bad3552c61e9bc012d524d408a643 [0,1,1,0,0,0|2,0,0]=4 652 B8R0.19 COC(=O)CN(C)CO ead5047548ab9512878dca6e9fed3e38 [0,1,1,0,0,0|2,0,0]=4 653 B8R0.19 C[C@@H](CO)NC(=O)CF 2c1d0a1ab5fcd3bc348406e1eae8d857 [0,1,1,0,0,0|2,0,0]=4 654 B8R0.19 C[C@@H](CO)NC(=O)CO 4ef5922646eca2409cc0528bbe495536 [0,1,1,0,0,0|2,0,0]=4 655 B8R0.19 C[C@@H](CO)NC(=O)CS ecb25931c5ecf30a1072b0ef0c850951 [0,1,1,0,0,0|2,0,0]=4 656 B8R0.19 C[C@H](CO)NC(=O)CF 47adba76c977441bf582f65bebd39947 [0,1,1,0,0,0|2,0,0]=4 657 B8R0.19 C[C@H](CO)NC(=O)CO 02a86c975d92184b3a8afd5bdd788d80 [0,1,1,0,0,0|2,0,0]=4 658 B8R0.19 C[C@H](CO)NC(=O)CS ecf3d50d57e6bb41773d96b1c96ed61c [0,1,1,0,0,0|2,0,0]=4 659 B8R0.23 C=C(C)CN(C)C(C)C 5ce3bf8335906065652aa3e2b299f4f5 [0,1,1,0,0,0|2,0,0]=4 660 B8R0.23 CC(=O)NC(C)C(C)C 44e61c71c404e93b61e4ebb2d17acd25 [0,1,1,0,0,0|1,0,0]=3 661 B8R0.23 CC(=O)NC(C)C(C)O 82d78b22fd9c1b1cb9a6f73c5b23c29f [0,1,1,0,0,0|1,0,0]=3 662 B8R0.23 CC(=O)N[C@@H](C)C(C)C 020b2d58d09d222117d5a013059e1c42 [0,1,1,0,0,0|1,0,0]=3 663 B8R0.23 CC(=O)N[C@@H](C)C(F)F 22488b68f94b27687795c9433c1222cc [0,1,1,0,0,0|2,0,0]=4 664 B8R0.23 CC(=O)N[C@H](C)C(C)C 1a8a59449f9523fa08b3f0d029907e07 [0,1,1,0,0,0|1,0,0]=3 665 B8R0.23 CC(=O)N[C@H](C)C(F)F 39323a7f6823bde98b326479b7aa9573 [0,1,1,0,0,0|2,0,0]=4 666 B8R0.23 CC(C)CN(C)C(C)C b51beb028657f748b3783403daf9db19 [0,1,1,0,0,0|2,0,0]=4 667 B8R0.23 CC(C)N(C)CC(=O)N 40fedc251db3e73f4c6c403ff754fd20 [0,1,1,0,0,0|2,0,0]=4 668 B8R0.23 CC(C)N(C)CC(=O)O 402f1d7c3b958af1fceb64bdcde4405c [0,1,1,0,0,0|2,0,0]=4 669 B8R0.24 CC(C)(C)NC(=O)CF eaf2c955300b2105c1bb32d1cd07b20a [0,1,1,0,0,0|2,0,0]=4 670 B8R0.24 CC(C)(C)NC(=O)CO 036f0d5d96292df8d1908352e5576a0c [0,1,1,0,0,0|2,0,0]=4 671 B8R0.24 CCC(=O)NC(C)(C)C 26a2f5ebe28b3d4c326c1e70f6823a38 [0,1,1,0,0,0|1,0,0]=3 672 B8R0.24 CCN(C)CC(C)(C)C ad9a32359488b3a57efd7a0f91b8539b [0,1,1,0,0,0|2,0,0]=4 673 B8R0.24 CCN(C)CC(C)(C)F 7a7eae4f3fa39ffa021a7e60015b3c3a [0,1,1,0,0,0|2,0,0]=4 674 B8R0.24 CCN(C)CC(C)(C)O 3a82767057043d9df3fecda73f227fdf [0,1,1,0,0,0|2,0,0]=4 675 B8R0.24 CCN(C)CS(=O)(=O)C 8b03fecdc46398064987fc89f87828a9 [0,1,1,0,0,0|2,0,0]=4 676 B8R0.34 CC(=O)NC(C)(C)CF a18ff32a5fc0bc819ab72e44d96d3946 [0,1,1,0,0,0|2,0,0]=4 677 B8R0.34 CC(=O)NC(C)(C)CO 79003794ec6500404906022922bddeef [0,1,1,0,0,0|2,0,0]=4 678 B8R0.34 CCC(C)(C)NC(=O)C 840c3fecba24f983e5795d9efa511b8c [0,1,1,0,0,0|1,0,0]=3 679 B8R0.6 C#CC(=O)NCCCC 7b05ebf03d7d7168df7348c28a985d62 [0,1,1,0,0,0|1,0,1]=4 680 B8R0.6 C#CC(C)NCCC=O b9c5b6ba8cfb4703ce184973d7d00c34 [0,1,1,0,0,0|1,0,1]=4 681 B8R0.6 C#CC(C)OCCC=O b4f26efb44146120dac4c2f499518b75 [0,1,1,0,0,0|1,0,1]=4 682 B8R0.6 C#C[C@@H](C)NCCC=O b812c862625c4e6478a179cd48b74fa0 [0,1,1,0,0,0|1,0,1]=4 683 B8R0.6 C#C[C@@H](C)OCCC=O 1b5d14ca063cbe7e9022b4c05ac12aee [0,1,1,0,0,0|1,0,1]=4 684 B8R0.6 C#C[C@H](C)NCCC=O 60f4e36e697fd4ebabd9745a90d09b82 [0,1,1,0,0,0|1,0,1]=4 685 B8R0.6 C#C[C@H](C)OCCC=O 69494d0b919c0bc0fbbc271ade219f3c [0,1,1,0,0,0|1,0,1]=4 686 B8R0.6 C=C(C=O)OCCCC 6ce71ca855175b3f8b8b50951f61cb4c [0,1,1,0,0,0|1,0,1]=4 687 B8R0.6 C=C(CC)CNCCC 13f11be9634d172790672a2fd9a9840c [0,1,1,0,0,0|2,0,0]=4 688 B8R0.6 C=C(CC)COCCC 9a03753bc1b5bbc7ba706f1688ccd4c0 [0,1,1,0,0,0|2,0,0]=4 689 B8R0.6 C=C(CNCCC)OC 087b8e9db7c5cf69f544a95d2e04b5df [0,1,1,0,0,0|2,0,0]=4 690 B8R0.6 C=C(CO)CNCCC 1a3d72efe9d3ce84e285b2c8b91ed59f [0,1,1,0,0,0|2,0,0]=4 691 B8R0.6 C=C(COCCC)OC 35a576a479e84b27dbf4c71b4925086f [0,1,1,0,0,0|2,0,0]=4 692 B8R0.6 C=CC(=O)NCCCC 4c95ec79288c2f88fcb23d3a93f15b5c [0,1,1,0,0,0|1,0,1]=4 693 B8R0.6 C=CC(C)COCC=O 6e7f92fb51e32c59e36957f0b0308468 [0,1,1,0,0,0|1,0,1]=4 694 B8R0.6 C=CC(C)NCCC=O 34ccac889a8fddd78b8149315d5fbb67 [0,1,1,0,0,0|1,0,1]=4 695 B8R0.6 C=CC(C)OCCC=O c2fb39e17e89251aad102f8067a79d7c [0,1,1,0,0,0|1,0,1]=4 696 B8R0.6 C=CCCCN(C)CC 1bec5e770716bf844a25a95ad899a7c4 [0,1,1,0,0,0|2,0,0]=4 697 B8R0.6 C=CCCCN(C)CF e6af2ce76076b26c6389083a0013f3c7 [0,1,1,0,0,0|2,0,0]=4 698 B8R0.6 C=CCCCN(C)CO 60383a05b98647585562faefac549271 [0,1,1,0,0,0|2,0,0]=4 699 B8R0.6 C=CCCNC(C)CC f885cbdaaa18710cec8775d0fc08c804 [0,1,1,0,0,0|2,0,0]=4 700 B8R0.6 C=CCCNC(C)CO 4c19367b66c3870cb1b9b059820dfae4 [0,1,1,0,0,0|2,0,0]=4 701 B8R0.6 C=CCCN[C@@H](C)CC 999e8371ea0e07c999dbfb955513b106 [0,1,1,0,0,0|2,0,0]=4 702 B8R0.6 C=CCCN[C@@H](C)CO bd75d5ba5552ec3b4468e50c48f577dc [0,1,1,0,0,0|2,0,0]=4 703 B8R0.6 C=CCCN[C@H](C)CC 07aa1c8af6a68bcbd328411f213e0d5f [0,1,1,0,0,0|2,0,0]=4 704 B8R0.6 C=CCCN[C@H](C)CO dcb6aa26546bb9950f8526419d01344b [0,1,1,0,0,0|2,0,0]=4 705 B8R0.6 C=CCCOC(C)CC b8bb0fe92dd0d23b9879350a5841a976 [0,1,1,0,0,0|2,0,0]=4 706 B8R0.6 C=CCCOC(C)CF 0e487925b38dfe7a8f30a61d464d191c [0,1,1,0,0,0|2,0,0]=4 707 B8R0.6 C=CCCOC(C)CS b8f1fc30072621f664eef040a9b38cb9 [0,1,1,0,0,0|2,0,0]=4 708 B8R0.6 C=CCCO[C@@H](C)CC 29dfa30bd98e5dbf9563047158a37aea [0,1,1,0,0,0|2,0,0]=4 709 B8R0.6 C=CCCO[C@H](C)CC 5cad605e23fae06ae0f8741c6fbdd602 [0,1,1,0,0,0|2,0,0]=4 710 B8R0.6 C=CCCO[C@H](C)CS 50de7baf66874e07c349214eaf94a3db [0,1,1,0,0,0|2,0,0]=4 711 B8R0.6 C=CCNCC(C)CC 494ce94604ac38dadc94644e86d6a10d [0,1,1,0,0,0|2,0,0]=4 712 B8R0.6 C=CCNCC(C)CO 0349751dd72119d1ec86991336485e44 [0,1,1,0,0,0|2,0,0]=4 713 B8R0.6 C=CCNC[C@@H](C)CC 10564aa737f9984860d65735a5b1d4f7 [0,1,1,0,0,0|2,0,0]=4 714 B8R0.6 C=CCNC[C@@H](C)OC b7562211711e7dd3c0c532f66c1ea725 [0,1,1,0,0,0|2,0,0]=4 715 B8R0.6 C=CCNC[C@H](C)CO 83df800fa1fe19eaa9c32210c081717f [0,1,1,0,0,0|2,0,0]=4 716 B8R0.6 C=CCNC[C@H](C)OC f2ade53da8dc35e9501abf5457bf836b [0,1,1,0,0,0|2,0,0]=4 717 B8R0.6 C=CCOCC(C)CC 80dd01c33214aee04f213ff4b3d8b154 [0,1,1,0,0,0|2,0,0]=4 718 B8R0.6 C=CCOCC(C)OC 5e8d34ad1209ea0db8a9ab36af63874c [0,1,1,0,0,0|2,0,0]=4 719 B8R0.6 C=CCOC[C@@H](C)CC 33cb2ec72dfd50721c249724597568dd [0,1,1,0,0,0|2,0,0]=4 720 B8R0.6 C=CCOC[C@@H](C)OC 56af6ef64f40f572849a587c987a9fb6 [0,1,1,0,0,0|2,0,0]=4 721 B8R0.6 C=CCOC[C@H](C)CC ea37bcd01cf18ce9e17869382a85446c [0,1,1,0,0,0|2,0,0]=4 722 B8R0.6 C=CCOC[C@H](C)OC 19fb47c1068b524cb2a6d3cb74d2934d [0,1,1,0,0,0|2,0,0]=4 723 B8R0.6 C=C[C@H](C)OCCC=O d2528d5f8182afb1ad2ed844bb3b4d34 [0,1,1,0,0,0|1,0,1]=4 724 B8R0.6 CC(C#N)CNCC=O 07dd87324302dc639b7e40a71a6d2b89 [0,1,1,0,0,0|1,0,1]=4 725 B8R0.6 CC(C#N)COCC=O bdc1cb68eac2034044d1af91bed9168f [0,1,1,0,0,0|1,0,1]=4 726 B8R0.6 CC(C#N)NCCC=O 17f5eafdd4ffc04728989125a0e2f64a [0,1,1,0,0,0|1,0,1]=4 727 B8R0.6 CC(C#N)OCCC=O 99235743f38a0ed59261f8b08a8ebe83 [0,1,1,0,0,0|1,0,1]=4 728 B8R0.6 CC(C=O)OCCC=O 33ed4daad58f2a66394ebc2ecb1ab8c7 [0,1,1,0,0,0|1,0,1]=4 729 B8R0.6 CC(CF)OCCC=O b17ff84b04efc05e93964ee25e1ae59e [0,1,1,0,0,0|1,0,0]=3 730 B8R0.6 CC(CO)CCNC=O 39cb296f33f08cf60badb1105cd0e264 [0,1,1,0,0,0|1,0,0]=3 731 B8R0.6 CC(CO)CNCC=O 18b721b702015f9166f9e0a533c4ee44 [0,1,1,0,0,0|1,0,0]=3 732 B8R0.6 CC(CO)NCCC=O 2a49eedaae162f27c224c004e49e642c [0,1,1,0,0,0|1,0,0]=3 733 B8R0.6 CC(CS)OCCC=O b15e712b3203e46c10248532ab426545 [0,1,1,0,0,0|1,0,0]=3 734 B8R0.6 CCC(=O)CNCCBr 4ae86c97534187fa67e366dfd1eebd3b [0,1,1,0,0,0|2,0,0]=4 735 B8R0.6 CCC(=O)CNCCF 0bc469d08994cf5b5fbc36250b4ccf28 [0,1,1,0,0,0|2,0,0]=4 736 B8R0.6 CCC(=O)CNCCI 652e280753f4ad7ee550469669c66e91 [0,1,1,0,0,0|2,0,0]=4 737 B8R0.6 CCC(=O)CNCCO c42e5d5f257b37e8ba7acbbae4993f31 [0,1,1,0,0,0|2,0,0]=4 738 B8R0.6 CCC(=O)CNCCS 5d6e1d449d9df5ddcd81a9e54a1f9bcc [0,1,1,0,0,0|2,0,0]=4 739 B8R0.6 CCC(=O)COCCF 42452841604a6e08503574a608b88150 [0,1,1,0,0,0|2,0,0]=4 740 B8R0.6 CCC(=O)COCCS 361d7f9395122f7ce5b0a13a0b0a8b7e [0,1,1,0,0,0|2,0,0]=4 741 B8R0.6 CCC(=O)COCOC 2080604d4fba0b9d8e850f3f84775a84 [0,1,1,0,0,0|2,0,0]=4 742 B8R0.6 CCC(=O)COCSC 20ce94165e7ab9ceae1e7c23a6d6840a [0,1,1,0,0,0|2,0,0]=4 743 B8R0.6 CCC(=O)NCCCCl 8c01153ec31ae9cc62389708147e768e [0,1,1,0,0,0|2,0,0]=4 744 B8R0.6 CCC(=O)NCCCO f98fa75986b7788f9e80577d0f4b70ab [0,1,1,0,0,0|2,0,0]=4 745 B8R0.6 CCC(=O)NCCOC 23e877e020a2c5b2736fc6a95b7c4f02 [0,1,1,0,0,0|2,0,0]=4 746 B8R0.6 CCC(=O)NCCSC c0f9bf4f85b22a82daaa8b7807daec1c [0,1,1,0,0,0|2,0,0]=4 747 B8R0.6 CCC(C)CCNC=O 558581aaa032d77ec9625244f37a5ff2 [0,1,1,0,0,0|1,0,0]=3 748 B8R0.6 CCC(C)CNCC=O d00b0f81a0565e49d0bc6374b24732a9 [0,1,1,0,0,0|1,0,0]=3 749 B8R0.6 CCC(C)COCC=O aceccf78c40e809dde74393b828702d0 [0,1,1,0,0,0|1,0,0]=3 750 B8R0.6 CCC(C)NCCC=O 315da1f228cd97e2635c09e3abdec4cc [0,1,1,0,0,0|1,0,0]=3 751 B8R0.6 CCC(C)OCCC=O f072f162ee9d24e1b36d781e9499869c [0,1,1,0,0,0|1,0,0]=3 752 B8R0.6 CCC(O)CNCC=O 54e64a65f08901b7347dcf1abc24dda0 [0,1,1,0,0,0|2,0,0]=4 753 B8R0.6 CCCCCN(C)C=O 7b286f721a9c6a91b513309dd89d81c0 [0,1,1,0,0,0|1,0,0]=3 754 B8R0.6 CCCCCN(C)CC 9518c2300d9243488291f90365ee6acc [0,1,1,0,0,0|2,0,0]=4 755 B8R0.6 CCCCCN(C)CF 8024733ae25e28b26397cb54377f95de [0,1,1,0,0,0|2,0,0]=4 756 B8R0.6 CCCCCN(C)CO 702cd1b5f55dd49ef03de9639f750f5d [0,1,1,0,0,0|1,0,1]=4 757 B8R0.6 CCCCNC(=O)C=O f208026ec74ccdc3b90201942951f82d [0,1,1,0,0,0|1,0,1]=4 758 B8R0.6 CCCCNC(=O)CC 285e0c69f0d3b13983c95eed26c8d721 [0,1,1,0,0,0|1,0,0]=3 759 B8R0.6 CCCCNC(=O)CF ccc4967a8e0a27400c7d0139924f7409 [0,1,1,0,0,0|1,0,0]=3 760 B8R0.6 CCCCNC(=O)CO a7ebdf854bf2900347fbb690e8e35978 [0,1,1,0,0,0|1,0,0]=3 761 B8R0.6 CCCCNC(=O)CS c89622d02eae8eb9fb1a47fc8bb6fb10 [0,1,1,0,0,0|1,0,0]=3 762 B8R0.6 CCCCNC(C)C=O c990dbf02cb6f8344eb0c4b5b1c5bf1a [0,1,1,0,0,0|1,0,1]=4 763 B8R0.6 CCCCN[C@H](C)C=O a8c57992d16bbaafdc8ecce6752aa20e [0,1,1,0,0,0|1,0,1]=4 764 B8R0.6 CCCCOC(C)C=O 3da272a8eb2eb108a59ce2b6af2c590a [0,1,1,0,0,0|1,0,1]=4 765 B8R0.6 CCCCO[C@H](C)C=O e407b3f8d89671debf616b7fa7dc0ddb [0,1,1,0,0,0|1,0,1]=4 766 B8R0.6 CCCNCC(=O)CC 5f434fb49a11666bfc9ba500f0cbcfca [0,1,1,0,0,0|1,0,0]=3 767 B8R0.6 CCCNCC(=O)CO c0d2ea34a02dfba5aebbad6447271711 [0,1,1,0,0,0|1,0,0]=3 768 B8R0.6 CCCNCC(=O)NC eb0d012f1c9ad7dec4f4287f037196b3 [0,1,1,0,0,0|1,0,0]=3 769 B8R0.6 CCCNCC(=O)NO ef6f70702891ae45e4d4bb0573b2f089 [0,1,1,0,0,0|2,0,0]=4 770 B8R0.6 CCCNCC(=O)OC 3b0745436e6aac5047a752faa3629f9d [0,1,1,0,0,0|1,0,0]=3 771 B8R0.6 CCCOC/C(=C/I)/C dc8f9e85d6578ff08977a63eedf944cc [0,1,1,0,0,0|2,0,0]=4 772 B8R0.6 CCCOCC(=CI)C b3b55d96dd2a298243d83d73d18b42c8 [0,1,1,0,0,0|2,0,0]=4 773 B8R0.6 CCCOCC(=O)CC 3f397a74b90866b03f1163a524097d68 [0,1,1,0,0,0|1,0,0]=3 774 B8R0.6 CCCOCC(=O)NC 58f4813a2cc9a1be45793f06ebe468ea [0,1,1,0,0,0|1,0,0]=3 775 B8R0.6 CCCOCC(=O)OC c6e77fb768013ea608698b73991c1be0 [0,1,1,0,0,0|1,0,0]=3 776 B8R0.6 CCN(C)CCCC=O 3dbfe5dc5050d94978ae64e6b9604998 [0,1,1,0,0,0|1,0,0]=3 777 B8R0.6 CCNCCC(=O)NC 1e9b17ee02ba0e5b6aaaa347b3dcbe57 [0,1,1,0,0,0|1,0,0]=3 778 B8R0.6 CCNCCC(=O)NO 160d8ac572661099c06b72037ca2e0ea [0,1,1,0,0,0|2,0,0]=4 779 B8R0.6 CCNCCC(=O)OC bbd99f235af5ec44deb263c1fbced8c5 [0,1,1,0,0,0|1,0,0]=3 780 B8R0.6 CCOCCC(=O)NC 04f56cfd8d6885a7e2cb20782e900533 [0,1,1,0,0,0|1,0,0]=3 781 B8R0.6 CCOCCC(=O)OC 6c8ac8346f4b448f7b384f7ba30dc419 [0,1,1,0,0,0|1,0,0]=3 782 B8R0.6 CCOCCN(C)C=O 150e28d8c1b8a1d219f5e81a871d89a8 [0,1,1,0,0,0|2,0,0]=4 783 B8R0.6 CC[C@@H](C)COCC=O c20d93b7abbfab6c6470d540cd7a9908 [0,1,1,0,0,0|1,0,0]=3 784 B8R0.6 CC[C@@H](C)NCCC=O 7e1102ccaaec525d37867fc7a78c5909 [0,1,1,0,0,0|1,0,0]=3 785 B8R0.6 CC[C@@H](C)OCCC=O 368bcae871eba79a6fc9cfc4628ca9f3 [0,1,1,0,0,0|1,0,0]=3 786 B8R0.6 CC[C@@H](O)CNCC=O e6c97da33124e077a1a003eda729d8a4 [0,1,1,0,0,0|2,0,0]=4 787 B8R0.6 CC[C@H](C)CNCC=O 2b0760fdc9935c799222d1a5925541c3 [0,1,1,0,0,0|1,0,0]=3 788 B8R0.6 CC[C@H](C)COCC=O 96abd8316d02f524642d5d119877059b [0,1,1,0,0,0|1,0,0]=3 789 B8R0.6 CC[C@H](C)NCCC=O a962ffc26cc849df8f10ed5a3a3f3407 [0,1,1,0,0,0|1,0,0]=3 790 B8R0.6 CC[C@H](C)OCCC=O 663f558856e5f356903f7f6932db0707 [0,1,1,0,0,0|1,0,0]=3 791 B8R0.6 CN(C=O)CCCCO 7f619f7f07602d0a1e936e8e17f35450 [0,1,1,0,0,0|2,0,0]=4 792 B8R0.6 CNC(=O)CCNCF 7d032297ec7b15962e82d70691941148 [0,1,1,0,0,0|2,0,0]=4 793 B8R0.6 CNC(=O)CCNCO f9748f0c4978ae72b7a558591315c7a3 [0,1,1,0,0,0|2,0,0]=4 794 B8R0.6 CNC(=O)CCOCF d44958e5865e9e15b8b4578e30ceba1f [0,1,1,0,0,0|2,0,0]=4 795 B8R0.6 CNC(=O)CNCCBr 6c7bbb2b8e2277851a9c4b1ee98b855e [0,1,1,0,0,0|2,0,0]=4 796 B8R0.6 CNC(=O)CNCCF ad7e29831d5186eb0f908b77a11c392c [0,1,1,0,0,0|2,0,0]=4 797 B8R0.6 CNC(=O)CNCCI e2ceae3c2127a1926854bc9548bd60de [0,1,1,0,0,0|2,0,0]=4 798 B8R0.6 CNC(=O)CNCCO 6524c53498939c1e86b45867695a7210 [0,1,1,0,0,0|2,0,0]=4 799 B8R0.6 CNC(=O)CNCCS 910fb23341c3da7d5e154bf7558a8aca [0,1,1,0,0,0|2,0,0]=4 800 B8R0.6 CNC(=O)CNCOC 8847ec992234bab2b496b10120a2af91 [0,1,1,0,0,0|2,0,0]=4 801 B8R0.6 CNC(=O)CNCSC 885b3d7715d4a99b7fd1330a008578d3 [0,1,1,0,0,0|2,0,0]=4 802 B8R0.6 CNC(=O)COCCF 12ab537cbcf65659b34d887d9c7fb928 [0,1,1,0,0,0|2,0,0]=4 803 B8R0.6 CNC(=O)COCCS 63270616340bb3c6f39f4a96b70e09a6 [0,1,1,0,0,0|2,0,0]=4 804 B8R0.6 CNC(=O)COCOC 3537c715a815bdbf6b14bfada111b9bd [0,1,1,0,0,0|2,0,0]=4 805 B8R0.6 CNC(=O)COCSC 241621ed8c34a22b0f5a33905a2ce887 [0,1,1,0,0,0|2,0,0]=4 806 B8R0.6 COC(=O)CCNCF c9ea88c8e4da792c48ff261f6679c953 [0,1,1,0,0,0|2,0,0]=4 807 B8R0.6 COC(=O)CCNCO 9bc4822c35c94c877fc0ddc05b282774 [0,1,1,0,0,0|2,0,0]=4 808 B8R0.6 COC(=O)CCOCF 2f015a84e5a71939cec0c0c38276031f [0,1,1,0,0,0|2,0,0]=4 809 B8R0.6 COC(=O)CNCCBr e28aeca94e61f0de9c0ea2f9b9e87e88 [0,1,1,0,0,0|2,0,0]=4 810 B8R0.6 COC(=O)CNCCF d4a8c2b68347ac06f3cf07a0af263386 [0,1,1,0,0,0|2,0,0]=4 811 B8R0.6 COC(=O)CNCCI 45efb0e66cb53512c5450123a0571534 [0,1,1,0,0,0|2,0,0]=4 812 B8R0.6 COC(=O)CNCCO 9abf03e13c5594ade083b34dd22b9514 [0,1,1,0,0,0|2,0,0]=4 813 B8R0.6 COC(=O)CNCCS dafa382862b39c74b9bcdca9e45699c9 [0,1,1,0,0,0|2,0,0]=4 814 B8R0.6 COC(=O)CNCSC 8f9e6be1c8a25920663107a786d297b6 [0,1,1,0,0,0|2,0,0]=4 815 B8R0.6 COC(=O)COCCF 5fd538a27028a3025713a820ebe3ece9 [0,1,1,0,0,0|2,0,0]=4 816 B8R0.6 COC(=O)COCCS 8cf490d3a85a4d72de5bf7120c96cf93 [0,1,1,0,0,0|2,0,0]=4 817 B8R0.6 COC(=O)COCSC 0a7a5ae46e24085ed1063ee9467aa6ec [0,1,1,0,0,0|2,0,0]=4 818 B8R0.6 COC(C)COCC=O d60b36a618df9b4241244f9566ecdc5f [0,1,1,0,0,0|1,0,0]=3 819 B8R0.6 COCCCN(C)C=O 2dd2589e4563c98a7952d017ac8fb720 [0,1,1,0,0,0|2,0,0]=4 820 B8R0.6 COCCNC(=O)CF a94db18f72aef2ec4c716239c23c2008 [0,1,1,0,0,0|2,0,0]=4 821 B8R0.6 COCCNC(=O)CO d671289b16ab36037d0c8d78118b8d68 [0,1,1,0,0,0|2,0,0]=4 822 B8R0.6 COCCNC(=O)CS 4b3174b27751971a4c745429c4f67196 [0,1,1,0,0,0|2,0,0]=4 823 B8R0.6 COCNCC(=O)OC 418d993c7f5c594cafa954c9550f79e1 [0,1,1,0,0,0|2,0,0]=4 824 B8R0.6 COCOCC(=O)OC 2b399bb8cae6f66d03fa8086bd2ee628 [0,1,1,0,0,0|2,0,0]=4 825 B8R0.6 CO[C@@H](C)CNCC=O 2b4a7e30da32bc7234bd11589f11e153 [0,1,1,0,0,0|1,0,0]=3 826 B8R0.6 CO[C@@H](C)COCC=O 07ee3a6b4ceb80665f98c8f198456fc5 [0,1,1,0,0,0|1,0,0]=3 827 B8R0.6 CO[C@H](C)CNCC=O 7ca0dc6a01650113664fa48ed0e0ea51 [0,1,1,0,0,0|1,0,0]=3 828 B8R0.6 CO[C@H](C)COCC=O 8da8ed3e6726a83c5f05e475965abd23 [0,1,1,0,0,0|1,0,0]=3 829 B8R0.6 CSCCNC(=O)CF 57944584a9e694467df2be000c951ad6 [0,1,1,0,0,0|2,0,0]=4 830 B8R0.6 CSCCNC(=O)CO 65e8216c2feaa293039f65fdae32ef6d [0,1,1,0,0,0|2,0,0]=4 831 B8R0.6 CSCCNC(=O)CS 2af34aeed751cd9e812792b0dc7e1060 [0,1,1,0,0,0|2,0,0]=4 832 B8R0.6 C[C@@H](CO)CCNC=O 3feffe28caaaf0dbda7fb0990299be3b [0,1,1,0,0,0|1,0,0]=3 833 B8R0.6 C[C@@H](CO)NCCC=O 608fd81196e1155374938b5ce9be9d11 [0,1,1,0,0,0|1,0,0]=3 834 B8R0.6 C[C@H](C=O)OCCC=O 87e4ed47a9b86d975af2139f6b104017 [0,1,1,0,0,0|1,0,1]=4 835 B8R0.6 C[C@H](CO)CNCC=O ce3576180443b7d133df7f39370d8756 [0,1,1,0,0,0|1,0,0]=3 836 B8R0.6 C[C@H](CO)NCCC=O c6b2b9a5a05147f280b25371b2bca5f0 [0,1,1,0,0,0|1,0,0]=3 837 B8R0.6 C[C@H](CS)OCCC=O 59b0d090dd51e3a701804a923bcfc9bf [0,1,1,0,0,0|1,0,0]=3 838 B8R0.6 O=C(CF)NCCCCl 934b8e6ee889c80727ea8b7e3cae7f71 [0,1,1,0,0,0|2,0,0]=4 839 B8R0.6 O=C(CF)NCCCO f98476c767e724b095b3ceb9c47c191c [0,1,1,0,0,0|2,0,0]=4 840 B8R0.6 O=C(CO)CNCCBr 4b4dd4df91e92b925ca40ac918c073a9 [0,1,1,0,0,0|2,0,0]=4 841 B8R0.6 O=C(CO)CNCCF 9f05edaf4811ba7f9ac498eb6a37ffc4 [0,1,1,0,0,0|2,0,0]=4 842 B8R0.6 O=C(CO)CNCCI fad7dbe7caa4eb2201e5d92c6c999ddf [0,1,1,0,0,0|2,0,0]=4 843 B8R0.6 O=C(CO)CNCCO 8473c1767740ea9d135f46111299d63c [0,1,1,0,0,0|2,0,0]=4 844 B8R0.6 O=C(CO)CNCCS 0b181a826e47050c4e6ba69a8d17fa11 [0,1,1,0,0,0|2,0,0]=4 845 B8R0.6 O=C(CO)NCCCCl 0c789d035d9d5ee643962906d4106d8a [0,1,1,0,0,0|2,0,0]=4 846 B8R0.6 O=C(CO)NCCCO 8d20a4d16a68281342a6c9aa794f8168 [0,1,1,0,0,0|2,0,0]=4 847 B8R0.6 O=C(CS)NCCCCl 17654daec75e68e56a406f3209f982cd [0,1,1,0,0,0|2,0,0]=4 848 B8R0.6 O=C(CS)NCCCO 9609fec7c0df8b51e8b529e1db0af996 [0,1,1,0,0,0|2,0,0]=4 849 B8R0.6 O=CCNCC(Br)CBr f8b4628b874c00ea67f5b1ea31294bcb [0,1,1,0,0,0|2,0,0]=4 850 B8R0.6 O=CCNCC(F)CO 46d395441643b8391343b1608d225a77 [0,1,1,0,0,0|2,0,0]=4 851 B8R0.6 O=CCNCC(O)CO fda7899aa326db8479a7cf6ed9ff5496 [0,1,1,0,0,0|2,0,0]=4 852 B8R0.6 O=CCNC[C@@H](F)CO 5e18cd98a50b003516d72cc51ca3a1a4 [0,1,1,0,0,0|2,0,0]=4 853 B8R0.6 O=CCNC[C@@H](O)CO cfa882ca9454e8329a6128be9a5cb6e1 [0,1,1,0,0,0|2,0,0]=4 854 B8R0.6 O=CCNC[C@H](F)CO daaf806b3ec268a7d82f89fcafa4ccb5 [0,1,1,0,0,0|2,0,0]=4 855 B8R0.6 O=CCNC[C@H](O)CO 7ac55096fec47b7cc6006cf27ed82417 [0,1,1,0,0,0|2,0,0]=4 856 B8R0.6 O=CCOCC(Br)CBr aae332e0e58a483c7a378575c78ea8c6 [0,1,1,0,0,0|2,0,0]=4 857 B8R0.6 O=CCOCC(Cl)CCl 6c5deed46908ce8b01b3167bdc1c4832 [0,1,1,0,0,0|2,0,0]=4 858 B8R0.6 O=CCOCC(S)CS bd94fe95bf66dc42f5eb22995ef59c1b [0,1,1,0,0,0|2,0,0]=4 859 B8R0.6 O=CNCCC(O)CO e7dc97883d31a0c7dd013812e3944a74 [0,1,1,0,0,0|2,0,0]=4 860 B8R0.7 C#CCCCNC(=O)C 8bbad3dcf674b05cb5f90221808a2bb7 [0,1,1,0,0,0|0,0,2]=4 861 B8R0.7 C#CCCCNC(C)C a191f2dd6f3014e4785c981a31a68729 [0,1,1,0,0,0|1,0,1]=4 862 B8R0.7 C#CCCCOC(C)C c2df5f3e15633977f96051966f9f9505 [0,1,1,0,0,0|1,0,1]=4 863 B8R0.7 C#CCCNCC(=O)C c4cc756a51afb7be13a15a9a08fcff4c [0,1,1,0,0,0|0,0,2]=4 864 B8R0.7 C#CCCNCC(C)C e10dab758f95491c9440691e96a3d863 [0,1,1,0,0,0|1,0,1]=4 865 B8R0.7 C#CCCOCC(=O)C d40f062f5d5b5dd437467b58ad4478ba [0,1,1,0,0,0|0,0,2]=4 866 B8R0.7 C#CCCOCC(C)C aefb6ad98935f0a63d573e49cded9a56 [0,1,1,0,0,0|1,0,1]=4 867 B8R0.7 C#CCNCCC(=O)C c404d0087dc2dc93430e30073cbb1872 [0,1,1,0,0,0|0,0,2]=4 868 B8R0.7 C#CCNCCC(C)C 4a1ee3a8656fbdaeac93a06a821c9369 [0,1,1,0,0,0|1,0,1]=4 869 B8R0.7 C#CCOCCC(=O)C 5d051bea38d55a1d1b77591e946629a4 [0,1,1,0,0,0|0,0,2]=4 870 B8R0.7 C#CCOCCC(C)C d72bb51363c8e7ca5e67fd11d4f99fea [0,1,1,0,0,0|1,0,1]=4 871 B8R0.7 C/C=C/CCOC(C)C 57859a6e8a4f2b42a112ca30c6eb34ea [0,1,1,0,0,0|1,0,1]=4 872 B8R0.7 C/C=C/CNCC(=O)C d08365ea544d9b1f5f738627bd1655a4 [0,1,1,0,0,0|0,0,2]=4 873 B8R0.7 C/C=C/CNCC(C)C e5a937907a4337201bf33aee5a6b3888 [0,1,1,0,0,0|1,0,1]=4 874 B8R0.7 C/C=C/COCC(=O)C 8704cfa8ea1b508d264e8fc5e5c29d85 [0,1,1,0,0,0|0,0,2]=4 875 B8R0.7 C/C=C/COCC(C)C 8ec13cf40c3b90303310083630c7b896 [0,1,1,0,0,0|1,0,1]=4 876 B8R0.7 C/C=C\CNCC(=O)C 6a6c9d418c0891c2fa3bf4c597c04764 [0,1,1,0,0,0|0,0,2]=4 877 B8R0.7 C/C=C\CNCC(C)C 1a299450c5c350cd20a8a498c26f414a [0,1,1,0,0,0|1,0,1]=4 878 B8R0.7 C/C=C\COCC(=O)C 2779d7a42d72df0b04bf874f0b76bd29 [0,1,1,0,0,0|0,0,2]=4 879 B8R0.7 C/C=C\COCC(C)C 42b0314d12dbacaee541d6c376041c6f [0,1,1,0,0,0|1,0,1]=4 880 B8R0.7 C=C(Br)CCOCCC 724052c822c0bef7448f44a794bff992 [0,1,1,0,0,0|1,0,1]=4 881 B8R0.7 C=C(Br)CNCCCC 7c9c44e81bf00a83350435698bbd8321 [0,1,1,0,0,0|1,0,1]=4 882 B8R0.7 C=C(Br)COCCCC ec6d613824c971053aa03d22d6526bd3 [0,1,1,0,0,0|1,0,1]=4 883 B8R0.7 C=C(C)CCCOCC 36ef5adff872f4dda81f11eae3241c37 [0,1,1,0,0,0|1,0,0]=3 884 B8R0.7 C=C(C)CCCOCF 76264cef51d14a00e40692a03297067c [0,1,1,0,0,0|2,0,0]=4 885 B8R0.7 C=C(C)CCNCC=O 4c3ba9587f8532929abf485727b781bd [0,1,1,0,0,0|0,0,2]=4 886 B8R0.7 C=C(C)CCNCCBr 7ced6d8c6e32bc1f876500890047cded [0,1,1,0,0,0|2,0,0]=4 887 B8R0.7 C=C(C)CCNCCC 4d1900f680cbfef6ffe5a77e2294dd65 [0,1,1,0,0,0|1,0,0]=3 888 B8R0.7 C=C(C)CCNCCF 8569016bcb7348aaa45008d66f5f6a2c [0,1,1,0,0,0|2,0,0]=4 889 B8R0.7 C=C(C)CCNCCI d20ef749df3249ef9aaad80f778516f3 [0,1,1,0,0,0|2,0,0]=4 890 B8R0.7 C=C(C)CCNCCO 21920b0882725c69be4c5ff08469b5db [0,1,1,0,0,0|2,0,0]=4 891 B8R0.7 C=C(C)CCNCCS 2f2e2170dcd696655a54f1153dbc50c6 [0,1,1,0,0,0|2,0,0]=4 892 B8R0.7 C=C(C)CCNCOC 7be90491ee700292d0e2b62ea3c5d946 [0,1,1,0,0,0|2,0,0]=4 893 B8R0.7 C=C(C)CCNCSC 0537b76f67ce88918e3939b8c0661738 [0,1,1,0,0,0|2,0,0]=4 894 B8R0.7 C=C(C)CCOCC=O da9ea0e0498e99e55f19b3c9d4d5bcb1 [0,1,1,0,0,0|0,0,2]=4 895 B8R0.7 C=C(C)CCOCCC 845281f0f16ba18f3aad20093af18d36 [0,1,1,0,0,0|1,0,0]=3 896 B8R0.7 C=C(C)CCOCCF cad086a36984e044fb55164106973801 [0,1,1,0,0,0|2,0,0]=4 897 B8R0.7 C=C(C)CCOCCS c14b0067a06142591fd279d6fe25eb06 [0,1,1,0,0,0|2,0,0]=4 898 B8R0.7 C=C(C)CCOCOC 2d580783ee3d7b7a5ba6e90b0c9cd47a [0,1,1,0,0,0|2,0,0]=4 899 B8R0.7 C=C(C)CCOCSC 8b354d12fad36f04225eaa7c7e6282c1 [0,1,1,0,0,0|2,0,0]=4 900 B8R0.7 C=C(C)CNCCC=O 311dfeb8205d8e8cbdd8287713a6c3e0 [0,1,1,0,0,0|0,0,2]=4 901 B8R0.7 C=C(C)CNCCCC 47f5fb139675fc765be0663116650609 [0,1,1,0,0,0|1,0,0]=3 902 B8R0.7 C=C(C)CNCCCCl 846c99a3b9539c7d1bf408b5c7720df3 [0,1,1,0,0,0|2,0,0]=4 903 B8R0.7 C=C(C)CNCCCF beb220b1f62c61215fe4088c375ae748 [0,1,1,0,0,0|2,0,0]=4 904 B8R0.7 C=C(C)CNCCCO 4c5bf90b2f32d3a4f10f165a15242432 [0,1,1,0,0,0|2,0,0]=4 905 B8R0.7 C=C(C)CNCCCS 0a6e65af8417b99414a8ba398cfdd355 [0,1,1,0,0,0|2,0,0]=4 906 B8R0.7 C=C(C)CNCCOC 9d11af89280f819077ad9c1b1c3e595f [0,1,1,0,0,0|2,0,0]=4 907 B8R0.7 C=C(C)CNCCSC 3f20f05b0e16d23c2ebfc029ac4818f9 [0,1,1,0,0,0|2,0,0]=4 908 B8R0.7 C=C(C)CNCOCC 5232fb2ea1283f6a12b07e7e1960cc36 [0,1,1,0,0,0|2,0,0]=4 909 B8R0.7 C=C(C)COCCC=O 42d5e99ccfec788cebe16494c41e8b9c [0,1,1,0,0,0|0,0,2]=4 910 B8R0.7 C=C(C)COCCCC 260d3670dc084e87502d9a9ffe570e3c [0,1,1,0,0,0|1,0,0]=3 911 B8R0.7 C=C(C)COCCCF d7bfb5949c51972c3e54f6e8bca91cae [0,1,1,0,0,0|2,0,0]=4 912 B8R0.7 C=C(C)COCCCS ce1f8ade88868e163cf874f2fb32694a [0,1,1,0,0,0|2,0,0]=4 913 B8R0.7 C=C(C)COCCOC 4c97b3aa85916d5020a98673772e2c8a [0,1,1,0,0,0|2,0,0]=4 914 B8R0.7 C=C(C)COCCSC f6054d02b49bf489f798212392eec68c [0,1,1,0,0,0|2,0,0]=4 915 B8R0.7 C=C(C)COCOCC 386ffc84facf9cdf98d22feeb307d2d3 [0,1,1,0,0,0|2,0,0]=4 916 B8R0.7 C=C(Cl)CNCCCC 8cde48ce042cc357f299abd3d75de5f6 [0,1,1,0,0,0|1,0,1]=4 917 B8R0.7 C=C(Cl)COCCCC b9221f326393a29bb0b2b7fc0007ae8a [0,1,1,0,0,0|1,0,1]=4 918 B8R0.7 C=C(F)CNCCCC d50f3d468cf2542e6029912d15cd6fb8 [0,1,1,0,0,0|1,0,1]=4 919 B8R0.7 C=C(F)COCCCC 985eead93b4fa2eb0f6e6420dae41362 [0,1,1,0,0,0|1,0,1]=4 920 B8R0.7 C=C(I)COCCCC ad06c21e680b3d0f2a946d2102fcc07e [0,1,1,0,0,0|1,0,1]=4 921 B8R0.7 C=C=CCCOC(C)C 2c96a9b0827028cf5a3a6008e9bc6224 [0,1,1,0,0,0|2,0,0]=4 922 B8R0.7 C=CCCCNC(=O)C a96a5f1b6b5650813d22e03237823400 [0,1,1,0,0,0|0,0,2]=4 923 B8R0.7 C=CCCCNC(C)C 894cae9fc935a78c0b067be4248ffc85 [0,1,1,0,0,0|1,0,0]=3 924 B8R0.7 C=CCCCOC(C)C 44f540e8992dd6ebc85c497ca5bd3da7 [0,1,1,0,0,0|1,0,0]=3 925 B8R0.7 C=CCCNCC(=O)C bcd99b30d0ece034ae8651490e56c6a5 [0,1,1,0,0,0|0,0,2]=4 926 B8R0.7 C=CCCNCC(C)C 1982685da06926e0cc923f857859a0da [0,1,1,0,0,0|1,0,0]=3 927 B8R0.7 C=CCCNCC(C)O 4e6571e99dcee760d886b22b570b5c1d [0,1,1,0,0,0|2,0,0]=4 928 B8R0.7 C=CCCNCN(C)C eceb5ac379e24d8757be166f331f1f73 [0,1,1,0,0,0|2,0,0]=4 929 B8R0.7 C=CCCNC[C@@H](C)O 3bfe2cc9bba1b6e9c950926ca5be5329 [0,1,1,0,0,0|2,0,0]=4 930 B8R0.7 C=CCCNC[C@H](C)O a4471c07315e747de28477afc10e9fee [0,1,1,0,0,0|2,0,0]=4 931 B8R0.7 C=CCCOCC(=O)C 797d503837e4e202e9cb8254fa6d250d [0,1,1,0,0,0|0,0,2]=4 932 B8R0.7 C=CCCOCC(C)C f8f56569331f47ab6b85f26977d0706c [0,1,1,0,0,0|1,0,0]=3 933 B8R0.7 C=CCCOCC(C)F 35268cb4c3d8d39c50e552ba36723a50 [0,1,1,0,0,0|2,0,0]=4 934 B8R0.7 C=CCCOCC(C)S 0b13fb2271dc81ae4874cca9b955c6d8 [0,1,1,0,0,0|2,0,0]=4 935 B8R0.7 C=CCCOCN(C)C 5bd37421946c502614179aa125c68111 [0,1,1,0,0,0|2,0,0]=4 936 B8R0.7 C=CCCOC[C@@H](C)F 33ed1a4a48834dadd0ef0c94077124ed [0,1,1,0,0,0|2,0,0]=4 937 B8R0.7 C=CCCOC[C@H](C)F f03681ee0a33fbb7ce4605edeb70867a [0,1,1,0,0,0|2,0,0]=4 938 B8R0.7 C=CCNCCC(C)C 02f8ade1f1fe2a42fcd16f311d553eac [0,1,1,0,0,0|1,0,0]=3 939 B8R0.7 C=CCNCCC(C)O 1fed6d4363741bd7ad41e738315a760d [0,1,1,0,0,0|2,0,0]=4 940 B8R0.7 C=CCNCCN(C)C 1b3ce81826c26bea5ab385b244bc798b [0,1,1,0,0,0|2,0,0]=4 941 B8R0.7 C=CCNCC[C@@H](C)O eb18158b4edf95e8d76cbe758b4cff9f [0,1,1,0,0,0|2,0,0]=4 942 B8R0.7 C=CCNCC[C@H](C)O 4473edaccfa79377adf605e73cbba0bd [0,1,1,0,0,0|2,0,0]=4 943 B8R0.7 C=CCOCCC(=O)C 329a78e4caec96ed4eabde1e54085f6f [0,1,1,0,0,0|0,0,2]=4 944 B8R0.7 C=CCOCCC(C)C dc2b2939e1232ad92646d1a4f0a37a80 [0,1,1,0,0,0|1,0,0]=3 945 B8R0.7 C=CCOCCN(C)C 396f0cb9f4d9139b3793f0355979ea47 [0,1,1,0,0,0|2,0,0]=4 946 B8R0.7 C=COCCNC(C)C add3040c31282427bcf36ce2a3978af4 [0,1,1,0,0,0|2,0,0]=4 947 B8R0.7 C=COCCOC(C)C 5cd8e52b6baa2e7d14f9120affa1c52b [0,1,1,0,0,0|2,0,0]=4 948 B8R0.7 CC(=CCNCC=O)C 3064b3a277f78689989dd384c9ba4954 [0,1,1,0,0,0|0,0,2]=4 949 B8R0.7 CC(=CCOCC=O)C 4ab5a59373408a34b4481ca370ab3cf9 [0,1,1,0,0,0|0,0,2]=4 950 B8R0.7 CC(=O)CCCNC#N 8b7273c99af5c82cd0047226199ec8d9 [0,1,1,0,0,0|1,0,1]=4 951 B8R0.7 CC(=O)CCCOCF c94204172541830dae5131095b16871b [0,1,1,0,0,0|1,0,0]=3 952 B8R0.7 CC(=O)CCNCC#N 769fb98f7c4af2806e1b1e6106e1fb3b [0,1,1,0,0,0|1,0,1]=4 953 B8R0.7 CC(=O)CCNCCBr 24723ec774300f363e1c4ef5edc15c1c [0,1,1,0,0,0|1,0,0]=3 954 B8R0.7 CC(=O)CCNCCF 40798bc4989369da7dcdf726fe0e87a1 [0,1,1,0,0,0|1,0,0]=3 955 B8R0.7 CC(=O)CCNCCI d7d5a1870b965338fecd7489cd9c07db [0,1,1,0,0,0|1,0,0]=3 956 B8R0.7 CC(=O)CCNCCO a83400d724de744cf447c1456bef989f [0,1,1,0,0,0|1,0,0]=3 957 B8R0.7 CC(=O)CCNCCS 47ae194edd083db7c9ba93ef9079950b [0,1,1,0,0,0|1,0,0]=3 958 B8R0.7 CC(=O)CCOCC#N e0071fb57f9ed70e6e69159a4d59ad92 [0,1,1,0,0,0|1,0,1]=4 959 B8R0.7 CC(=O)CCOCC=O 7d9485ec83093875068f9e670696c657 [0,1,1,0,0,0|1,0,1]=4 960 B8R0.7 CC(=O)CCOCCF 7fad36a16ea18946b1976097922c5d63 [0,1,1,0,0,0|1,0,0]=3 961 B8R0.7 CC(=O)CCOCCS 9f3db6cd3be1dbc7c558d110015ffb61 [0,1,1,0,0,0|1,0,0]=3 962 B8R0.7 CC(=O)CNCCC#N cee37c97fe16e1f2f71518cd3f26d1c6 [0,1,1,0,0,0|1,0,1]=4 963 B8R0.7 CC(=O)CNCCC=O 9828f01b09fdb5fac4564520c95c63a6 [0,1,1,0,0,0|1,0,1]=4 964 B8R0.7 CC(=O)CNCCCF 01d09128914fbef0e9d6c6589849cfeb [0,1,1,0,0,0|1,0,0]=3 965 B8R0.7 CC(=O)CNCCCO 6b18feab134fa1608a1e961ad3762058 [0,1,1,0,0,0|1,0,0]=3 966 B8R0.7 CC(=O)CNCCCS 482b044f1453b6ed81cab115d2862b45 [0,1,1,0,0,0|1,0,0]=3 967 B8R0.7 CC(=O)COCCC#N 124c12496a741677c11befadae46beff [0,1,1,0,0,0|1,0,1]=4 968 B8R0.7 CC(=O)COCCC=O 67fac1685908ac3ed2e3421f7c02f4dc [0,1,1,0,0,0|1,0,1]=4 969 B8R0.7 CC(=O)COCCCF 7e71123e6763570d0b52e6653e8ee828 [0,1,1,0,0,0|1,0,0]=3 970 B8R0.7 CC(=O)COCCCS 638442dc16e5a63efd8808c1ef8dea5e [0,1,1,0,0,0|1,0,0]=3 971 B8R0.7 CC(=O)NCCCC#N 4c43f07b4dd9f661d7f672a979b3f954 [0,1,1,0,0,0|1,0,1]=4 972 B8R0.7 CC(=O)NCCCCCl ca2b0e10b9c67d6c9ac8f4d9ab4c2b88 [0,1,1,0,0,0|1,0,0]=3 973 B8R0.7 CC(=O)NCCCCO 57936c738ed3f822f33ee01b6260a94e [0,1,1,0,0,0|1,0,0]=3 974 B8R0.7 CC(=O)NCCCCS c05ad9ce2696d1887a7029e678ac4e5e [0,1,1,0,0,0|1,0,0]=3 975 B8R0.7 CC(=O)NCCNCF db91b63aaf221a36f5f6ac9412eb39bb [0,1,1,0,0,0|2,0,0]=4 976 B8R0.7 CC(=O)NCCNCO 818a1f0b2f9e527fc51c0718d6aa51ec [0,1,1,0,0,0|2,0,0]=4 977 B8R0.7 CC(=O)NCCOCF 64711f295825afc1aa99ebd9c8f8a648 [0,1,1,0,0,0|2,0,0]=4 978 B8R0.7 CC(=O)NCOCCF 71f4d510aaa6fcd6f0cc129128b41850 [0,1,1,0,0,0|2,0,0]=4 979 B8R0.7 CC(=O)NCOCCS ea386d431c82b5e4a577412c44abfbbd [0,1,1,0,0,0|2,0,0]=4 980 B8R0.7 CC(=O)OCCOCF 756380d609b85c4340107bc6c786fe33 [0,1,1,0,0,0|2,0,0]=4 981 B8R0.7 CC(=O)OCNCCBr 174298ba317d3d2bde96945db1ddc7ca [0,1,1,0,0,0|2,0,0]=4 982 B8R0.7 CC(=O)OCNCCF 63fb375855a825e0738d855f91fad5fd [0,1,1,0,0,0|2,0,0]=4 983 B8R0.7 CC(=O)OCNCCI dbce8e98f599d4912e85f711777f148f [0,1,1,0,0,0|2,0,0]=4 984 B8R0.7 CC(=O)OCNCCO 02ed0f7075f3856f82fcf4a6039e490a [0,1,1,0,0,0|2,0,0]=4 985 B8R0.7 CC(=O)OCNCCS 754743a28ff18a32145801e587e13f07 [0,1,1,0,0,0|2,0,0]=4 986 B8R0.7 CC(=O)OCOCCF 5b1b288bc16deebdd842b5c68c58b799 [0,1,1,0,0,0|2,0,0]=4 987 B8R0.7 CC(=O)OCOCCS 5bf0970c2800c0896344fcb315a8ccbb [0,1,1,0,0,0|2,0,0]=4 988 B8R0.7 CC(C)CCCNC#N b26d986ff5d7d2e96e2228fa15fa9499 [0,1,1,0,0,0|1,0,1]=4 989 B8R0.7 CC(C)CCCNC=O bfa0e9e134f210b758698d92c7453fd7 [0,1,1,0,0,0|0,0,0]=2 990 B8R0.7 CC(C)CCCNCF db99dd2fc56150b995ab6795ced65117 [0,1,1,0,0,0|1,0,1]=4 991 B8R0.7 CC(C)CCCNCO 9750317b56b896399a99f3a7f7a4e4a1 [0,1,1,0,0,0|0,0,2]=4 992 B8R0.7 CC(C)CCCOCF 074ff3c76c900e9b0ff85e608ffe9d01 [0,1,1,0,0,0|1,0,1]=4 993 B8R0.7 CC(C)CCNCC#N ef2455ad975761f49e382ff01598923b [0,1,1,0,0,0|1,0,1]=4 994 B8R0.7 CC(C)CCNCC=O 7f31486d3b2c7da3640d8a6a2c90d7ec [0,1,1,0,0,0|0,0,0]=2 995 B8R0.7 CC(C)CCNCCBr 63072d1bb0b37e13e4137a2658df5d3f [0,1,1,0,0,0|1,0,1]=4 996 B8R0.7 CC(C)CCNCCF fa88e798a35cb724c574c6d9beb4e026 [0,1,1,0,0,0|1,0,1]=4 997 B8R0.7 CC(C)CCNCCI 23da00c7d0e9607a32f436f0aa75fc42 [0,1,1,0,0,0|1,0,1]=4 998 B8R0.7 CC(C)CCNCCO 8808dbc8c43d3215658a37aae8c42922 [0,1,1,0,0,0|0,0,2]=4 999 B8R0.7 CC(C)CCNCCS f6fd9c0c9c1c8fd19eba108b534a9da0 [0,1,1,0,0,0|0,1,1]=4 1000 B8R0.7 CC(C)CCOCC#N b3cac106bbceade6f75af0b197358303 [0,1,1,0,0,0|1,0,1]=4 1001 B8R0.7 CC(C)CCOCC=O c3d2780edfa1fb6d6d194e7c0384e701 [0,1,1,0,0,0|0,0,0]=2 1002 B8R0.7 CC(C)CCOCCF 8c34c8e85518cf7592e3f685afefb143 [0,1,1,0,0,0|1,0,1]=4 1003 B8R0.7 CC(C)CCOCCS 32244445bbb2f48b4effe9772a2a7a0f [0,1,1,0,0,0|0,1,1]=4 1004 B8R0.7 CC(C)CNC/C=C/Cl 3d0b71abeed706a73e3b7c22029cb15d [0,1,1,0,0,0|1,0,1]=4 1005 B8R0.7 CC(C)CNC/C=C\Cl 18bcca763523de9a85009fd8c2251730 [0,1,1,0,0,0|1,0,1]=4 1006 B8R0.7 CC(C)CNC/C=C\O 2a9e8c84ec357ff0db3f516b3676402a [0,1,1,0,0,0|0,0,2]=4 1007 B8R0.7 CC(C)CNCCC#N 6afc924d6727acdfd4cea38494c8555d [0,1,1,0,0,0|1,0,1]=4 1008 B8R0.7 CC(C)CNCCC=O c6d6e4834d14f931aabc475254ed07bc [0,1,1,0,0,0|0,0,0]=2 1009 B8R0.7 CC(C)CNCCCCl 83551d904dbd627980ba793c1942d0e5 [0,1,1,0,0,0|1,0,1]=4 1010 B8R0.7 CC(C)CNCCCF e685da6699f44994d973febb9b810867 [0,1,1,0,0,0|1,0,1]=4 1011 B8R0.7 CC(C)CNCCCO 1cd6cdd205d9b8765f3eafc45298521d [0,1,1,0,0,0|0,0,2]=4 1012 B8R0.7 CC(C)CNCCCS 240b44f5bc44a9ca7d752febf9653f98 [0,1,1,0,0,0|0,1,1]=4 1013 B8R0.7 CC(C)CNCCON 8e91a62e1bb43e3a5c1b835333643145 [0,1,1,0,0,0|2,0,0]=4 1014 B8R0.7 CC(C)COC/C=C/Cl 0ce53ca30a5622eb088c942e21e74c99 [0,1,1,0,0,0|1,0,1]=4 1015 B8R0.7 CC(C)COC/C=C\Cl b887caec2d2df942d09a1c5e2755f136 [0,1,1,0,0,0|1,0,1]=4 1016 B8R0.7 CC(C)COCC=CCl 0153146ea4223b17bea15a288ddd0a0c [0,1,1,0,0,0|1,0,1]=4 1017 B8R0.7 CC(C)COCCC#N 70e50476844f1c704ebc6094f2361362 [0,1,1,0,0,0|1,0,1]=4 1018 B8R0.7 CC(C)COCCC=O 0606e6b209ad758c0703a3db270b4a8f [0,1,1,0,0,0|0,0,0]=2 1019 B8R0.7 CC(C)COCCCF 47b3e7003392b7e4d6af83ce49e8ae15 [0,1,1,0,0,0|1,0,1]=4 1020 B8R0.7 CC(C)COCCCS 4a6bc2e192e2a8c81d6a0173f59ed2af [0,1,1,0,0,0|0,1,1]=4 1021 B8R0.7 CC(C)NCCCC#N faa61ecb1dda45de27e6e00a170e9407 [0,1,1,0,0,0|1,0,1]=4 1022 B8R0.7 CC(C)NCCCCCl 760ce504f04b0a2c192a1d1765dbdc9f [0,1,1,0,0,0|1,0,1]=4 1023 B8R0.7 CC(C)NCCCCO cac322fa4c207db5bec318c0141a5615 [0,1,1,0,0,0|0,0,2]=4 1024 B8R0.7 CC(C)NCCCCS 974c6621180d0a894c4f21e582cd2063 [0,1,1,0,0,0|0,1,1]=4 1025 B8R0.7 CC(C)OC/C=C/C=O 4e4160efe718f5443229ce2fbcf01269 [0,1,1,0,0,0|0,0,2]=4 1026 B8R0.7 CC(C)OCCCC#N 71b8013ef203dbf4432810bfa1831972 [0,1,1,0,0,0|1,0,1]=4 1027 B8R0.7 CC(C)OCCCC=O a0a336521d27b867089bba2506cd7e1c [0,1,1,0,0,0|0,0,0]=2 1028 B8R0.7 CC(C)OCCCCF f9388f7924de81152ad266bc0e0fb91b [0,1,1,0,0,0|1,0,1]=4 1029 B8R0.7 CC(C)OCCCCS 7024b4637fc758d50ee27d269b165a7f [0,1,1,0,0,0|0,1,1]=4 1030 B8R0.7 CC(C)OCCNC=O 9db582d0158adc28dc148f1bd6556868 [0,1,1,0,0,0|1,0,0]=3 1031 B8R0.7 CC(C)OCCOC=O 1a56f018311ee77835abf65d4ff13081 [0,1,1,0,0,0|1,0,0]=3 1032 B8R0.7 CC(F)COCCC=O 1721f092429c0c96e4348392f19d4316 [0,1,1,0,0,0|1,0,0]=3 1033 B8R0.7 CC(O)CCNCC=O 9cf0036a3003ba539050104e2775dce4 [0,1,1,0,0,0|1,0,0]=3 1034 B8R0.7 CC(O)CNCCC=O a4922223293093343e687f0f88cdb1fd [0,1,1,0,0,0|1,0,0]=3 1035 B8R0.7 CC(S)COCCC=O a7a3c25c049b5dea5756d7eedb9dd76b [0,1,1,0,0,0|1,0,0]=3 1036 B8R0.7 CC=CCNCC(C)C 0ee3addc23bb078a62f5c57c3de30544 [0,1,1,0,0,0|1,0,1]=4 1037 B8R0.7 CC=CCOCC(C)C ccd450e3ab198b216809b6e4042e1597 [0,1,1,0,0,0|1,0,1]=4 1038 B8R0.7 CCCCCNC(=O)C da50d5d5f7d2f7c8f9763330c7139773 [0,1,1,0,0,0|0,0,0]=2 1039 B8R0.7 CCCCCNC(C)C fecd5fbc16956a143ac8609a2bd9e0c3 [0,1,1,0,0,0|1,0,1]=4 1040 B8R0.7 CCCCCOC(C)C d4e915467a92d9554e0d3ccd108d1b4d [0,1,1,0,0,0|1,0,1]=4 1041 B8R0.7 CCCCNCC(=O)C 8dbf7bfa43a4d98486dbc3615b11d498 [0,1,1,0,0,0|0,0,0]=2 1042 B8R0.7 CCCCNCC(=O)N 69585f0b9c8687120ac53dbaccd84fc0 [0,1,1,0,0,0|1,0,0]=3 1043 B8R0.7 CCCCNCC(=O)O a8de0a477de91420770c0a272ef6f881 [0,1,1,0,0,0|1,0,0]=3 1044 B8R0.7 CCCCNCC(C)C 14e08612915cf77b2fa2c2f94f61132b [0,1,1,0,0,0|1,0,1]=4 1045 B8R0.7 CCCCNCC(C)O 931ffaa97d207c9fb7ebac0ec881f8e7 [0,1,1,0,0,0|0,0,2]=4 1046 B8R0.7 CCCCNCN(C)C e1ce7e7ec8d6dee5ae81d311d66afe96 [0,1,1,0,0,0|2,0,0]=4 1047 B8R0.7 CCCCNC[C@@H](C)O 4edb0f48a9a733f4509d2f3b0321ae53 [0,1,1,0,0,0|0,0,2]=4 1048 B8R0.7 CCCCNC[C@H](C)O 57de7703f075876997013fb957b70c80 [0,1,1,0,0,0|0,0,2]=4 1049 B8R0.7 CCCCNC[N+](=O)[O-] b37a4d591c4d5c287e1ebe6ace96f684 [0,1,1,0,0,0|2,0,0]=4 1050 B8R0.7 CCCCOCC(=O)C badc4ff846862f74785a1abd49004213 [0,1,1,0,0,0|0,0,0]=2 1051 B8R0.7 CCCCOCC(=O)N 34eb6fb5b7f360ec9fe33699fca54d51 [0,1,1,0,0,0|1,0,0]=3 1052 B8R0.7 CCCCOCC(=O)O a087235172e11e6141c3e38f9ce4e4ce [0,1,1,0,0,0|1,0,0]=3 1053 B8R0.7 CCCCOCC(=S)N 66f00256fcd5080323facaf554f24131 [0,1,1,0,0,0|1,1,0]=4 1054 B8R0.7 CCCCOCC(C)C 68b7612d0f936ebbf9a831b7d6c778be [0,1,1,0,0,0|1,0,1]=4 1055 B8R0.7 CCCCOCC(C)F b61cc2ea745ef93460e21e251f057d4d [0,1,1,0,0,0|1,0,1]=4 1056 B8R0.7 CCCCOCC(C)S 0d43463b5fb693fda0dbccdcbbdd2ce0 [0,1,1,0,0,0|0,1,1]=4 1057 B8R0.7 CCCCOCN(C)C 3598f39145ccde2eee87aa91337fcbb4 [0,1,1,0,0,0|2,0,0]=4 1058 B8R0.7 CCCCOCS(=O)O 6325931987c0950b79bb089ebdc78c41 [0,1,1,0,0,0|2,0,0]=4 1059 B8R0.7 CCCCOC[C@@H](C)F 395daf95e36b203ab6e7a7c03c8e4490 [0,1,1,0,0,0|1,0,1]=4 1060 B8R0.7 CCCCOC[C@H](C)F 26014bea3230facd252589a2fc4ef47c [0,1,1,0,0,0|1,0,1]=4 1061 B8R0.7 CCCCOC[N+](=O)[O-] 94b3f3bcc50279ace071168fd7298364 [0,1,1,0,0,0|2,0,0]=4 1062 B8R0.7 CCCNC/C=C(/C)\I a77ce06125d9c73831e62376d6be0fc0 [0,1,1,0,0,0|1,0,1]=4 1063 B8R0.7 CCCNC/C=C(\C)/Cl 126e03eaad5b55a6a1e28418959632f2 [0,1,1,0,0,0|1,0,1]=4 1064 B8R0.7 CCCNCC=C(C)C 029a389e0c61ae0bd25944f993ae298b [0,1,1,0,0,0|1,0,1]=4 1065 B8R0.7 CCCNCC=C(C)Cl efaac4fe73efd3293fd70f693c290d56 [0,1,1,0,0,0|1,0,1]=4 1066 B8R0.7 CCCNCC=C(C)I a5752b317cc0800d3b92ad72ab74de8f [0,1,1,0,0,0|1,0,1]=4 1067 B8R0.7 CCCNCCC(=O)C d627d93187ac3c2b4a5879a831f73b21 [0,1,1,0,0,0|0,0,0]=2 1068 B8R0.7 CCCNCCC(=O)N 8a2306560cfefa8994234df81900436d [0,1,1,0,0,0|1,0,0]=3 1069 B8R0.7 CCCNCCC(=O)O 47226423aa5b665923516680070294a2 [0,1,1,0,0,0|1,0,0]=3 1070 B8R0.7 CCCNCCC(=S)N 9bd19729128b21bf5f6ba43475b023e4 [0,1,1,0,0,0|1,1,0]=4 1071 B8R0.7 CCCNCCC(C)C 76a9f83b0ca62c4bc3c8277b05f628fa [0,1,1,0,0,0|1,0,1]=4 1072 B8R0.7 CCCNCCC(C)O ccdd4aef6b342b7b92e15346bf177ff3 [0,1,1,0,0,0|0,0,2]=4 1073 B8R0.7 CCCNCCN(C)C 1fd7d9835f7eceefef0e4025a05690fb [0,1,1,0,0,0|2,0,0]=4 1074 B8R0.7 CCCNCCS(=O)C 8907fe98197a1b6e79d094b2d7a6d4a5 [0,1,1,0,0,0|1,0,0]=3 1075 B8R0.7 CCCNCCS(=O)O 9ce87a12381c4b5cfe3ec1783a75d72a [0,1,1,0,0,0|2,0,0]=4 1076 B8R0.7 CCCNCC[C@@H](C)O 96ed78371080616609e6a19f4bc6ef50 [0,1,1,0,0,0|0,0,2]=4 1077 B8R0.7 CCCNCC[C@H](C)O e223e4268330f6aea945d3b98613cfef [0,1,1,0,0,0|0,0,2]=4 1078 B8R0.7 CCCNCOC(=O)C 9a03e4459c640878e7dba532d4a06502 [0,1,1,0,0,0|1,0,0]=3 1079 B8R0.7 CCCNCSC(=O)N 21ecf184b2a8dc86141aa6b38ac15f2d [0,1,1,0,0,0|2,0,0]=4 1080 B8R0.7 CCCOC/C=C(/C)\Cl e5b94c0880532c7df7e87dea267bb3ef [0,1,1,0,0,0|1,0,1]=4 1081 B8R0.7 CCCOC/C=C(/C)\I 1101d7d371ceb7c7bf005fcd8d3d5521 [0,1,1,0,0,0|1,0,1]=4 1082 B8R0.7 CCCOC/C=C(\C)/Cl 3b21530ea6646e5380074ec64c6c9e4b [0,1,1,0,0,0|1,0,1]=4 1083 B8R0.7 CCCOCC=C(C)C b30e82a8d352d0695bc34774c65bba1f [0,1,1,0,0,0|1,0,1]=4 1084 B8R0.7 CCCOCC=C(C)Cl 4a4c390369b94edf3a434bd7810fee83 [0,1,1,0,0,0|1,0,1]=4 1085 B8R0.7 CCCOCC=C(C)I 1c329db9da6fd808a5be639e1c562867 [0,1,1,0,0,0|1,0,1]=4 1086 B8R0.7 CCCOCCC(=O)C 8597bbc8bbaf08f1a613a7aab0165313 [0,1,1,0,0,0|0,0,0]=2 1087 B8R0.7 CCCOCCC(=O)N c20536b6c03bcadb1169aacd62e340d9 [0,1,1,0,0,0|1,0,0]=3 1088 B8R0.7 CCCOCCC(=O)O 65883243788987d42449403fa915dd7d [0,1,1,0,0,0|1,0,0]=3 1089 B8R0.7 CCCOCCC(C)C 2eab4c15e86c20ee350695e4727673e2 [0,1,1,0,0,0|1,0,1]=4 1090 B8R0.7 CCCOCCN(C)C 79c8f5d530bd776f1befe5ca1224c45c [0,1,1,0,0,0|2,0,0]=4 1091 B8R0.7 CCCOCCS(=O)C 2c35684313aa0effe020f10a0837e485 [0,1,1,0,0,0|1,0,0]=3 1092 B8R0.7 CCCOCC[N+](=O)[O-] 11f99b66cb4f802bc9ea03fcd4d8e421 [0,1,1,0,0,0|2,0,0]=4 1093 B8R0.7 CCCOCNC(=O)C 6e99cd8c316495881ee605429ae8a169 [0,1,1,0,0,0|1,0,0]=3 1094 B8R0.7 CCCOCNC(=O)N 0c3353a650f6a23c649d3b49f74f0755 [0,1,1,0,0,0|2,0,0]=4 1095 B8R0.7 CCCOCOC(=O)C 0e004ff978c0c5c886108e25bd8d5e38 [0,1,1,0,0,0|1,0,0]=3 1096 B8R0.7 CCCOCSC(=O)N a8d0da169e47db6ff5658c749b630f62 [0,1,1,0,0,0|2,0,0]=4 1097 B8R0.7 CCNCCCC(=O)N d2cce21c7501504eb75a33266b0e5999 [0,1,1,0,0,0|1,0,0]=3 1098 B8R0.7 CCNCCCC(=O)O 9ad241b55443dd68da66ff4694ff3500 [0,1,1,0,0,0|1,0,0]=3 1099 B8R0.7 CCNCCCC(C)C 6e52cb7d352b50eb30e238c582f22475 [0,1,1,0,0,0|1,0,1]=4 1100 B8R0.7 CCNCCCN(C)C 90ee4ab5b9e6c4ea77050abf169d2a99 [0,1,1,0,0,0|2,0,0]=4 1101 B8R0.7 CCNCCCS(=O)C 391b9e72626e76cdd4e5a903c9b4bc67 [0,1,1,0,0,0|1,0,0]=3 1102 B8R0.7 CCNCCNC(=O)C 826d20b3d4f7b158aa9991d8c5f577d5 [0,1,1,0,0,0|1,0,0]=3 1103 B8R0.7 CCOCCCC(=O)C d3d73835b0002e0a803c11778e6c42f8 [0,1,1,0,0,0|0,0,0]=2 1104 B8R0.7 CCOCCCC(=O)N 32b0b6c66e42630050975d53410c1100 [0,1,1,0,0,0|1,0,0]=3 1105 B8R0.7 CCOCCCC(C)C e68811d021b73c585b1339be7097acd9 [0,1,1,0,0,0|1,0,1]=4 1106 B8R0.7 CCOCCCN(C)C aea7d760e9c8771a1ef45b93a8f9f7c3 [0,1,1,0,0,0|2,0,0]=4 1107 B8R0.7 CCOCCC[N+](=O)[O-] 71c6eb2b7e36ed7d09037020112f4423 [0,1,1,0,0,0|2,0,0]=4 1108 B8R0.7 CCOCCNC(=O)C 364422f97eb926237421a47e55dbdc32 [0,1,1,0,0,0|1,0,0]=3 1109 B8R0.7 CCOCCNC(=O)N 1d69caaced26be13153afb55af020221 [0,1,1,0,0,0|2,0,0]=4 1110 B8R0.7 CCOCCOC(=O)C 65c3fc557763a3804d7e247a1996cb75 [0,1,1,0,0,0|1,0,0]=3 1111 B8R0.7 CCOCNCC(=O)C 534404aa2bb4eb60a9a5f4f7d068a4cd [0,1,1,0,0,0|1,0,0]=3 1112 B8R0.7 CCOCNCC(=O)N 8c5834421c71bace2ac17791d8413420 [0,1,1,0,0,0|2,0,0]=4 1113 B8R0.7 CCOCNCC(=O)O 0cadae74986469dc80946ca8e9bb1b07 [0,1,1,0,0,0|2,0,0]=4 1114 B8R0.7 CCOCOCC(=O)C e044734fa15c25bee2b20056cca4f1a8 [0,1,1,0,0,0|1,0,0]=3 1115 B8R0.7 CCOCOCC(=O)N 4677b548e92ecffae954122455550d38 [0,1,1,0,0,0|2,0,0]=4 1116 B8R0.7 CCSCCNC(=O)C 8c3ea9957cae597313583e7951afded4 [0,1,1,0,0,0|1,0,0]=3 1117 B8R0.7 CN(C)CCCNC=O 5a07256aa2b2dc2ccccdfecfcf5dd80b [0,1,1,0,0,0|1,0,0]=3 1118 B8R0.7 CN(C)CCNCC=O 29f095735c40145ed9940de03c146b31 [0,1,1,0,0,0|1,0,0]=3 1119 B8R0.7 CN(C)CCOCC=O f2f32f3186f4b25325b639bd2505a675 [0,1,1,0,0,0|1,0,0]=3 1120 B8R0.7 CN(C)COCCC=O a90c5f93b3add179fffb905e406fd25f [0,1,1,0,0,0|1,0,0]=3 1121 B8R0.7 COCCCNC(=O)C 526fcf80a030c8c3912a63af41d08c51 [0,1,1,0,0,0|1,0,0]=3 1122 B8R0.7 COCCCNC(C)C c96e3047c8ced8f316486e1c2cd3b324 [0,1,1,0,0,0|2,0,0]=4 1123 B8R0.7 COCCCOC(C)C 5684bb8a7ac01785c80283a1f20a9ef4 [0,1,1,0,0,0|2,0,0]=4 1124 B8R0.7 COCCNCC(=O)C 961ddbf961717199cb7ccbe5fdba9647 [0,1,1,0,0,0|1,0,0]=3 1125 B8R0.7 COCCNCC(=O)N 137fcc310030132af81430a136880512 [0,1,1,0,0,0|2,0,0]=4 1126 B8R0.7 COCCNCC(=O)O 5ce813bb3dda5e9060aa6f61548b6a1a [0,1,1,0,0,0|2,0,0]=4 1127 B8R0.7 COCCNCC(C)C 0f93e00b6918ab89e337016dce5ddb5a [0,1,1,0,0,0|2,0,0]=4 1128 B8R0.7 COCCOCC(=O)C c43dd4e6beb50da293ecb7edbd68b366 [0,1,1,0,0,0|1,0,0]=3 1129 B8R0.7 COCCOCC(=O)N 52e3a5cb41b7881a4ace23e25a8bc04a [0,1,1,0,0,0|2,0,0]=4 1130 B8R0.7 COCCOCC(=O)O 003ae303058ace8e592ced58cf4e05e5 [0,1,1,0,0,0|2,0,0]=4 1131 B8R0.7 COCCOCC(C)C d0e5035e5ad75d7667af2fe282c6f0ba [0,1,1,0,0,0|2,0,0]=4 1132 B8R0.7 COCNCCC(=O)N 75a34d6a21e65f0fa9c3ab03a203332a [0,1,1,0,0,0|2,0,0]=4 1133 B8R0.7 COCNCCC(=O)O 6cfc61f9f7468a99c69b381c4067bdfb [0,1,1,0,0,0|2,0,0]=4 1134 B8R0.7 COCNCCC(C)C d504197e2de2477c0ef95d33ccdc019c [0,1,1,0,0,0|2,0,0]=4 1135 B8R0.7 COCNCCS(=O)C c1b03b36250a7d65845034eba40ff581 [0,1,1,0,0,0|2,0,0]=4 1136 B8R0.7 COCOCCC(=O)C 85ebfe45bbace861b367f83c75d33358 [0,1,1,0,0,0|1,0,0]=3 1137 B8R0.7 COCOCCC(=O)N dacd263a3e35c03bcd8f525b496ade95 [0,1,1,0,0,0|2,0,0]=4 1138 B8R0.7 COCOCCC(=O)O 1302d1ad564a958c9ef097b350c13897 [0,1,1,0,0,0|2,0,0]=4 1139 B8R0.7 COCOCCC(C)C bcaaca22e174aa65ea31c88fa163f2b9 [0,1,1,0,0,0|2,0,0]=4 1140 B8R0.7 COCOCCS(=O)C 5c514c40760f28852b9a3cba0a2dcded [0,1,1,0,0,0|2,0,0]=4 1141 B8R0.7 COCOCNC(=O)C 312d16668782054e8a09863d487deec3 [0,1,1,0,0,0|2,0,0]=4 1142 B8R0.7 COCOCOC(=O)C 54249d0e78c186a79ad9be3cc51e7aac [0,1,1,0,0,0|2,0,0]=4 1143 B8R0.7 CS(=O)CCCNC=O ac978e4dec6c59820deb2d60499ba3b0 [0,1,1,0,0,0|2,0,0]=4 1144 B8R0.7 CS(=O)CCCNCF 1782bd36c07605f68f0fc42848ad0ff8 [0,1,1,0,0,0|2,0,0]=4 1145 B8R0.7 CS(=O)CCCNCO 61e6364bb166cbf2cabd3dc6ad6ca626 [0,1,1,0,0,0|2,0,0]=4 1146 B8R0.7 CS(=O)CCNCC=O 8c3be09abac30b1ba1881382c982061c [0,1,1,0,0,0|2,0,0]=4 1147 B8R0.7 CS(=O)CCNCCBr 65a2b15dd6aa44ab4cdd342d230b704b [0,1,1,0,0,0|2,0,0]=4 1148 B8R0.7 CS(=O)CCNCCF cbee396aafd868112d9d9f046e829220 [0,1,1,0,0,0|2,0,0]=4 1149 B8R0.7 CS(=O)CCNCCI 629ce25a6db322c2ba9dda0f6a58fe44 [0,1,1,0,0,0|2,0,0]=4 1150 B8R0.7 CS(=O)CCNCCO 93f7733e139b010e12660cb8139e909a [0,1,1,0,0,0|2,0,0]=4 1151 B8R0.7 CS(=O)CCNCCS 49818c7057088eae67f281721402a222 [0,1,1,0,0,0|2,0,0]=4 1152 B8R0.7 CS(=O)CCOCC=O 29eecdac67755e86d2be2b2f45a9b6a4 [0,1,1,0,0,0|2,0,0]=4 1153 B8R0.7 CS(=O)CCOCCF fdaadfc676436847a62c0e42bb0f6865 [0,1,1,0,0,0|2,0,0]=4 1154 B8R0.7 CS(=O)CCOCCS 189076507e3322af2f6154476fa0f988 [0,1,1,0,0,0|2,0,0]=4 1155 B8R0.7 CSCCCNC(=O)C f4b4c7d4d652abb45039c5639b312853 [0,1,1,0,0,0|1,0,0]=3 1156 B8R0.7 CSCCCNC(C)C 6b279fd0ea31fe5ab25c2d7757b17983 [0,1,1,0,0,0|2,0,0]=4 1157 B8R0.7 CSCCCOC(C)C f53d2336fb0f520dbcdbe91d0f6f8fb0 [0,1,1,0,0,0|2,0,0]=4 1158 B8R0.7 CSCCNCC(=O)C 8b0311856afbb6796c6aad3a263d628d [0,1,1,0,0,0|1,0,0]=3 1159 B8R0.7 CSCCNCC(=O)N 4e8fca086c3faa7db23a74b3dfff0f2f [0,1,1,0,0,0|2,0,0]=4 1160 B8R0.7 CSCCNCC(=O)O f1b95c9de1a925845087f31bd4bae7df [0,1,1,0,0,0|2,0,0]=4 1161 B8R0.7 CSCCNCC(C)C 16d1e3af66ad99f6b4393c7a907a603c [0,1,1,0,0,0|2,0,0]=4 1162 B8R0.7 CSCCOCC(=O)C fd4e693f71d7966351ba22f8108e19ff [0,1,1,0,0,0|1,0,0]=3 1163 B8R0.7 CSCCOCC(=O)N c731f0739b7e1ef13acc36f6574a92da [0,1,1,0,0,0|2,0,0]=4 1164 B8R0.7 CSCCOCC(=O)O db65161c67ff612db3780dea90f2a2f8 [0,1,1,0,0,0|2,0,0]=4 1165 B8R0.7 CSCCOCC(C)C 0d7a1f3f7a05c508cd670d9e86716796 [0,1,1,0,0,0|2,0,0]=4 1166 B8R0.7 CSCNCCC(=O)N 2c9d140685046003cf9f9ad555d9359d [0,1,1,0,0,0|2,0,0]=4 1167 B8R0.7 CSCNCCC(=O)O 098fcb068b20e260bdec4c343b4671e9 [0,1,1,0,0,0|2,0,0]=4 1168 B8R0.7 CSCNCCC(C)C 1214140341214495e484e265d71b8d27 [0,1,1,0,0,0|2,0,0]=4 1169 B8R0.7 CSCNCCS(=O)C 584a2850b756fa8cc87b9ef394dad8f0 [0,1,1,0,0,0|2,0,0]=4 1170 B8R0.7 CSCOCCC(=O)C b844a3f3dbea733d811f327fadd49286 [0,1,1,0,0,0|1,0,0]=3 1171 B8R0.7 CSCOCCC(=O)N 80656c5e91a3a0e1eab18691c1ff654d [0,1,1,0,0,0|2,0,0]=4 1172 B8R0.7 CSCOCCC(=O)O 729e28748e361be58000ab33275c6b91 [0,1,1,0,0,0|2,0,0]=4 1173 B8R0.7 CSCOCCC(C)C de4759993ae77e6152e45a8e6c1a8f14 [0,1,1,0,0,0|2,0,0]=4 1174 B8R0.7 CSCOCCS(=O)C 36c06b13169a7a72e8a51ac6beeed9ff [0,1,1,0,0,0|2,0,0]=4 1175 B8R0.7 CSCOCNC(=O)C 30bfc52f57e4ed91a642bf8853a3d4bb [0,1,1,0,0,0|2,0,0]=4 1176 B8R0.7 C[C@@H](F)COCCC=O b2bd9789cc544f1c8e31a32db2a661d9 [0,1,1,0,0,0|1,0,0]=3 1177 B8R0.7 C[C@@H](O)CCNCC=O a9020fd357d1f95ddbb3ee9465870652 [0,1,1,0,0,0|1,0,0]=3 1178 B8R0.7 C[C@@H](O)CNCCC=O 7d91813785f65cc63c3d9cbb3ff309cf [0,1,1,0,0,0|1,0,0]=3 1179 B8R0.7 C[C@H](F)COCCC=O c2ecfe080abe2207069b2c51ff72d431 [0,1,1,0,0,0|1,0,0]=3 1180 B8R0.7 C[C@H](O)CCNCC=O bedbd11e9379692d602aa1c619cc418f [0,1,1,0,0,0|1,0,0]=3 1181 B8R0.7 C[C@H](O)CNCCC=O 450069e6f027c46eb6d29b2b31e57c5c [0,1,1,0,0,0|1,0,0]=3 1182 B8R0.7 NC(=O)CCCNCF 69e545c202cd7c9a6342c69c6e6a5f59 [0,1,1,0,0,0|2,0,0]=4 1183 B8R0.7 NC(=O)CCCNCO f70a60c235672d89293f900a8d9cefa7 [0,1,1,0,0,0|2,0,0]=4 1184 B8R0.7 NC(=O)CCCOCF 15f9a4387dce16382a2e493f0dda5b13 [0,1,1,0,0,0|2,0,0]=4 1185 B8R0.7 NC(=O)CCNCCBr ef24ce00bd552b4c7b9798b47e83c534 [0,1,1,0,0,0|2,0,0]=4 1186 B8R0.7 NC(=O)CCNCCF 6b59759188d6118acfcc7c61e6ea8d88 [0,1,1,0,0,0|2,0,0]=4 1187 B8R0.7 NC(=O)CCNCCI 3bfe0d669e39520f94e74660ecea4a46 [0,1,1,0,0,0|2,0,0]=4 1188 B8R0.7 NC(=O)CCNCCO ea9a91e023644befadbf5d244e261bb0 [0,1,1,0,0,0|2,0,0]=4 1189 B8R0.7 NC(=O)CCNCCS c12ed7aa66bfc39da304ecb7c8d6cdd6 [0,1,1,0,0,0|2,0,0]=4 1190 B8R0.7 NC(=O)CCOCCF 21f605ef26e643b6ae8cba650c7f6b82 [0,1,1,0,0,0|2,0,0]=4 1191 B8R0.7 NC(=O)CCOCCS 2a5607f5a17aca280aa8d0bbb5f8e88b [0,1,1,0,0,0|2,0,0]=4 1192 B8R0.7 NC(=O)CNCCCCl 1db53d8b6e8ec0b45f5ac5aea65a66af [0,1,1,0,0,0|2,0,0]=4 1193 B8R0.7 NC(=O)CNCCCF b8df96f83ebeea4472e3f0cf574d5c10 [0,1,1,0,0,0|2,0,0]=4 1194 B8R0.7 NC(=O)CNCCCO f7f428c6be3a0f96cc03fd2549aaf101 [0,1,1,0,0,0|2,0,0]=4 1195 B8R0.7 NC(=O)CNCCCS 0cd1ecba18cd09d4875eb7edc039e565 [0,1,1,0,0,0|2,0,0]=4 1196 B8R0.7 NC(=O)COCCCF 4c181403b43bd0150828aba20f5caec7 [0,1,1,0,0,0|2,0,0]=4 1197 B8R0.7 NC(=O)COCCCS 4ccafd8c8a1e89284daea9397b358185 [0,1,1,0,0,0|2,0,0]=4 1198 B8R0.7 O=C(O)CCCNCF 670cea18bd6ba2b81ceecb2577e1a7ab [0,1,1,0,0,0|2,0,0]=4 1199 B8R0.7 O=C(O)CCCNCO 6267c5eeb1933064d917e4e814ad9722 [0,1,1,0,0,0|2,0,0]=4 1200 B8R0.7 O=C(O)CCNCCBr 29cc353153febf3a8c067ebc7d4659a9 [0,1,1,0,0,0|2,0,0]=4 1201 B8R0.7 O=C(O)CCNCCF cb03b3b8d9be6ed00316ec8fa58ea22d [0,1,1,0,0,0|2,0,0]=4 1202 B8R0.7 O=C(O)CCNCCI 1fb0bb507aa993f2a3522c41edc93100 [0,1,1,0,0,0|2,0,0]=4 1203 B8R0.7 O=C(O)CCNCCO 7fda1e67c117139da08349807b03ae85 [0,1,1,0,0,0|2,0,0]=4 1204 B8R0.7 O=C(O)CCNCCS e7b12ac116347e188c56484ce05a8410 [0,1,1,0,0,0|2,0,0]=4 1205 B8R0.7 O=C(O)CCOCCF fcf96ee60132be28c36745264cbf0317 [0,1,1,0,0,0|2,0,0]=4 1206 B8R0.7 O=C(O)CCOCCS 61b8e7b02af12e03f8a3747e8eb16780 [0,1,1,0,0,0|2,0,0]=4 1207 B8R0.7 O=C(O)CNCCCCl 6975978044558bce000c0ca780485b76 [0,1,1,0,0,0|2,0,0]=4 1208 B8R0.7 O=C(O)CNCCCF 69db0caef1002e94499cf44277421fb3 [0,1,1,0,0,0|2,0,0]=4 1209 B8R0.7 O=C(O)CNCCCO 15bb30af3bbf0b9503efbda60ef38d51 [0,1,1,0,0,0|2,0,0]=4 1210 B8R0.7 O=C(O)CNCCCS 69374183d65b27382aaeea8dfc3bb03c [0,1,1,0,0,0|2,0,0]=4 1211 B8R0.7 O=C(O)COCCCF da2984b4de14bdafc90cabbb14713902 [0,1,1,0,0,0|2,0,0]=4 1212 B8R0.7 O=C(O)COCCCS b637a7d4aac2c64b554918898eb44811 [0,1,1,0,0,0|2,0,0]=4 1213 B8R0.7 O=CCCNCC(F)F 00aa3292125883dcbd5abfb2aba15616 [0,1,1,0,0,0|2,0,0]=4 1214 B8R0.7 O=CCCOCC(F)F 3e9e6e81048071f99b0010d81f0f3255 [0,1,1,0,0,0|2,0,0]=4 1215 B8R0.7 O=CCNCCC(F)F 9d1172aa9d99b0c7e63054f3e9b872fa [0,1,1,0,0,0|2,0,0]=4 1216 B8R0.7 O=CCOCCC(F)F f9017dd3628f25b685f6611fcf21a34d [0,1,1,0,0,0|2,0,0]=4 1217 B8R0.8 C=CCCN(C)C(C)C be0919bf7338ac44844869a6227e18ce [0,1,1,0,0,0|2,0,0]=4 1218 B8R0.8 C=CCNC(C)C(C)C aa6dca52f8f7036289360e5e3602fa9f [0,1,1,0,0,0|2,0,0]=4 1219 B8R0.8 C=CCN[C@@H](C)C(C)C 5b1a97f01f322fc50ca513c9b9d7d1df [0,1,1,0,0,0|2,0,0]=4 1220 B8R0.8 C=CCN[C@H](C)C(C)C a756fd8bb791b035f4648efddcd7fe78 [0,1,1,0,0,0|2,0,0]=4 1221 B8R0.8 C=CCOC(C)C(C)C df599d8f0a3e3227a2f32e12d329969e [0,1,1,0,0,0|2,0,0]=4 1222 B8R0.8 C=CCO[C@@H](C)C(C)C 7dd431dc0ac33224bf589664a60f33d6 [0,1,1,0,0,0|2,0,0]=4 1223 B8R0.8 C=CCO[C@H](C)C(C)C 92f8c5c268803a32ca406f92c9c094af [0,1,1,0,0,0|2,0,0]=4 1224 B8R0.8 CC(=O)C(C)COCF c45f8ad47bb47acfc61ca43baa4a6417 [0,1,1,0,0,0|2,0,0]=4 1225 B8R0.8 CC(=O)C(C)NCCBr 3210bd9423ad5a5155327281550f5f25 [0,1,1,0,0,0|2,0,0]=4 1226 B8R0.8 CC(=O)C(C)NCCF ddfa9965dd9a8b7bc370014a7270bc24 [0,1,1,0,0,0|2,0,0]=4 1227 B8R0.8 CC(=O)C(C)NCCI a2fabb97dc000dda6bc097c4a9247332 [0,1,1,0,0,0|2,0,0]=4 1228 B8R0.8 CC(=O)C(C)NCCO 2aeb3f0703a454ddc9d76e39bdb7fb76 [0,1,1,0,0,0|2,0,0]=4 1229 B8R0.8 CC(=O)C(C)NCCS ec2fcb162cf9fe04c53dc8de339e343c [0,1,1,0,0,0|2,0,0]=4 1230 B8R0.8 CC(=O)C(C)OCCF 2400feff3997df18334864838c96453f [0,1,1,0,0,0|2,0,0]=4 1231 B8R0.8 CC(=O)C(C)OCCS 8423f1e18d91a46ab22e3647b29e1625 [0,1,1,0,0,0|2,0,0]=4 1232 B8R0.8 CC(=O)N(C)CCCO f1b608083519b3981f39547632d628d0 [0,1,1,0,0,0|2,0,0]=4 1233 B8R0.8 CC(C)C(C)NCC=O 7480596882376427695ab906c9a7bfb0 [0,1,1,0,0,0|1,0,0]=3 1234 B8R0.8 CC(C)C(C)OCC=O ce23aaf71e4025cbdc74369cbf39ec61 [0,1,1,0,0,0|1,0,0]=3 1235 B8R0.8 CC(C)C(O)CNC=O 60e39351432db3e8d29156b9b9cbfea4 [0,1,1,0,0,0|1,0,0]=3 1236 B8R0.8 CC(C)N(C)CCC=O 35a1a35e01b1c9ac6c32f45a18f937cb [0,1,1,0,0,0|1,0,0]=3 1237 B8R0.8 CC(C)[C@@H](C)NCC=O fe4cca6e9187eefae56d7c7e9b333cad [0,1,1,0,0,0|1,0,0]=3 1238 B8R0.8 CC(C)[C@@H](C)OCC=O 8cb7fc9ac2c6caf3bd0148655550849f [0,1,1,0,0,0|1,0,0]=3 1239 B8R0.8 CC(C)[C@H](C)NCC=O b91fe17b3c92a1482d1cf7254f00a408 [0,1,1,0,0,0|1,0,0]=3 1240 B8R0.8 CC(C)[C@H](C)OCC=O 42c325ee3d5f7ae3be802a85dcd7d5a5 [0,1,1,0,0,0|1,0,0]=3 1241 B8R0.8 CC(CNC=O)N(C)C cf5b00de5b0d05aaa1417f75408e48c9 [0,1,1,0,0,0|2,0,0]=4 1242 B8R0.8 CC(O)C(C)NCC=O e305fe128f0a78b8ad0315156373b87a [0,1,1,0,0,0|2,0,0]=4 1243 B8R0.8 CC(S)C(C)OCC=O be24c910a021f9f13deb5a032f14acad [0,1,1,0,0,0|2,0,0]=4 1244 B8R0.8 CCCCN(C)C(=O)C 88d1b3a05bc92700007f7660d5b84e56 [0,1,1,0,0,0|1,0,0]=3 1245 B8R0.8 CCCNC(=O)C(=O)C 6616f52ba2db0bc51edea61ef0a86e36 [0,1,1,0,0,0|1,0,1]=4 1246 B8R0.8 CCCNC(C)C(=O)C 6c20f55484fcd603f7867a7e61cb3d7e [0,1,1,0,0,0|1,0,0]=3 1247 B8R0.8 CCCNC(C)C(=O)N b2fc625c38ab8c709841d5c7372d4adf [0,1,1,0,0,0|2,0,0]=4 1248 B8R0.8 CCCNC(C)C(=O)O 0bb3e38e8c1f88931a7fe4405f55b48f [0,1,1,0,0,0|2,0,0]=4 1249 B8R0.8 CCCNC(F)C(=O)N 887433dddf04b7504891cb2e153136a8 [0,1,1,0,0,0|2,0,0]=4 1250 B8R0.8 CCCNC(O)C(=O)O cc97d4d167b9765bc7e9641f2f876d2e [0,1,1,0,0,0|2,0,0]=4 1251 B8R0.8 CCCN[C@@H](C)C(=O)N 02dd18b86b56ba975cc40a36af64e278 [0,1,1,0,0,0|2,0,0]=4 1252 B8R0.8 CCCN[C@@H](C)C(=O)O ef0370d06100564dc30ac92abf332f2f [0,1,1,0,0,0|2,0,0]=4 1253 B8R0.8 CCCN[C@H](C)C(=O)N 99c67abc53ca408bd7a07e11216e0931 [0,1,1,0,0,0|2,0,0]=4 1254 B8R0.8 CCCN[C@H](C)C(=O)O a8f2478751dbbc6b16132b4c2221ee6f [0,1,1,0,0,0|2,0,0]=4 1255 B8R0.8 CCCOC(C)C(=O)C f2ac291285b506c3aa995ed18a49b95f [0,1,1,0,0,0|1,0,0]=3 1256 B8R0.8 CCCOC(C)C(=O)N 960017c2975c35a65e9a919d09986bae [0,1,1,0,0,0|2,0,0]=4 1257 B8R0.8 CCCOC(C)C(=O)O 1322f7b5e7c49e969524d97c6c86e731 [0,1,1,0,0,0|2,0,0]=4 1258 B8R0.8 CCCOC(F)C(=O)N e307f7bcd27dd26468887c129da73e20 [0,1,1,0,0,0|2,0,0]=4 1259 B8R0.8 CCCO[C@@H](C)C(=O)N b8c1d5a3f29f788c88f92112d4a6c2ab [0,1,1,0,0,0|2,0,0]=4 1260 B8R0.8 CCCO[C@@H](C)C(=O)O 6d34f6dc5dea70a72e909784584aa3d0 [0,1,1,0,0,0|2,0,0]=4 1261 B8R0.8 CCCO[C@H](C)C(=O)N ca342d08f32f80afdbcc627d7b3ff5e4 [0,1,1,0,0,0|2,0,0]=4 1262 B8R0.8 CCCO[C@H](C)C(=O)O c80966cb853c5464154df7c1b20e2fad [0,1,1,0,0,0|2,0,0]=4 1263 B8R0.8 CCNCC(C)C(=O)O f1d53d3e850c3e5f7eacfd1722a00821 [0,1,1,0,0,0|2,0,0]=4 1264 B8R0.8 CCNCC(F)C(=O)O 3b295cc4c966015ef89d181bb2cf0fd1 [0,1,1,0,0,0|2,0,0]=4 1265 B8R0.8 CCNCC(O)C(=O)O 199a2ff9ee4d2808377aac2de3a1300d [0,1,1,0,0,0|2,0,0]=4 1266 B8R0.8 CCNC[C@@H](C)C(=O)O c248e05b45d9e657c31f93c9072982c9 [0,1,1,0,0,0|2,0,0]=4 1267 B8R0.8 CCNC[C@@H](O)C(=O)O 0b3a1c0d41c6b74588ef5eb637fd0fb0 [0,1,1,0,0,0|2,0,0]=4 1268 B8R0.8 CCNC[C@H](C)C(=O)O 0c2e6d5b0da6964440e6e3ec89c9de07 [0,1,1,0,0,0|2,0,0]=4 1269 B8R0.8 CCNC[C@H](O)C(=O)O 8f48edbc7af4278b5a62e9966729660b [0,1,1,0,0,0|2,0,0]=4 1270 B8R0.8 CCOCC(C)C(=O)C 7ed02ca7a024702f528cad10b88a8859 [0,1,1,0,0,0|1,0,0]=3 1271 B8R0.8 CCOCC(C)C(=O)O c058fb39790cebd08b409e3f0067a53c [0,1,1,0,0,0|2,0,0]=4 1272 B8R0.8 CCOC[C@@H](C)C(=O)O caa5ba1722b2330e21dcd6c456bf8574 [0,1,1,0,0,0|2,0,0]=4 1273 B8R0.8 CCOC[C@H](C)C(=O)O 3f7f39bbd0ce3dcf45d784eca89b738a [0,1,1,0,0,0|2,0,0]=4 1274 B8R0.8 COCCN(C)C(=O)C 1c56ee19503977f51009b726340315a1 [0,1,1,0,0,0|2,0,0]=4 1275 B8R0.8 COCOC(C)C(=O)C 9af88437e924837e1175779254d8725f [0,1,1,0,0,0|2,0,0]=4 1276 B8R0.8 CSCCN(C)C(=O)C f3dc0247d8f8741adf15cb67ead23b7f [0,1,1,0,0,0|2,0,0]=4 1277 B8R0.8 CSCOC(C)C(=O)C c95aac72a50d87c47012f14e7a8068b2 [0,1,1,0,0,0|2,0,0]=4 1278 B8R0.9 C=C(C)CCN(C)CC 975bc598c990d4455049b666e0eec143 [0,1,1,0,0,0|2,0,0]=4 1279 B8R0.9 C=C(C)CNC(C)CC 256f62cec490bafed043741999c25df4 [0,1,1,0,0,0|2,0,0]=4 1280 B8R0.9 C=C(C)CN[C@@H](C)CC d26c3d64a9f189169a5866d4e2b497b9 [0,1,1,0,0,0|2,0,0]=4 1281 B8R0.9 C=C(C)CN[C@H](C)CC 63a0b508416fa3ab231e5f743622aa6e [0,1,1,0,0,0|2,0,0]=4 1282 B8R0.9 C=C(C)COC(C)CC 4482bd721211f848f89897698cdef93d [0,1,1,0,0,0|2,0,0]=4 1283 B8R0.9 C=C(C)CO[C@@H](C)CC 1f8fa1d6bc957d679b02c8c39dd68048 [0,1,1,0,0,0|2,0,0]=4 1284 B8R0.9 C=C(C)CO[C@H](C)CC 4903f87f8690f044163b36d5c736143f [0,1,1,0,0,0|2,0,0]=4 1285 B8R0.9 C=C(C=O)OCC(C)C c5cdf695798fe36105735778dae3c7a0 [0,1,1,0,0,0|1,0,1]=4 1286 B8R0.9 C=CC(C)COC(C)C 19cf5fe9d616c2621a235c9cc79e808d [0,1,1,0,0,0|2,0,0]=4 1287 B8R0.9 C=CC(C)NCC(C)C 7a35880eed0ef215a0c00470a636579c [0,1,1,0,0,0|2,0,0]=4 1288 B8R0.9 C=CC(C)OCC(C)C 71af5c71e84583a0ab5121668b3ae2e9 [0,1,1,0,0,0|2,0,0]=4 1289 B8R0.9 C=CC(O)CNC(C)C 254002c1439ccf47813784fa50338918 [0,1,1,0,0,0|2,0,0]=4 1290 B8R0.9 C=C[C@H](C)OCC(C)C 275b6c20fe3580ee4a4871d9838c8c79 [0,1,1,0,0,0|2,0,0]=4 1291 B8R0.9 CC(=O)CNC(C)CO 7f456ce2665c50a288606a55fcadb654 [0,1,1,0,0,0|2,0,0]=4 1292 B8R0.9 CC(=O)CN[C@@H](C)CO 3490504cc82c16f891707783a3f5d03b [0,1,1,0,0,0|2,0,0]=4 1293 B8R0.9 CC(=O)CN[C@H](C)CO b856683376ccfcef5ca680b8cb827c55 [0,1,1,0,0,0|2,0,0]=4 1294 B8R0.9 CC(=O)NCC(Br)CBr 026233203db163de359d5c31f32507c5 [0,1,1,0,0,0|2,0,0]=4 1295 B8R0.9 CC(=O)NCC(C)CO 5107eece73873b4763584dc1449ad61c [0,1,1,0,0,0|2,0,0]=4 1296 B8R0.9 CC(=O)NCC(F)CO b8843bcee854bfdd401231e90b011422 [0,1,1,0,0,0|2,0,0]=4 1297 B8R0.9 CC(=O)NCC(O)CO a7a306466b1599337a98d4a78b5d781e [0,1,1,0,0,0|2,0,0]=4 1298 B8R0.9 CC(=O)NC[C@@H](F)CO 964c0a882da1253a8b823c85e90b43d9 [0,1,1,0,0,0|2,0,0]=4 1299 B8R0.9 CC(=O)NC[C@@H](O)CO a8483dbc09c1c7f138b3ed243987530b [0,1,1,0,0,0|2,0,0]=4 1300 B8R0.9 CC(=O)NC[C@H](C)CO 5409bde0c2b60b9f7b568586e701b259 [0,1,1,0,0,0|2,0,0]=4 1301 B8R0.9 CC(=O)NC[C@H](F)CO 938a8d1e230afccbf699e7334f08d345 [0,1,1,0,0,0|2,0,0]=4 1302 B8R0.9 CC(=O)NC[C@H](O)CO 4c725599a6cf504375db5135be307edf [0,1,1,0,0,0|2,0,0]=4 1303 B8R0.9 CC(C)CCN(C)C=O 516a2a022cb88171d447755eeb173861 [0,1,1,0,0,0|1,0,0]=3 1304 B8R0.9 CC(C)CNC(=O)C=O b40cc57029845c8997b7aa8efc245b60 [0,1,1,0,0,0|1,0,1]=4 1305 B8R0.9 CC(C)CNC(C)C=O 03449348422393b4e0bdd254036a8d58 [0,1,1,0,0,0|1,0,0]=3 1306 B8R0.9 CC(C)CN[C@H](C)C=O 7c782c131d4d366690f182c8ead9a413 [0,1,1,0,0,0|1,0,0]=3 1307 B8R0.9 CC(C)COC(C)C=O 0b8c6cf115c2322fa1674f79e1d3c4dd [0,1,1,0,0,0|1,0,0]=3 1308 B8R0.9 CC(C)CO[C@H](C)C=O 5c45a366049badd5e36b154ae522c338 [0,1,1,0,0,0|1,0,0]=3 1309 B8R0.9 CC(C=O)NC[C@@H](C)O d6dc2629bd4430c3bd67a8f081c11379 [0,1,1,0,0,0|2,0,0]=4 1310 B8R0.9 CC(C=O)NC[C@H](C)O 7869ad4f3cbe7e38dea9b0d6c90c6141 [0,1,1,0,0,0|2,0,0]=4 1311 B8R0.9 CC(C=O)OCN(C)C 4dc03f8644dc120ddbe18940ad718344 [0,1,1,0,0,0|2,0,0]=4 1312 B8R0.9 CC(C=O)OC[C@@H](C)F 44348d98ecea104d30821f34423bd4e0 [0,1,1,0,0,0|2,0,0]=4 1313 B8R0.9 CC(C=O)OC[C@H](C)F 9637178c90bdbe6a1061955c6d3c749b [0,1,1,0,0,0|2,0,0]=4 1314 B8R0.9 CC(F)COC(C)C=O a88f9eb602b828f938892defccbfe947 [0,1,1,0,0,0|2,0,0]=4 1315 B8R0.9 CC(F)CO[C@H](C)C=O ab2b879912e041805a15c42eb98ff36e [0,1,1,0,0,0|2,0,0]=4 1316 B8R0.9 CC(O)CCN(C)C=O 32af2d18851b8de7c2fbf9dc298410b8 [0,1,1,0,0,0|2,0,0]=4 1317 B8R0.9 CC(O)CNC(C)C=O 383ad87f47185da30b4a1f76d3fc6516 [0,1,1,0,0,0|2,0,0]=4 1318 B8R0.9 CC(O)CN[C@H](C)C=O 8a0a71f4d2dc211ad7713289d588e2ee [0,1,1,0,0,0|2,0,0]=4 1319 B8R0.9 CC(S)COC(C)C=O 3be1d5c17e9ab7f7a6674fa02b1f8eb9 [0,1,1,0,0,0|2,0,0]=4 1320 B8R0.9 CC(S)CO[C@H](C)C=O 6171e06cfb5a5db48bbba1b7f4375842 [0,1,1,0,0,0|2,0,0]=4 1321 B8R0.9 CCC(=O)NCC(=O)C 5911502c3a8395822fc4c0959647e135 [0,1,1,0,0,0|1,0,1]=4 1322 B8R0.9 CCC(C)CNC(=O)C aa3f1455f544ac3656d43724f45ee4b6 [0,1,1,0,0,0|1,0,0]=3 1323 B8R0.9 CCC(C)NCC(=O)C 6436401da3e43365ad6648f7d16996be [0,1,1,0,0,0|1,0,0]=3 1324 B8R0.9 CCC(C)NCC(=O)N 000867cd72bf7abf807440f1d3bec59b [0,1,1,0,0,0|2,0,0]=4 1325 B8R0.9 CCC(C)NCC(=O)O f2952a77ab3e8bd898813643bd6d2028 [0,1,1,0,0,0|2,0,0]=4 1326 B8R0.9 CCC(C)OCC(=O)C 51585707b16cf92a5a0e33fe644c9725 [0,1,1,0,0,0|1,0,0]=3 1327 B8R0.9 CCC(C)OCC(=O)N 1b913184d403fb69b64ed9e9c743a425 [0,1,1,0,0,0|2,0,0]=4 1328 B8R0.9 CCC(C)OCC(=O)O ba461bfe27072cdbfb8d74924722a4e4 [0,1,1,0,0,0|2,0,0]=4 1329 B8R0.9 CCC(O)CNC(=O)C 303ca77168267846269f8e2248e6c650 [0,1,1,0,0,0|1,0,0]=3 1330 B8R0.9 CCN(C)CCC(=O)C 704b8017c1fe42d466a2c16771fe60b9 [0,1,1,0,0,0|1,0,0]=3 1331 B8R0.9 CCN(C)CCC(=O)N 8598f908b554962aaf272d88582a793e [0,1,1,0,0,0|2,0,0]=4 1332 B8R0.9 CCN(C)CCC(=O)O 2d55640deefd272dbf27378182c87c56 [0,1,1,0,0,0|2,0,0]=4 1333 B8R0.9 CCN(C)CCS(=O)C 181957332795259e7c2d453ef9f3db35 [0,1,1,0,0,0|2,0,0]=4 1334 B8R0.9 CCN(C)COC(=O)C 662418b9fd851b02bfa0c21ae20e504d [0,1,1,0,0,0|2,0,0]=4 1335 B8R0.9 CC[C@@H](C)NCC(=O)N 00c2922a9a0e085fef41a6936ba22077 [0,1,1,0,0,0|2,0,0]=4 1336 B8R0.9 CC[C@@H](C)NCC(=O)O 5c12fd5b6d0cdca7f2b2238c17851dd2 [0,1,1,0,0,0|2,0,0]=4 1337 B8R0.9 CC[C@@H](C)OCC(=O)N 177a1fefad08e7123933fff20860c103 [0,1,1,0,0,0|2,0,0]=4 1338 B8R0.9 CC[C@@H](C)OCC(=O)O fcbe44d01b8fa575a40781f8929bf942 [0,1,1,0,0,0|2,0,0]=4 1339 B8R0.9 CC[C@@H](O)CNC(=O)C 214f1ff21aca62cdd2be0dae45336745 [0,1,1,0,0,0|1,0,0]=3 1340 B8R0.9 CC[C@H](C)CNC(=O)C 7308e3222c110d542936eb43984d990d [0,1,1,0,0,0|1,0,0]=3 1341 B8R0.9 CC[C@H](C)NCC(=O)N f4cbd027635400a1bd56158094969969 [0,1,1,0,0,0|2,0,0]=4 1342 B8R0.9 CC[C@H](C)NCC(=O)O d0392c98c4a58fa7920a948e7c8055d4 [0,1,1,0,0,0|2,0,0]=4 1343 B8R0.9 CC[C@H](C)OCC(=O)N a50cd0f8b1faba93c04bb41f0f47043f [0,1,1,0,0,0|2,0,0]=4 1344 B8R0.9 CC[C@H](C)OCC(=O)O 8b17e83f890f84f235b698dd6e78f10d [0,1,1,0,0,0|2,0,0]=4 1345 B8R0.9 CN(C)CCN(C)C=O b34edb31e570d3653e5ff795502442ff [0,1,1,0,0,0|2,0,0]=4 1346 B8R0.9 CO[C@@H](C)CNC(=O)C 0cf2684fa855f95ea59e4d00d3adab12 [0,1,1,0,0,0|2,0,0]=4 1347 B8R0.9 CO[C@H](C)CNC(=O)C 8d64b64f82d28ad11a8f0edbe07358fd [0,1,1,0,0,0|2,0,0]=4 1348 B8R0.9 C[C@H](C=O)NC[C@@H](C)O e7c9c037399ac257f04fd04c210bf172 [0,1,1,0,0,0|2,0,0]=4 1349 B8R0.9 C[C@H](C=O)OC[C@@H](C)F 1f5893c2e9eac3fefa5fe404e93fe70a [0,1,1,0,0,0|2,0,0]=4 1350 B8R0.9 C[C@H](F)CO[C@H](C)C=O 02995616d1e99566d5726c66b80d922d [0,1,1,0,0,0|2,0,0]=4 1351 B8R0.9 C[C@H](O)CN[C@H](C)C=O 53b9e59588b92175a902e97408217ade [0,1,1,0,0,0|2,0,0]=4 1352 B8R0.21 C=CCCNC(C)(C)C a4869414584c0064a547553365751db6 [0,1,1,0,0,0|2,0,0]=4 1353 B8R0.21 C=CCNCC(C)(C)C b5759ab7d0998d378594802a0d0b43d3 [0,1,1,0,0,0|2,0,0]=4 1354 B8R0.21 C=CCNCC(C)(C)O b737e0ff54c9705607b3b70dab40165b [0,1,1,0,0,0|2,0,0]=4 1355 B8R0.21 C=CCOCC(C)(C)Br 4fcb063b7db70d435f42d66c90104170 [0,1,1,0,0,0|2,0,0]=4 1356 B8R0.21 C=CCOCC(C)(C)C 1c78200b7bd7909308849acf7ab86f3e [0,1,1,0,0,0|2,0,0]=4 1357 B8R0.21 C=CCOCC(C)(C)F 12ce04c50ca168247d56ca83e10b8ab1 [0,1,1,0,0,0|2,0,0]=4 1358 B8R0.21 C=CCOCC(C)(C)S 948294cbf919b15d8157b10819b9e874 [0,1,1,0,0,0|2,0,0]=4 1359 B8R0.21 CC(C)(Br)COCC=O 0c1d7c5166ed98b5f925ae9d138c137a [0,1,1,0,0,0|1,0,0]=3 1360 B8R0.21 CC(C)(C)CCNC=O 10d181a0403fdc263c049f7950d09c8a [0,1,1,0,0,0|1,0,0]=3 1361 B8R0.21 CC(C)(C)CNCC=O 3ad1cf51e607a6beac30c83baeb36c0f [0,1,1,0,0,0|1,0,0]=3 1362 B8R0.21 CC(C)(C)COCC=O 452032ec8ec1169c65301506a57f3400 [0,1,1,0,0,0|1,0,0]=3 1363 B8R0.21 CC(C)(C)NCCC=O 55ce68401173f98bc7370dc4d84bf683 [0,1,1,0,0,0|1,0,0]=3 1364 B8R0.21 CC(C)(F)CCNC=O 580d97cb09a7af4eedc84d8d9c23039e [0,1,1,0,0,0|1,0,0]=3 1365 B8R0.21 CC(C)(F)COCC=O 96a4f5d42c2e2aa743757d961ea002d5 [0,1,1,0,0,0|1,0,0]=3 1366 B8R0.21 CC(C)(O)CCNC=O 8086b4eda3a3ff1c39b6ec114b66fce7 [0,1,1,0,0,0|1,0,0]=3 1367 B8R0.21 CC(C)(O)CNCC=O 0b6f9a66e3da10f9fae74e8313e10a67 [0,1,1,0,0,0|1,0,0]=3 1368 B8R0.21 CC(C)(S)COCC=O 355fa4dd8d31fd881acfc2d6f070cec6 [0,1,1,0,0,0|1,0,0]=3 1369 B8R0.21 CC(F)(F)CNCC=O 5505656e38c31e6e13c2758ae512a321 [0,1,1,0,0,0|2,0,0]=4 1370 B8R0.21 CC(F)(F)COCC=O a6db49236bb9c0551f5dff8c96bf606b [0,1,1,0,0,0|2,0,0]=4 1371 B8R0.21 CCCNCS(=O)(=O)C 0c5ac4b5c3470daba42966bdd3f646a9 [0,1,1,0,0,0|2,0,0]=4 1372 B8R0.21 CCCOCS(=O)(=O)C 432b2a9bb367cc63d3832a09eed3d2d9 [0,1,1,0,0,0|2,0,0]=4 1373 B8R0.21 CCNCCS(=O)(=O)C e43bf84c2c33da0607bb89ff5a969bd7 [0,1,1,0,0,0|2,0,0]=4 1374 B8R0.21 CCOCCS(=N)(=O)C 7d172d8392597cc891bea17b5e99219f [0,1,1,0,0,0|2,0,0]=4 1375 B8R0.21 CCOCCS(=O)(=O)C 23fca17b909b52d4a7188ab3cd634626 [0,1,1,0,0,0|2,0,0]=4 1376 B8R0.28 C=C(Br)CCOC(C)C ebda5fee130a250b1943610fb0d4dd32 [0,1,1,0,0,0|2,0,0]=4 1377 B8R0.28 C=C(Br)CNCC(C)C c8a2223ad4fb68f566d748ff6bcd2335 [0,1,1,0,0,0|2,0,0]=4 1378 B8R0.28 C=C(Br)COCC(C)C c1a78a7a2c4ff68938dbedaa96847100 [0,1,1,0,0,0|2,0,0]=4 1379 B8R0.28 C=C(C)CCNC(=O)C aad0094172f39db5c54a5f1ed27a8fb8 [0,1,1,0,0,0|1,0,1]=4 1380 B8R0.28 C=C(C)CCNC(C)C 743b41619695d9f1ae0496c6310ea6bc [0,1,1,0,0,0|2,0,0]=4 1381 B8R0.28 C=C(C)CCOC(C)C 69cc10ae5801e38a3d14074626c7f435 [0,1,1,0,0,0|2,0,0]=4 1382 B8R0.28 C=C(C)CNCC(=O)C 78f45c6f7509cf460bc1a071e894d38c [0,1,1,0,0,0|1,0,1]=4 1383 B8R0.28 C=C(C)CNCC(C)C 67c871a24d86e1667f16c08c29255d90 [0,1,1,0,0,0|2,0,0]=4 1384 B8R0.28 C=C(C)CNCC(C)O 2b714059ab9907260e6aaccb52d1cb14 [0,1,1,0,0,0|2,0,0]=4 1385 B8R0.28 C=C(C)CNC[C@@H](C)O c594a1781a89398e4ea1a6fed43fc869 [0,1,1,0,0,0|2,0,0]=4 1386 B8R0.28 C=C(C)CNC[C@H](C)O a78b3c91bc5afc2963451088f5a91de2 [0,1,1,0,0,0|2,0,0]=4 1387 B8R0.28 C=C(C)COCC(=O)C 3742b2df3a9a917d85dc43f50a8243d8 [0,1,1,0,0,0|1,0,1]=4 1388 B8R0.28 C=C(C)COCC(C)C 4b7379c6d79f87e4ea0cd366985a2d99 [0,1,1,0,0,0|2,0,0]=4 1389 B8R0.28 C=C(C)COCC(C)F a795756f8a49e558cd74e3b29b74a2d5 [0,1,1,0,0,0|2,0,0]=4 1390 B8R0.28 C=C(C)COCC(C)S 662040e79d7dc5c45fcfe22fcc5b8e8f [0,1,1,0,0,0|2,0,0]=4 1391 B8R0.28 C=C(C)COC[C@@H](C)F fa9677698904873ff03c9c575f62d5d5 [0,1,1,0,0,0|2,0,0]=4 1392 B8R0.28 C=C(C)COC[C@H](C)F 15d5f151204078319cecfaf717305158 [0,1,1,0,0,0|2,0,0]=4 1393 B8R0.28 C=C(Cl)CNCC(C)C 133a90dc6fd28ed81828592e584bc629 [0,1,1,0,0,0|2,0,0]=4 1394 B8R0.28 C=C(Cl)COCC(C)C 184574507b3b98e3e54e734161d68e3a [0,1,1,0,0,0|2,0,0]=4 1395 B8R0.28 C=C(F)CNCC(C)C cf657ab8bf1ba535863f8b8fe0d19e9c [0,1,1,0,0,0|2,0,0]=4 1396 B8R0.28 C=C(F)COCC(C)C 232c1ccf078910d1e8ccc5380c172d54 [0,1,1,0,0,0|2,0,0]=4 1397 B8R0.28 C=C(I)COCC(C)C fe07220c9926e6770dfe26662ad9f2d0 [0,1,1,0,0,0|2,0,0]=4 1398 B8R0.28 CC(=O)CCOC(C)C aa63e522dd0ebf165c9748d141547c49 [0,1,1,0,0,0|1,0,0]=3 1399 B8R0.28 CC(=O)CNCC(C)C 58247fbcbea9991e7cd9ed1b77ee7a40 [0,1,1,0,0,0|1,0,0]=3 1400 B8R0.28 CC(=O)CNCC(C)O 5f353bb8460ab4b4998d7b1c0d718029 [0,1,1,0,0,0|1,0,0]=3 1401 B8R0.28 CC(=O)CNCC(F)F 040d59234b7876c01745adf80e5ff725 [0,1,1,0,0,0|2,0,0]=4 1402 B8R0.28 CC(=O)CNCN(C)C ec5ebd7a403a45eadc9cad461d333fc2 [0,1,1,0,0,0|2,0,0]=4 1403 B8R0.28 CC(=O)CNC[C@@H](C)O 289cb2833e34a4679529caaeb671569a [0,1,1,0,0,0|1,0,0]=3 1404 B8R0.28 CC(=O)CNC[C@H](C)O 8f9759e3f6a23502911152a314ede481 [0,1,1,0,0,0|1,0,0]=3 1405 B8R0.28 CC(=O)COCC(C)C 63d13f7ca3ddeaa73dc93b4258f7679e [0,1,1,0,0,0|1,0,0]=3 1406 B8R0.28 CC(=O)COCC(F)F 1c8a3357ef90b18ca0f3f98579cdfed3 [0,1,1,0,0,0|2,0,0]=4 1407 B8R0.28 CC(=O)COCN(C)C 0fabcf829b746355f1de3762558cb13f [0,1,1,0,0,0|2,0,0]=4 1408 B8R0.28 CC(=O)NCCC(C)C b73f1b13554baa3e34a3560715777fc7 [0,1,1,0,0,0|1,0,0]=3 1409 B8R0.28 CC(=O)NCCC(C)O 9f83d99fdee0bda30ff85f31b4ee4b24 [0,1,1,0,0,0|1,0,0]=3 1410 B8R0.28 CC(=O)NCCC(F)F 4173536c2fddb4363b9de4250b8bab34 [0,1,1,0,0,0|2,0,0]=4 1411 B8R0.28 CC(=O)NCCN(C)C 4d10f56d353a729da2aad8b96e7ef495 [0,1,1,0,0,0|2,0,0]=4 1412 B8R0.28 CC(=O)NCCS(=O)C f793348c68f8cf140d26df72f9958533 [0,1,1,0,0,0|2,0,0]=4 1413 B8R0.28 CC(=O)NCC[C@@H](C)O 40ba395f3243b6aab3575e45be2f2594 [0,1,1,0,0,0|1,0,0]=3 1414 B8R0.28 CC(=O)NCC[C@H](C)O ac547764dcce609b723a03cd4268cf9c [0,1,1,0,0,0|1,0,0]=3 1415 B8R0.28 CC(=O)NCOC(C)C 05afe8e43df805f9cf6a2136caacdf0b [0,1,1,0,0,0|2,0,0]=4 1416 B8R0.28 CC(=O)OCOC(C)C b15362469d0253806d0b351da68c3f40 [0,1,1,0,0,0|2,0,0]=4 1417 B8R0.28 CC(C)CNCC(=O)N 387d837e6273849b1cdad6a6a721ebd2 [0,1,1,0,0,0|1,0,0]=3 1418 B8R0.28 CC(C)CNCC(=O)O e07c47544f784e3ece77975eaa39fa62 [0,1,1,0,0,0|1,0,0]=3 1419 B8R0.28 CC(C)CNC[N+](=O)[O-] e5f388f51900fde81f64a7b5204f667c [0,1,1,0,0,0|2,0,0]=4 1420 B8R0.28 CC(C)COCC(=O)N 80d16d817ce82c87fac95f334c2d23e2 [0,1,1,0,0,0|1,0,0]=3 1421 B8R0.28 CC(C)COCC(=O)O 569b76ca429bc6806415c3ae92c5e81d [0,1,1,0,0,0|1,0,0]=3 1422 B8R0.28 CC(C)COCC(=S)N 55b2e4b0740851f871d2f97589a87dae [0,1,1,0,0,0|1,1,0]=4 1423 B8R0.28 CC(C)COCS(=O)O 28c686504a6dcd9fda3dd07e4e3670ff [0,1,1,0,0,0|2,0,0]=4 1424 B8R0.28 CC(C)COC[N+](=O)[O-] 47f94b331a22180dd9beb857af40f67d [0,1,1,0,0,0|2,0,0]=4 1425 B8R0.28 CC(C)NCCC(=O)N 69c941b0389a0756f6e4daf4a9ab0a1c [0,1,1,0,0,0|1,0,0]=3 1426 B8R0.28 CC(C)NCCC(=O)O f0554134cac289d8b7cbdbda8f5830d8 [0,1,1,0,0,0|1,0,0]=3 1427 B8R0.28 CC(C)NCCC(=S)N dd4f1fea922619b4f6e264931f2d243c [0,1,1,0,0,0|1,1,0]=4 1428 B8R0.28 CC(C)NCCS(=O)C 98cd73f96f71cf5f44c565cd7f7e7b57 [0,1,1,0,0,0|2,0,0]=4 1429 B8R0.28 CC(C)NCCS(=O)O 263a3deff9fb38c3a098f5239db29a80 [0,1,1,0,0,0|2,0,0]=4 1430 B8R0.28 CC(C)OCCC(=O)N 4ee5da2191d5f265d860cb9cfbdd86d0 [0,1,1,0,0,0|1,0,0]=3 1431 B8R0.28 CC(C)OCCC(=O)O a2f1c0df938b61e89340f22784f5d552 [0,1,1,0,0,0|1,0,0]=3 1432 B8R0.28 CC(C)OCCS(=O)C 9f44a2155f1463de437cc5b5f1a51c9f [0,1,1,0,0,0|2,0,0]=4 1433 B8R0.28 CC(C)OCC[N+](=O)[O-] 2fa45c3a4a072eea01604f0243815c5a [0,1,1,0,0,0|2,0,0]=4 1434 B8R0.28 CC(C)OCNC(=O)N 225bdba254c9e931f9fcb99b6f0644ed [0,1,1,0,0,0|2,0,0]=4 1435 B8R0.28 CC(C)OCSC(=O)N 456704dc0d4b427a59e70e240701dde0 [0,1,1,0,0,0|2,0,0]=4 1436 B8R0.28 CC(F)COCC(=O)N e9a9dcc4f520190840a7681321655420 [0,1,1,0,0,0|2,0,0]=4 1437 B8R0.28 CC(F)COCC(=O)O 5825b41f210e11c756bbcfb99cc1b006 [0,1,1,0,0,0|2,0,0]=4 1438 B8R0.28 CC(O)CNCC(=O)N 3341accee510efc87cc2f7b3f340be25 [0,1,1,0,0,0|2,0,0]=4 1439 B8R0.28 CC(O)CNCC(=O)O 0fd36ebbcdac4288c2c1e57036c66736 [0,1,1,0,0,0|2,0,0]=4 1440 B8R0.28 CC(S)COCC(=O)N 82763365c9d88e903f647e90bafc9568 [0,1,1,0,0,0|2,0,0]=4 1441 B8R0.28 CC(S)COCC(=O)O 572404985c8dcbb1715d2ff9748114ee [0,1,1,0,0,0|2,0,0]=4 1442 B8R0.28 CN(C)CNCC(=O)N 61dc06082070ca26d637fe3f6c04d6ee [0,1,1,0,0,0|2,0,0]=4 1443 B8R0.28 CN(C)CNCC(=O)O e6fa8314318b79cfd8ae4ca00ea3b758 [0,1,1,0,0,0|2,0,0]=4 1444 B8R0.28 CN(C)COCC(=O)N 419913c96364efa4322cd65a17692db0 [0,1,1,0,0,0|2,0,0]=4 1445 B8R0.28 CN(C)COCC(=O)O fc3ba42b9747b2743ad7eda51803bfcf [0,1,1,0,0,0|2,0,0]=4 1446 B8R0.28 C[C@@H](F)COCC(=O)N 26ec5b6c1520beb81cb66bb9beb36fee [0,1,1,0,0,0|2,0,0]=4 1447 B8R0.28 C[C@@H](F)COCC(=O)O d9eb7ecba762e434dc71a2e535d45ab3 [0,1,1,0,0,0|2,0,0]=4 1448 B8R0.28 C[C@@H](O)CNCC(=O)N f96380b9f6a9b4fe64a1f461f7c8c0ef [0,1,1,0,0,0|2,0,0]=4 1449 B8R0.28 C[C@@H](O)CNCC(=O)O 6173ec4fb928b6f3ec52f242f1027a0f [0,1,1,0,0,0|2,0,0]=4 1450 B8R0.28 C[C@H](F)COCC(=O)N 7c480ef07c1a9a0730d837d631e998ff [0,1,1,0,0,0|2,0,0]=4 1451 B8R0.28 C[C@H](F)COCC(=O)O 5eaade2b5a7f385567c5eb3b69b32ab7 [0,1,1,0,0,0|2,0,0]=4 1452 B8R0.28 C[C@H](O)CNCC(=O)N dab4e7fe2a5d0d056345029620f69bd6 [0,1,1,0,0,0|2,0,0]=4 1453 B8R0.28 C[C@H](O)CNCC(=O)O 369122c3216fc4d9a4a5ea858770fa62 [0,1,1,0,0,0|2,0,0]=4 1454 B8R0.1 C#CCC(=O)NCCC 02e18d00f6cac127c3ba925ff7cc6fd1 [0,1,1,0,0,0|0,0,2]=4 1455 B8R0.1 C#CCC(C)OCC=O 6f35cb4bf7bb16a3eee8311ce03cd4d2 [0,1,1,0,0,0|0,0,2]=4 1456 B8R0.1 C#CCC(C)OCCC 726b29ef337798823059b3efca55fe70 [0,1,1,0,0,0|1,0,1]=4 1457 B8R0.1 C#CCCN(C)CC=O abfe3994cf7670d80dbb5df8b8fa93fa [0,1,1,0,0,0|1,0,1]=4 1458 B8R0.1 C#CCNC(=O)CCC 988fe137497a657fd02a96648cfc31de [0,1,1,0,0,0|0,0,2]=4 1459 B8R0.1 C#CCNC(C)CCC 904a95c2d539aee151943a21e058e5d4 [0,1,1,0,0,0|1,0,1]=4 1460 B8R0.1 C#CCN[C@@H](C)CCC 3830c22a3d09976b992f49636d5b1dfd [0,1,1,0,0,0|1,0,1]=4 1461 B8R0.1 C#CCOC(C)CCC 292a9da26dd6fef6b77c2dfe0aefdcd5 [0,1,1,0,0,0|1,0,1]=4 1462 B8R0.1 C#CCO[C@@H](C)CCC 59461e1b1d7a142b510d19a0b98bf0f8 [0,1,1,0,0,0|1,0,1]=4 1463 B8R0.1 C#CCO[C@H](C)CCC 2bb84b902e1ccc7a64fd1f85c25c42f1 [0,1,1,0,0,0|1,0,1]=4 1464 B8R0.1 C/C=C/C(=O)NCCC 3112d70c0159afb044aaeb01584dde68 [0,1,1,0,0,0|0,0,2]=4 1465 B8R0.1 C/C=C/C(C)OCC=O 3c462d15fec3dcb51b9371f8065dab9e [0,1,1,0,0,0|0,0,2]=4 1466 B8R0.1 C/C=C/C(C)OCCC 63733f028ee2622e94a5b800971df6ec [0,1,1,0,0,0|1,0,1]=4 1467 B8R0.1 C/C=C/CN(C)CCC 68fa4beb90f4e459d9bc957a029629eb [0,1,1,0,0,0|2,0,0]=4 1468 B8R0.1 C/C=C\CN(C)CCC d8f36325b90dad42a1f23b0fb5c73ea6 [0,1,1,0,0,0|2,0,0]=4 1469 B8R0.1 C=CCC(=O)NCCC 0464f3619ee0131de1206f24520111fa [0,1,1,0,0,0|0,0,2]=4 1470 B8R0.1 C=CCC(C)COCC 1270be54942bfc9267f93a523dae28a1 [0,1,1,0,0,0|1,0,0]=3 1471 B8R0.1 C=CCC(C)COCF 1addc2f48251cfde760e48a173ade9f6 [0,1,1,0,0,0|2,0,0]=4 1472 B8R0.1 C=CCC(C)OCC=O 805d006448d647b16a227c84124f8a54 [0,1,1,0,0,0|0,0,2]=4 1473 B8R0.1 C=CCC(C)OCCC a45dcff5acaff24e8a928ffef7da10dd [0,1,1,0,0,0|1,0,0]=3 1474 B8R0.1 C=CCC(C)OCCF 876f3a417169ab4b1923ee788d5dc5a1 [0,1,1,0,0,0|2,0,0]=4 1475 B8R0.1 C=CCC(C)OCCS fc0c953432b2651d92b5a8e3c428c38d [0,1,1,0,0,0|2,0,0]=4 1476 B8R0.1 C=CCC(C)OCOC 281b0bbcfd0d56f0759e511db89fe2ba [0,1,1,0,0,0|2,0,0]=4 1477 B8R0.1 C=CCC(C)OCSC 22615d5f2d03cd17a008d29371245f31 [0,1,1,0,0,0|2,0,0]=4 1478 B8R0.1 C=CCC(O)CNCC aa1682f0a7f6c65d6e9eb9dff4402815 [0,1,1,0,0,0|2,0,0]=4 1479 B8R0.1 C=CCCC(C)OCC 12ed926926e8651e3a80017bb67d145a [0,1,1,0,0,0|2,0,0]=4 1480 B8R0.1 C=CCCN(C)CC=O b6583e7bc93735d44a280421bb97021c [0,1,1,0,0,0|1,0,1]=4 1481 B8R0.1 C=CCCN(C)CCC dab57175e9273de33949da20b7fb71b3 [0,1,1,0,0,0|2,0,0]=4 1482 B8R0.1 C=CCC[C@@H](C)OCC 0ab76f3ece4d8150e9e76a16d7bb942b [0,1,1,0,0,0|2,0,0]=4 1483 B8R0.1 C=CCN(C)CCCC 7e690a78fa00c036d6b524400b1b2762 [0,1,1,0,0,0|2,0,0]=4 1484 B8R0.1 C=CCN(C)CCCF 321f3b1711738193a09039846d139e57 [0,1,1,0,0,0|2,0,0]=4 1485 B8R0.1 C=CCN(C)CCCO 9b92752ecae5d7c0bd7bb52b6f94bdc6 [0,1,1,0,0,0|2,0,0]=4 1486 B8R0.1 C=CCN(C)CCCS 61cf49fc564e4db05ae16346ec0e4e78 [0,1,1,0,0,0|2,0,0]=4 1487 B8R0.1 C=CCN(C)CCOC 35c6a7bb506c9bbb574bc4cf97ada70e [0,1,1,0,0,0|2,0,0]=4 1488 B8R0.1 C=CCN(C)CCSC ee9f42aa31f4a8a97ec7d7c915a6bf5a [0,1,1,0,0,0|2,0,0]=4 1489 B8R0.1 C=CCN(C)COCC 5ff4c124ad3f579f89631f8abd7975f7 [0,1,1,0,0,0|2,0,0]=4 1490 B8R0.1 C=CCNC(C)CCC 36451e2cb7be8df5f7670577a1f566ee [0,1,1,0,0,0|1,0,0]=3 1491 B8R0.1 C=CCNC(C)CCO 20392bc249adb293d88033c472c5ba70 [0,1,1,0,0,0|2,0,0]=4 1492 B8R0.1 C=CCNC(C)COC 8be0a1a3efe06201dfdebdb472d4b60d [0,1,1,0,0,0|2,0,0]=4 1493 B8R0.1 C=CCN[C@@H](C)CCC d5fcdf262c72aeb1e02dde87ad10c66b [0,1,1,0,0,0|1,0,0]=3 1494 B8R0.1 C=CCN[C@@H](C)CCO 1b9f49ff05f45441652baa86b54c33fb [0,1,1,0,0,0|2,0,0]=4 1495 B8R0.1 C=CCN[C@@H](C)COC aab98976808482653489089b6e41eaad [0,1,1,0,0,0|2,0,0]=4 1496 B8R0.1 C=CCN[C@H](C)CCO a742a5ac3ea9b1a9e5ba170dc2102a99 [0,1,1,0,0,0|2,0,0]=4 1497 B8R0.1 C=CCN[C@H](C)COC da94bb1b36f0e4246472ca31a9988767 [0,1,1,0,0,0|2,0,0]=4 1498 B8R0.1 C=CCOC(C)CCC fbdc613bc45f6b8caccc8ec8a52f0c2d [0,1,1,0,0,0|1,0,0]=3 1499 B8R0.1 C=CCOC(C)COC 5cdae24e3deb217752566671cd1e864c [0,1,1,0,0,0|2,0,0]=4 1500 B8R0.1 C=CCOC(C)CSC 66d2cdb6f488bc931466771d9a4d5e16 [0,1,1,0,0,0|2,0,0]=4 1501 B8R0.1 C=CCO[C@@H](C)CCC 709aabbb80656eae64c78055179b3126 [0,1,1,0,0,0|1,0,0]=3 1502 B8R0.1 C=CCO[C@@H](C)COC ddb97d53499bbb5a741daaae71316e95 [0,1,1,0,0,0|2,0,0]=4 1503 B8R0.1 C=CCO[C@H](C)CCC 0d000bc310de5de3a03499af588f23c5 [0,1,1,0,0,0|1,0,0]=3 1504 B8R0.1 C=CCO[C@H](C)COC 517e372db2b6b0cbc809bc89ea1bfb62 [0,1,1,0,0,0|2,0,0]=4 1505 B8R0.1 C=CC[C@@H](C)OCC=O a0e388fab32588efe0b0ae569bdc0661 [0,1,1,0,0,0|0,0,2]=4 1506 B8R0.1 C=CC[C@@H](C)OCCC d5c9cea8bbf114b9070cd8c5746c3116 [0,1,1,0,0,0|1,0,0]=3 1507 B8R0.1 C=CC[C@@H](C)OCCF 0e221b4e3777ac0e75fec6bc777769f9 [0,1,1,0,0,0|2,0,0]=4 1508 B8R0.1 C=CC[C@@H](C)OCCS a793bef9b5fb1aecc9937aaba2cf4ca4 [0,1,1,0,0,0|2,0,0]=4 1509 B8R0.1 C=CC[C@@H](C)OCOC fcb1b5a2c21edbd89383d6033a63e9ae [0,1,1,0,0,0|2,0,0]=4 1510 B8R0.1 C=CC[C@@H](C)OCSC c7295f0bbc48ced0b90bfdbfbefa2e81 [0,1,1,0,0,0|2,0,0]=4 1511 B8R0.1 C=CC[C@H](C)OCC=O b16f0951e117256fa250913579de0fe1 [0,1,1,0,0,0|0,0,2]=4 1512 B8R0.1 C=CC[C@H](C)OCCC 25f96375986637102dbe5a79fcef6427 [0,1,1,0,0,0|1,0,0]=3 1513 B8R0.1 C=CC[C@H](C)OCCF de84939ff1a4fae7b057243706dea173 [0,1,1,0,0,0|2,0,0]=4 1514 B8R0.1 C=CC[C@H](C)OCCS 061bef58b35add8d9c046c4e85b43a74 [0,1,1,0,0,0|2,0,0]=4 1515 B8R0.1 C=CC[C@H](C)OCOC f258f69d76f9669905c9f9c961e70ed3 [0,1,1,0,0,0|2,0,0]=4 1516 B8R0.1 C=CC[C@H](C)OCSC daeb07a08dc35c24216d7d76c9c166e7 [0,1,1,0,0,0|2,0,0]=4 1517 B8R0.1 CC#CC(=O)NCCC f3929637650271102a5b6c505641e7e8 [0,1,1,0,0,0|0,0,2]=4 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effb943f4ec1dba1ee2232662d0cb367 [0,1,1,0,0,0|1,0,0]=3 1531 B8R0.1 CCCC(=O)NCCO d2bc78e5bd2f73aa8619f010857f1926 [0,1,1,0,0,0|1,0,0]=3 1532 B8R0.1 CCCC(=O)NCCS c2ef67720d0b2ef54134f82538ee13fd [0,1,1,0,0,0|1,0,0]=3 1533 B8R0.1 CCCC(=S)OCC=O ee4851bc3a15d19c33e510859df38ec8 [0,1,1,0,0,0|1,0,1]=4 1534 B8R0.1 CCCC(=S)OCCF 4a3f66968fafe65a13eab591dccc8c9f [0,1,1,0,0,0|1,1,0]=4 1535 B8R0.1 CCCC(=S)OCCS 7161c28940ff0dc6e0b2d32d8bc2d5dc [0,1,1,0,0,0|1,1,0]=4 1536 B8R0.1 CCCC(=S)OCOC d7c66aa0be93e71a0e10702c93e66ce1 [0,1,1,0,0,0|1,1,0]=4 1537 B8R0.1 CCCC(=S)OCSC aaf32ff7376d2185d5b81bb017266ecd [0,1,1,0,0,0|1,1,0]=4 1538 B8R0.1 CCCC(C)CNC#N c3be8e8d2214c40f927f4d3b04c074a9 [0,1,1,0,0,0|1,0,1]=4 1539 B8R0.1 CCCC(C)COCC 93903632c96b35063d92ad4a88f1870f [0,1,1,0,0,0|1,0,1]=4 1540 B8R0.1 CCCC(C)COCF 93c3ddfe52dd775edf5ae50e46d5413c [0,1,1,0,0,0|1,0,1]=4 1541 B8R0.1 CCCC(C)NCC#N 922f6b6c54005aee290e90bbc567adb3 [0,1,1,0,0,0|1,0,1]=4 1542 B8R0.1 CCCC(C)NCC=O 9f1868c3f1326c5a8444197e6058548a [0,1,1,0,0,0|0,0,0]=2 1543 B8R0.1 CCCC(C)NCCBr 753adf372612d932eb167d3c6c6a7373 [0,1,1,0,0,0|1,0,1]=4 1544 B8R0.1 CCCC(C)NCCF 561290ca4cbab4d4179520d904990ead [0,1,1,0,0,0|1,0,1]=4 1545 B8R0.1 CCCC(C)NCCI 853631fdd24c7675889f7c8342411ed2 [0,1,1,0,0,0|1,0,1]=4 1546 B8R0.1 CCCC(C)NCCO d387394dd5b59962f0214322519a89cd [0,1,1,0,0,0|0,0,2]=4 1547 B8R0.1 CCCC(C)NCCS ae0edf47df652752132304246cff565d [0,1,1,0,0,0|0,1,1]=4 1548 B8R0.1 CCCC(C)NCOC 7593556ba3b3358786240e76b9dc1cde [0,1,1,0,0,0|2,0,0]=4 1549 B8R0.1 CCCC(C)NCSC 3493d269ab799371709caa3d578d33ab [0,1,1,0,0,0|2,0,0]=4 1550 B8R0.1 CCCC(C)OCC#N 4085f27291709d3acf54fc2da94130ba [0,1,1,0,0,0|1,0,1]=4 1551 B8R0.1 CCCC(C)OCC=O bf24684220a55c36790abbdedb1b3799 [0,1,1,0,0,0|0,0,0]=2 1552 B8R0.1 CCCC(C)OCCF 51dd4182d40ab8df7fc597096aea8427 [0,1,1,0,0,0|1,0,1]=4 1553 B8R0.1 CCCC(C)OCCS 69475e4324fe3c939d55cdf50e8476b5 [0,1,1,0,0,0|0,1,1]=4 1554 B8R0.1 CCCC(C)OCOC 7c2918bfa8ffaddb181d24a90d0ac5c3 [0,1,1,0,0,0|2,0,0]=4 1555 B8R0.1 CCCC(C)OCSC 75e51c2393446b0133ca8c8523cf3bf1 [0,1,1,0,0,0|2,0,0]=4 1556 B8R0.1 CCCC(O)CNC=O 3e50ed85c9c916875e196c40b2fc51de [0,1,1,0,0,0|1,0,0]=3 1557 B8R0.1 CCCC(O)CNCC 832780b22c4621b899b7afcc4f4f0de1 [0,1,1,0,0,0|0,0,2]=4 1558 B8R0.1 CCCCC(C)NC=O 203907a44368850c8dee59ecad001a1f [0,1,1,0,0,0|1,0,0]=3 1559 B8R0.1 CCCCN(C)CC=O 0b9f4b899180868f46e162e3fdd5a057 [0,1,1,0,0,0|1,0,0]=3 1560 B8R0.1 CCCCN(C)CCC 598958f1bf27154d8760346aca3fc1c7 [0,1,1,0,0,0|2,0,0]=4 1561 B8R0.1 CCCC[C@@H](C)NC=O 85ae0f7eb97c9ecc6858b3133cc13253 [0,1,1,0,0,0|1,0,0]=3 1562 B8R0.1 CCCN(C)C/C=C/Cl 053be1c3804b0f40a9cdad829ccbf7bd [0,1,1,0,0,0|2,0,0]=4 1563 B8R0.1 CCCN(C)C/C=C\Cl 1125c72ad5f10029dac46adbd18ceff1 [0,1,1,0,0,0|2,0,0]=4 1564 B8R0.1 CCCN(C)C/C=C\O 2a082a41c2329b960b6a0761624140ea [0,1,1,0,0,0|1,0,1]=4 1565 B8R0.1 CCCN(C)CCC=O cd4badc64192ce4c537889fd9678d594 [0,1,1,0,0,0|1,0,0]=3 1566 B8R0.1 CCCN(C)CCCF 59925d2d70ed2cd32e04f065de645944 [0,1,1,0,0,0|2,0,0]=4 1567 B8R0.1 CCCN(C)CCCO bcaba704baeaba819c24be99d4c792f1 [0,1,1,0,0,0|2,0,0]=4 1568 B8R0.1 CCCN(C)CCCS 13f800e972129b543eca8df52c669ca8 [0,1,1,0,0,0|2,0,0]=4 1569 B8R0.1 CCCN(C)CCOC 3001c1572568a855669d478bf72bb14a [0,1,1,0,0,0|2,0,0]=4 1570 B8R0.1 CCCN(C)CCSC 124c992bab27aab465124a43552a6d9d [0,1,1,0,0,0|2,0,0]=4 1571 B8R0.1 CCCN(C)COCC cf6f2674ada2fc38b6be0d5d76fba32b [0,1,1,0,0,0|2,0,0]=4 1572 B8R0.1 CCCNC(=O)CC#N a35df4e334c2327f92e0bafe31098739 [0,1,1,0,0,0|1,0,1]=4 1573 B8R0.1 CCCNC(=O)CC=O c387c4bc3ea86b21200effc59fe151db [0,1,1,0,0,0|1,0,1]=4 1574 B8R0.1 CCCNC(=O)CCC 3a4ef615081398a2acfdf5d3349655c4 [0,1,1,0,0,0|0,0,0]=2 1575 B8R0.1 CCCNC(=O)CCF 80cac466548133e31f593852e3638107 [0,1,1,0,0,0|1,0,0]=3 1576 B8R0.1 CCCNC(=O)CCO 1e17d6cf040450a0042d7883a84b4d20 [0,1,1,0,0,0|1,0,0]=3 1577 B8R0.1 CCCNC(=O)CCS 5ca47d6ccf33cee73df146cfd5794783 [0,1,1,0,0,0|1,0,0]=3 1578 B8R0.1 CCCNC(=O)COC d992f0c3466a56e61d0974e6b6e8669f [0,1,1,0,0,0|1,0,0]=3 1579 B8R0.1 CCCNC(=O)CON 9840c2139f1e78498e25b8fce4d164d2 [0,1,1,0,0,0|2,0,0]=4 1580 B8R0.1 CCCNC(=O)CSC 6ae58cb75ea789964eebc3d4df556317 [0,1,1,0,0,0|1,0,0]=3 1581 B8R0.1 CCCNC(C)CC#N 43b32c6da36abb9ca868ef3a72e99b78 [0,1,1,0,0,0|1,0,1]=4 1582 B8R0.1 CCCNC(C)CCC d58b8fb4472d4722966db633dc2848a1 [0,1,1,0,0,0|1,0,1]=4 1583 B8R0.1 CCCNC(C)CCO 2e0066dec5bfac2fe8aee5a15fdb0084 [0,1,1,0,0,0|0,0,2]=4 1584 B8R0.1 CCCNC(C)COC 4346ed93e9ed26ed30cbd2c33a1a3971 [0,1,1,0,0,0|2,0,0]=4 1585 B8R0.1 CCCN[C@@H](C)CCC 559d6e0322e30323f5594c28d9f6d2f9 [0,1,1,0,0,0|1,0,1]=4 1586 B8R0.1 CCCN[C@@H](C)CCO d83bfeeda889a8c7feae809ec08f9d71 [0,1,1,0,0,0|0,0,2]=4 1587 B8R0.1 CCCN[C@@H](C)COC c1bfae4cdff368ae020ea427a86f20a2 [0,1,1,0,0,0|2,0,0]=4 1588 B8R0.1 CCCN[C@H](C)CCO 868b607afbbd0b779ae880e9de3082ae [0,1,1,0,0,0|0,0,2]=4 1589 B8R0.1 CCCN[C@H](C)COC db62694081776beb55a87c04a01b7e4c [0,1,1,0,0,0|2,0,0]=4 1590 B8R0.1 CCCOC(=S)CCC 553859e26557f67ca84075cb05814f3e [0,1,1,0,0,0|0,1,0]=3 1591 B8R0.1 CCCOC(C)CC#N 407318eac9e44ed191090c3a4ee1db31 [0,1,1,0,0,0|1,0,1]=4 1592 B8R0.1 CCCOC(C)CCC 5072af5c5b154601df0153ecc4f9a62c [0,1,1,0,0,0|1,0,1]=4 1593 B8R0.1 CCCOC(C)COC 7da8295e4d831ee4f9d2cde28bad1a12 [0,1,1,0,0,0|2,0,0]=4 1594 B8R0.1 CCCOC(C)CSC 9f9571e90cf786089b434f3ce024d599 [0,1,1,0,0,0|2,0,0]=4 1595 B8R0.1 CCCO[C@@H](C)CC#N e1cc5f2702a0bdb4ec145d80cec246cf [0,1,1,0,0,0|1,0,1]=4 1596 B8R0.1 CCCO[C@@H](C)CCC 3768650ef68ec2d5f66e51478eb2c0cf [0,1,1,0,0,0|1,0,1]=4 1597 B8R0.1 CCCO[C@@H](C)COC 626e622663639373f117286290b64b6d [0,1,1,0,0,0|2,0,0]=4 1598 B8R0.1 CCCO[C@H](C)CC#N 92b4d59f363ebe9abc712b1a1f2a0233 [0,1,1,0,0,0|1,0,1]=4 1599 B8R0.1 CCCO[C@H](C)CCC d9937f3512bcf6b6a2b04993e218c5dc [0,1,1,0,0,0|1,0,1]=4 1600 B8R0.1 CCCO[C@H](C)COC 97f2c6bbb0fdd054219bab069984cf44 [0,1,1,0,0,0|2,0,0]=4 1601 B8R0.1 CCC[C@@H](C)OCC#N 6cfa39cf188e361c410ed92789c272b5 [0,1,1,0,0,0|1,0,1]=4 1602 B8R0.1 CCC[C@@H](C)OCC=O 81402cca9611ddb40901d5fa2d62e285 [0,1,1,0,0,0|0,0,0]=2 1603 B8R0.1 CCC[C@@H](C)OCCF 551477ebd941c69308556a318357406d [0,1,1,0,0,0|1,0,1]=4 1604 B8R0.1 CCC[C@@H](C)OCCS 32dc180121f7e6b2463f9b82f724d60f [0,1,1,0,0,0|0,1,1]=4 1605 B8R0.1 CCC[C@@H](C)OCOC 424856e8f73d9733e5e6cd61105c8f9c [0,1,1,0,0,0|2,0,0]=4 1606 B8R0.1 CCC[C@@H](C)OCSC c99c99286eba63cefa83ea33456022c2 [0,1,1,0,0,0|2,0,0]=4 1607 B8R0.1 CCC[C@H](C)NCC#N f729fd78de4d2dbac625f813b0bf3743 [0,1,1,0,0,0|1,0,1]=4 1608 B8R0.1 CCC[C@H](C)NCC=O 344319cad1a5cb6c553f571432cf347f [0,1,1,0,0,0|0,0,0]=2 1609 B8R0.1 CCC[C@H](C)NCCF ad34b2e1bc15d73c299f2f9233e9fc6d [0,1,1,0,0,0|1,0,1]=4 1610 B8R0.1 CCC[C@H](C)NCCO a9ccf92f27c638a9d01093b14de8d08e [0,1,1,0,0,0|0,0,2]=4 1611 B8R0.1 CCC[C@H](C)NCCS 4b977739e63bd4bdba50b1434c29865f [0,1,1,0,0,0|0,1,1]=4 1612 B8R0.1 CCC[C@H](C)NCOC e6035597a8eb8fe082f6fe480c7fc30b [0,1,1,0,0,0|2,0,0]=4 1613 B8R0.1 CCC[C@H](C)NCSC 104ebf702d7962ee0497ce7761710d65 [0,1,1,0,0,0|2,0,0]=4 1614 B8R0.1 CCC[C@H](C)OCC#N a65ccb7a75a6f63c6043f7514ae51a4c [0,1,1,0,0,0|1,0,1]=4 1615 B8R0.1 CCC[C@H](C)OCC=O cd3513e181af862dd8891792f8677966 [0,1,1,0,0,0|0,0,0]=2 1616 B8R0.1 CCC[C@H](C)OCCF e12d025f332e1847a0a0c8377933b294 [0,1,1,0,0,0|1,0,1]=4 1617 B8R0.1 CCC[C@H](C)OCCS 9c981c47f7c3ead27a21a510681a21c3 [0,1,1,0,0,0|0,1,1]=4 1618 B8R0.1 CCC[C@H](C)OCOC f3c5c84cdb332795f207cd42cee3605b [0,1,1,0,0,0|2,0,0]=4 1619 B8R0.1 CCC[C@H](C)OCSC 32a5d497847cfe259fd9a3968696750a [0,1,1,0,0,0|2,0,0]=4 1620 B8R0.1 CCNC(=O)CNCF 00b80b6827b81d8895e54234ac75d43c [0,1,1,0,0,0|2,0,0]=4 1621 B8R0.1 CCNC(=O)CNCO ce3cba50f7ed87e7409428e42c23fd71 [0,1,1,0,0,0|2,0,0]=4 1622 B8R0.1 CCNC(=O)COCC c84e7c49da6c2baea65be933f5b80bea [0,1,1,0,0,0|1,0,0]=3 1623 B8R0.1 CCNC(=O)COCF 07accf9dfadaaccc536f5c34a66ac1b1 [0,1,1,0,0,0|2,0,0]=4 1624 B8R0.1 CCNCC(=O)NCC 85e3c6c463358c2ceb6c3f3c07ea189c [0,1,1,0,0,0|1,0,0]=3 1625 B8R0.1 CCNCC(=O)OCC 13e479e123264c7bc2cd9986b04b4c24 [0,1,1,0,0,0|1,0,0]=3 1626 B8R0.1 CCNCC(C)CCO ce19fc97a41079125b3a501e5658b50e [0,1,1,0,0,0|0,0,2]=4 1627 B8R0.1 CCOC(=O)CNCF 7d02e761e530b1a2e8b4937d75024162 [0,1,1,0,0,0|2,0,0]=4 1628 B8R0.1 CCOC(=O)CNCO be258da79336855a99e7f18427102b1b [0,1,1,0,0,0|2,0,0]=4 1629 B8R0.1 CCOC(=O)COCF e0f65d48f1d596b5b0dcd0c878bc5d05 [0,1,1,0,0,0|2,0,0]=4 1630 B8R0.1 CCOC(C)CNC=O 6ac843f8d05ef25abe339acf9a7e85be [0,1,1,0,0,0|1,0,0]=3 1631 B8R0.1 CCOCC(=O)OCC a71429e2784f27b770f80be9d4ceb826 [0,1,1,0,0,0|1,0,0]=3 1632 B8R0.1 CN(CC=O)CCC#N 2b7af8a14631e012502622d7a3c9dfed [0,1,1,0,0,0|1,0,1]=4 1633 B8R0.1 CN(CC=O)CCCO e829ef1e39177735d96baabedb183026 [0,1,1,0,0,0|1,0,0]=3 1634 B8R0.1 CN(CC=O)CCON e216ea3a47e02385fd3a2622ad7fa59d [0,1,1,0,0,0|2,0,0]=4 1635 B8R0.1 CN(CCF)CCC=O 8931c69c0220d8a040f4b6d70039493e [0,1,1,0,0,0|2,0,0]=4 1636 B8R0.1 CN(CCO)CCC=O 69df82d3bd6c841b00970a1b6a8a928f [0,1,1,0,0,0|2,0,0]=4 1637 B8R0.1 COCC(=O)NCCBr e1d7efa2beb897f6fe8c723e5fef1d8c [0,1,1,0,0,0|2,0,0]=4 1638 B8R0.1 COCC(=O)NCCF 5b27f9df05a07da8459d8e50096ac5ef [0,1,1,0,0,0|2,0,0]=4 1639 B8R0.1 COCC(=O)NCCI 555339bd86b0ca69dc4cdec31caa1894 [0,1,1,0,0,0|2,0,0]=4 1640 B8R0.1 COCC(=O)NCCO 5ced7d6cbd9eed1c30b901e6485d694c [0,1,1,0,0,0|2,0,0]=4 1641 B8R0.1 COCC(=O)NCCS 730709bdb2536a5f7519c33efb71b705 [0,1,1,0,0,0|2,0,0]=4 1642 B8R0.1 COCC(C)NCC=O 4baf3fe6a6d274e7ea1aec1466238275 [0,1,1,0,0,0|1,0,0]=3 1643 B8R0.1 COCC(C)OCC=O a93d71aa3da594c97159b56ba29ff8f5 [0,1,1,0,0,0|1,0,0]=3 1644 B8R0.1 COCC(O)CNC=O dcf0e3098a4084e4af6a40d5ee812c91 [0,1,1,0,0,0|2,0,0]=4 1645 B8R0.1 COCCN(C)CC=O c7dafc3b396de10656291e435de6410a [0,1,1,0,0,0|1,0,0]=3 1646 B8R0.1 COC[C@@H](C)NCC=O 4fb921a050a5f68cf2239a934ae891a7 [0,1,1,0,0,0|1,0,0]=3 1647 B8R0.1 COC[C@@H](C)OCC=O e4852e42aa1f253c2a0a1f8cacf1148b [0,1,1,0,0,0|1,0,0]=3 1648 B8R0.1 COC[C@@H](O)CNC=O 17b12184b93d1444bd3c1cfdf3acf27b [0,1,1,0,0,0|2,0,0]=4 1649 B8R0.1 COC[C@H](C)NCC=O bc29ca8d06d84bc5177cf78e24d1b1b6 [0,1,1,0,0,0|1,0,0]=3 1650 B8R0.1 COC[C@H](C)OCC=O e3af86d71c642a75e0e78450bc9ecd56 [0,1,1,0,0,0|1,0,0]=3 1651 B8R0.1 CSCC(=O)NCCBr 98705a0f39eb077061bcbd29b0672e6a [0,1,1,0,0,0|2,0,0]=4 1652 B8R0.1 CSCC(=O)NCCF dfda28d66fa36cfb5ce50a1350224197 [0,1,1,0,0,0|2,0,0]=4 1653 B8R0.1 CSCC(=O)NCCI 7bfc8d164efaef654c34edd5d1d07835 [0,1,1,0,0,0|2,0,0]=4 1654 B8R0.1 CSCC(=O)NCCO 8fe8e72aaf0bb9f5644b18e3c790996d [0,1,1,0,0,0|2,0,0]=4 1655 B8R0.1 CSCC(=O)NCCS 0c7243c53eb1aa5322c2775032ee2b33 [0,1,1,0,0,0|2,0,0]=4 1656 B8R0.1 CSCC(C)OCC=O d521716379b16767717aab19be915c57 [0,1,1,0,0,0|1,0,0]=3 1657 B8R0.1 CSCCN(C)CC=O 89a7838ed9276e35ce7d12178b247609 [0,1,1,0,0,0|1,0,0]=3 1658 B8R0.1 C[C@@H](CC#N)OCC=O fbb86d03e87cb409bf21e60c3df05582 [0,1,1,0,0,0|1,0,1]=4 1659 B8R0.1 C[C@@H](CCO)NCC=O b740e215ba752232b945e9f7d9202d2b [0,1,1,0,0,0|1,0,0]=3 1660 B8R0.1 C[C@H](CC#N)OCC=O 5dee6ecc90844b5e78d82d86547d8772 [0,1,1,0,0,0|1,0,1]=4 1661 B8R0.1 C[C@H](CCCO)NC=O 76787ce64f2b79059513d880ee57c0da [0,1,1,0,0,0|1,0,0]=3 1662 B8R0.1 C[C@H](CCO)NCC=O 8e0d0c9fecd308d7ccaf47b7123c3880 [0,1,1,0,0,0|1,0,0]=3 1663 B8R0.1 O=C(CCF)NCCBr 4e6a83a04fff0ae2002d06f5532a71cf [0,1,1,0,0,0|2,0,0]=4 1664 B8R0.1 O=C(CCF)NCCF 3ee47b2b4a969933bf6a2b7769d886d8 [0,1,1,0,0,0|2,0,0]=4 1665 B8R0.1 O=C(CCF)NCCI 0514d32be9a459d35ff2d3dd8e59c8c1 [0,1,1,0,0,0|2,0,0]=4 1666 B8R0.1 O=C(CCF)NCCO 8a006b90c0f677be977fd587da748001 [0,1,1,0,0,0|2,0,0]=4 1667 B8R0.1 O=C(CCF)NCCS cc499bcf14cc4ef20c4a540fd4249535 [0,1,1,0,0,0|2,0,0]=4 1668 B8R0.1 O=C(CCO)NCCBr 0598e39f87524871b714a958e56557af [0,1,1,0,0,0|2,0,0]=4 1669 B8R0.1 O=C(CCO)NCCF fc3c58338add0c048e7e192017336dc4 [0,1,1,0,0,0|2,0,0]=4 1670 B8R0.1 O=C(CCO)NCCI f4b9eac1b1d1ab1205b4f68c01e683b0 [0,1,1,0,0,0|2,0,0]=4 1671 B8R0.1 O=C(CCO)NCCO baa85bba8951a71c692dae57f4f0b055 [0,1,1,0,0,0|2,0,0]=4 1672 B8R0.1 O=C(CCO)NCCS 67e704856b61f7f4ce061f14d041dc6c [0,1,1,0,0,0|2,0,0]=4 1673 B8R0.1 O=C(CCS)NCCBr 0eb47b0aecf2287af30d9b3e94e8bc58 [0,1,1,0,0,0|2,0,0]=4 1674 B8R0.1 O=C(CCS)NCCF b7e186cad638003cfed1aa574b20f812 [0,1,1,0,0,0|2,0,0]=4 1675 B8R0.1 O=C(CCS)NCCI 56f9d8039c6ce5f07f13c307d4e588bf [0,1,1,0,0,0|2,0,0]=4 1676 B8R0.1 O=C(CCS)NCCO 41c5fbd04fe40888bf540f13522d8b85 [0,1,1,0,0,0|2,0,0]=4 1677 B8R0.1 O=C(CCS)NCCS a425fac0fa57c463ae17426b0d0c8bcc [0,1,1,0,0,0|2,0,0]=4 1678 B8R0.3 C=CC(C)N(C)CCC dcaf3d979e8229a6a7227fc47437ea40 [0,1,1,0,0,0|2,0,0]=4 1679 B8R0.3 C=CCN(C)C(C)CC 0f1e60581fe569ba5c9e9daeaa046c78 [0,1,1,0,0,0|2,0,0]=4 1680 B8R0.3 C=C[C@@H](C)[C@@H](C)OCC 7174985858b6754d29082e0523030593 [0,1,1,0,0,0|2,0,0]=4 1681 B8R0.3 C=C[C@@H](C)[C@H](C)OCC 1539f179cedf60643533cb2e64df525b [0,1,1,0,0,0|2,0,0]=4 1682 B8R0.3 C=C[C@H](C)[C@@H](C)OCC d464e2ddb3652873a2501204a8efab8b [0,1,1,0,0,0|2,0,0]=4 1683 B8R0.3 C=C[C@H](C)[C@H](C)OCC 0a872f2d6d98f6438e7af34bb761da4a [0,1,1,0,0,0|2,0,0]=4 1684 B8R0.3 CC(C=O)N(C)CCF 418bf595cf9b58e3c449816e6eac5594 [0,1,1,0,0,0|2,0,0]=4 1685 B8R0.3 CC(C=O)N(C)CCO 7d4a0fe41ac03f29b1a8a1f199619c05 [0,1,1,0,0,0|2,0,0]=4 1686 B8R0.3 CC(CCO)N(C)C=O 5555bcf9461e7743273bcd7e0352a154 [0,1,1,0,0,0|2,0,0]=4 1687 B8R0.3 CC(CO)N(C)CC=O 0f8d2e48b5ce1eda5ef71ae8a2fbea8d [0,1,1,0,0,0|2,0,0]=4 1688 B8R0.3 CCC(C)C(C)NC=O 4790f87f99d2631c4d7242b87ea52752 [0,1,1,0,0,0|1,0,0]=3 1689 B8R0.3 CCC(C)N(C)CC=O 842637d179d388d97d4751c027c4a536 [0,1,1,0,0,0|1,0,0]=3 1690 B8R0.3 CCCC(=O)N(C)CC d5f34bd9db3ccc82fc95365990f29579 [0,1,1,0,0,0|1,0,0]=3 1691 B8R0.3 CCCN(C)C(=O)C=O ae9046810fc57b836f1225fb4fa409a0 [0,1,1,0,0,0|1,0,1]=4 1692 B8R0.3 CCCN(C)C(C)C=O e6473a1a6d02a5e82b6c038acd576da0 [0,1,1,0,0,0|1,0,0]=3 1693 B8R0.3 CCCN(C)C(C)CC e90ec3dd5d6af029f20e2d820addd400 [0,1,1,0,0,0|2,0,0]=4 1694 B8R0.3 CCCN(C)[C@H](C)C=O 3790552277429781db5f53610a8878f0 [0,1,1,0,0,0|1,0,0]=3 1695 B8R0.3 CCN(C)C(=O)CCF e5a9ff21e8c2fcaad476896c3478fe71 [0,1,1,0,0,0|2,0,0]=4 1696 B8R0.3 CCN(C)C(=O)CCO a768fc1ddb9cd71dd31e098b1227291c [0,1,1,0,0,0|2,0,0]=4 1697 B8R0.3 CCN(C)C(=O)CCS 9063f4e5b939dc91c720aeb631377d8b [0,1,1,0,0,0|2,0,0]=4 1698 B8R0.3 CCN(C)C(=O)COC bc075abf9590b9fbb9912b8588e5739b [0,1,1,0,0,0|2,0,0]=4 1699 B8R0.3 CCN(C)C(=O)CSC de841dcb44287d75dce30d4bffb7e292 [0,1,1,0,0,0|2,0,0]=4 1700 B8R0.3 C[C@@H](CCO)N(C)C=O 745e3e839cb6abf8e6c7990ccbf7d930 [0,1,1,0,0,0|2,0,0]=4 1701 B8R0.3 C[C@@H](CO)N(C)CC=O 7ec30cd81e597e1bd2a1af4676ffad1f [0,1,1,0,0,0|2,0,0]=4 1702 B8R0.3 C[C@H](C=O)N(C)CCF 3e1cbaf51d2e952784a1b5db79504f53 [0,1,1,0,0,0|2,0,0]=4 1703 B8R0.3 C[C@H](C=O)N(C)CCO 49a6d7d68908c07ccafe8fbc747e5a32 [0,1,1,0,0,0|2,0,0]=4 1704 B8R0.3 C[C@H](CO)N(C)CC=O 549d4707c245d0d43b050d1c44958445 [0,1,1,0,0,0|2,0,0]=4 1705 B8R0.22 C=CCN(CC)CCC 7aebbfb3f75baa8bbab14ad7e2fc6fe2 [0,1,1,0,0,0|2,0,0]=4 1706 B8R0.22 C=CCN(CF)CCC 49aab59b80da8d4589be20d7460f1c51 [0,1,1,0,0,0|2,0,0]=4 1707 B8R0.22 C=CCN(CO)CCC 5b800a0a1d2f8747fb56a06f460cf028 [0,1,1,0,0,0|2,0,0]=4 1708 B8R0.22 CCC(COC)NC=O 53905710bc62d6f533f443331f56e2bc [0,1,1,0,0,0|2,0,0]=4 1709 B8R0.22 CCCC(CO)NC=O 41f5afc0296d6847bc820d8afc2b5787 [0,1,1,0,0,0|1,0,0]=3 1710 B8R0.22 CCCN(C=O)CCC b8d16e0fe5e219991097fa7af52168fc [0,1,1,0,0,0|1,0,0]=3 1711 B8R0.22 CCCN(C=O)CCO 05c7e3c748b410d220017381f77da8d3 [0,1,1,0,0,0|2,0,0]=4 1712 B8R0.22 CCCN(CC)CC=O 10f91472c4600bbc31b6ae1008baca40 [0,1,1,0,0,0|1,0,0]=3 1713 B8R0.22 CCCN(CC)CCC fbdeabbee1b9c3e90ce0dba0622f60e1 [0,1,1,0,0,0|2,0,0]=4 1714 B8R0.22 CCCN(CF)CCC 13308840e37fb0db9101f8040f290680 [0,1,1,0,0,0|2,0,0]=4 1715 B8R0.22 CCCN(CO)CCC 8895812a51d2f9ffd61abab1a697cc71 [0,1,1,0,0,0|1,0,1]=4 1716 B8R0.22 CCC[C@@H](CO)NC=O 3c94a70b3970ecaf12f548b2138bdede [0,1,1,0,0,0|1,0,0]=3 1717 B8R0.22 CCC[C@H](CO)NC=O 930af0e5fd8674584b8a8514e2d4657f [0,1,1,0,0,0|1,0,0]=3 1718 B8R0.22 CCN(CC=O)CCCl 4ed90969909b022e2ac83da8060f9efc [0,1,1,0,0,0|2,0,0]=4 1719 B8R0.22 CCN(CC=O)CCO 97dbc0347b45240747141aa67b4d0675 [0,1,1,0,0,0|2,0,0]=4 1720 B8R0.22 COCC(CO)NC=O 7cb927b980bd90d760ca02f17ab63be0 [0,1,1,0,0,0|2,0,0]=4 1721 B8R0.22 CSCC(CO)NC=O dbcc07b4bda20d44a07ec89880e75884 [0,1,1,0,0,0|2,0,0]=4 1722 B8R0.22 O=CCN(CO)CCO 2b815b0b958039d51c66791793833e59 [0,1,1,0,0,0|2,0,0]=4 1723 B8R0.22 O=CNC(CO)CCO 1c386d33bbd7c581f75e6c17d6cd6e2e [0,1,1,0,0,0|2,0,0]=4 1724 B8R0.22 O=CN[C@@H](CO)CCO eb8f36be4729f323a89920f2afd3da27 [0,1,1,0,0,0|2,0,0]=4 1725 B8R0.30 CC(C)(CCO)NC=O 891404ec31955bcc8f89b5b47dc12dc8 [0,1,1,0,0,0|2,0,0]=4 1726 B8R0.30 COCC(C)(C)NC=O bc842487dd6105675988088f36c24b44 [0,1,1,0,0,0|2,0,0]=4 1727 B8R0.30 CSCC(C)(C)NC=O 6a2b278b615a8d3027c03a5b693d9473 [0,1,1,0,0,0|2,0,0]=4 1728 B8R1.2 CCN1CC=CCC1 0dfc6382e2eb71bb203dc8f8c11fc3a7 [1,1,0,0,0,0|1,0,1]=4 1729 B8R1.2 CCN1CCCOC1 53af203468797a49275022682d8f1a11 [1,1,0,0,0,0|2,0,0]=4 1730 B8R1.2 CCN1CCCSC1 94ac8411443cb0a4aa7db7b3767bc109 [1,1,0,0,0,0|2,0,0]=4 1731 B8R1.2 FCN1CC=CCC1 401ca9aa2f450f72776a775dc9b905eb [1,1,0,0,0,0|1,0,1]=4 1732 B8R1.2 FCN1CCCOC1 0813b9bdd7e109f7922171400e48b2a2 [1,1,0,0,0,0|2,0,0]=4 1733 B8R1.2 FCN1CCCSC1 18b1e690d5a67e082a0e052f9650c2cd [1,1,0,0,0,0|2,0,0]=4 1734 B8R1.2 O=CN1CCCOC1 f5641b081c81baeb630a926cccc2dad9 [1,1,0,0,0,0|2,0,0]=4 1735 B8R1.2 O=CN1CCCSC1 02efafcaba189386286d3d47585eb111 [1,1,0,0,0,0|2,0,0]=4 1736 B8R1.2 O=CN1CCOCC1 477872453b181b061009dc05da1525e4 [1,1,0,0,0,0|2,0,0]=4 1737 B8R1.2 O=CN1CCSCC1 ef4056096863dc4bdb0fd1df8e6f14a0 [1,1,0,0,0,0|2,0,0]=4 1738 B8R1.2 OCN1CC=CCC1 62ece6a5f9d8ed840fd2002de05e26aa [1,1,0,0,0,0|1,0,1]=4 1739 B8R1.2 OCN1CCCOC1 5d3795378d3cf5e5400d928253cd75c6 [1,1,0,0,0,0|2,0,0]=4 1740 B8R1.2 OCN1CCCSC1 29a305b970bef8ec6ed20eb90ae3d8b0 [1,1,0,0,0,0|2,0,0]=4 1741 B8R1.1 CC1CCN(C1)C=O 802232b85eec3baa7ee60be5f84b67b5 [0,1,0,0,1,0|1,0,0]=3 1742 B8R1.1 CC1CCN(C1)CF da0970cce8482326171d63e42120fe9a [0,1,0,0,1,0|2,0,0]=4 1743 B8R1.1 CC1CCN(C1)CO 35ec454f519cadc0e2b5b2b07f513132 [0,1,0,0,1,0|1,0,1]=4 1744 B8R1.1 CCN1CCC(C1)C c5b0c6261615cc6c7323d9c48f305770 [0,1,0,0,1,0|2,0,0]=4 1745 B8R1.1 CCN1CNC(=O)C1 58009d6dfded7497e427ac45a5ff5413 [0,1,0,0,1,0|2,0,0]=4 1746 B8R1.1 CN1CCN(C1)C=O 8b7db25ff5974733ece4d3fc3a4817d7 [0,1,0,0,1,0|2,0,0]=4 1747 B8R1.1 O=C1CN(CN1)CF f13f56dc757cd85272f424d9ac53fbce [0,1,0,0,1,0|2,0,0]=4 1748 B8R1.1 O=C1CN(CN1)CO e561a9f6a1ffe109b2b8eed70763223f [0,1,0,0,1,0|2,0,0]=4 1749 B8R1.1 O=CN1CCC(C1)F 96284cdc191c7cba11f6a402b8eb117c [0,1,0,0,1,0|2,0,0]=4 1750 B8R1.1 O=CN1CCC(C1)O 36bb47eb3389f04fbd153dabfa4995ad [0,1,0,0,1,0|2,0,0]=4 1751 B8R1.1 O=CN1CC[C@@H](C1)F 008cec7e125285aba69bdec89e8d8fbf [0,1,0,0,1,0|2,0,0]=4 1752 B8R1.1 O=CN1CC[C@@H](C1)O 75171cfcb992bb0c611e45c07ca0c61c [0,1,0,0,1,0|2,0,0]=4 1753 B8R1.1 O=CN1CC[C@H](C1)F 27a4a903f78fd10dcf90e00458f77a70 [0,1,0,0,1,0|2,0,0]=4 1754 B8R1.1 O=CN1CC[C@H](C1)O 4d35040bdf5a1607b14717edf31c1dc0 [0,1,0,0,1,0|2,0,0]=4 1755 B8R1.11 CC1CCCN1C=O 3ea4d1e6647fbd09960c2c26417f1af4 [0,1,0,0,1,0|1,0,0]=3 1756 B8R1.11 CC1CCCN1CF fe20c957914c646b3b4006d1b063b75a [0,1,0,0,1,0|2,0,0]=4 1757 B8R1.11 CC1CCCN1CO 54974954fab0e072c3e5d67d217551d6 [0,1,0,0,1,0|1,0,1]=4 1758 B8R1.11 CC1SCCN1C=O a4140bf0d296ba848f3453d4bea5de05 [0,1,0,0,1,0|2,0,0]=4 1759 B8R1.11 CCN1CCCC1C 74d058d7956efbc8ae4ef590fc86d9c6 [0,1,0,0,1,0|2,0,0]=4 1760 B8R1.11 CCN1CCC[C@@H]1C 5bf7e722ced97ef7aec7490b4d0dc25a [0,1,0,0,1,0|2,0,0]=4 1761 B8R1.11 CCN1CCC[C@H]1C e74b9532535bc2eef7ae4850e9df5331 [0,1,0,0,1,0|2,0,0]=4 1762 B8R1.11 C[C@@H]1CCCN1C=O 5b11f1ed15ba14e3311dd9d4b620d01b [0,1,0,0,1,0|1,0,0]=3 1763 B8R1.11 C[C@@H]1CCCN1CF e9b99bb24d3baf133d2b2e0829d1f9dd [0,1,0,0,1,0|2,0,0]=4 1764 B8R1.11 C[C@@H]1CCCN1CO 4fcb8232d21346615f4cbb83427dc320 [0,1,0,0,1,0|1,0,1]=4 1765 B8R1.11 C[C@H]1CCCN1C=O 47ce3e99eee2f4d382d5e118e22fa773 [0,1,0,0,1,0|1,0,0]=3 1766 B8R1.11 C[C@H]1CCCN1CF dcda868098b241037a860e32aa3597cd [0,1,0,0,1,0|2,0,0]=4 1767 B8R1.11 C[C@H]1CCCN1CO 2f61618a874473c8038742f46c63e99b [0,1,0,0,1,0|1,0,1]=4 1768 B8R1.11 O=CN1CCCC1O a26ec465eebf98c295c9d7f5c4bb6e0a [0,1,0,0,1,0|2,0,0]=4 1769 B10R1.162 CC1CN(CCCO1)C=O be274abb7ce72c912adaa22ba8073355 [0,1,0,0,0,1|1,0,0]=3 1770 B10R1.162 CC1CN(CCCO1)CF 111ec24641fb870f2e6e6febf67e5152 [0,1,0,0,0,1|2,0,0]=4 1771 B10R1.162 CC1CN(CCCO1)CO 73cac2e79947b32cf514d86da741338c [0,1,0,0,0,1|1,0,1]=4 1772 B10R1.162 CCN1CCCNC(=O)C1 7f847c2e24a9fed6454900cb01e9e0cc [0,1,0,0,0,1|1,0,0]=3 1773 B10R1.162 CCN1CCCOC(C1)C 31c53a19350d83e4432907206d9fe674 [0,1,0,0,0,1|2,0,0]=4 1774 B10R1.162 O=C1CN(CCCN1)CF 0a115fd5f4a96a1ba9ac1bb388118635 [0,1,0,0,0,1|1,0,0]=3 1775 B10R1.162 O=C1CN(CCCN1)CO 927689e274c83a0f72ed7e0824cb21ad [0,1,0,0,0,1|1,0,0]=3 1776 B10R1.162 O=CN1CCCCC(C1)O 6963e9a074f606b38dce3449384cb9be [0,1,0,0,0,1|2,0,0]=4 1777 B10R1.162 O=CN1CCCC[C@H](C1)O c542bdc034425e93cfcfd6a4821f5780 [0,1,0,0,0,1|2,0,0]=4 1778 B10R1.162 O=CN1CCCNC(=O)C1 20f5771170acf328c40954a929bb7f84 [0,1,0,0,0,1|1,0,1]=4 1779 B10R1.162 O=CN1CCOCC(C1)F 70f1e81eb29d28ebef9d1dc838bc13c1 [0,1,0,0,0,1|2,0,0]=4 1780 B10R1.162 O=CN1CCOCC(C1)O 7098caae05d8c69047712a853c245d90 [0,1,0,0,0,1|2,0,0]=4 1781 B10R1.162 O=CN1CCOC[C@@H](C1)F 54447e03957eb1b7c2366dbb95f373e8 [0,1,0,0,0,1|2,0,0]=4 1782 B10R1.162 O=CN1CCOC[C@@H](C1)O bb23d83cd543c27b15bd7aa85783b522 [0,1,0,0,0,1|2,0,0]=4 1783 B10R1.162 O=CN1CCOC[C@H](C1)F fae0ce54bcd34d6d9a2a7fdaf07f7e3d [0,1,0,0,0,1|2,0,0]=4 1784 B10R1.162 O=CN1CCOC[C@H](C1)O 98b50c342e0d21392cbe335b525507df [0,1,0,0,0,1|2,0,0]=4 1785 B10R1.197 CC1CCCN(CC1)C=O 377760f9fe9460ff48ba55e169ecc323 [0,1,0,0,0,1|1,0,0]=3 1786 B10R1.197 CC1CCCN(CC1)CF c69faa64d9e9e27443cd80ee71fbc6a0 [0,1,0,0,0,1|2,0,0]=4 1787 B10R1.197 CC1CCCN(CC1)CO 2fb530ce5b31dd0445e89e58ba92e4c5 [0,1,0,0,0,1|1,0,1]=4 1788 B10R1.197 CCN1CCCC(=O)CC1 43ab575eb7387d1676c90286c1ea0c74 [0,1,0,0,0,1|1,0,0]=3 1789 B10R1.197 CCN1CCCC(CC1)C 9d7cc09ad8c203bd615d3666ca926cd9 [0,1,0,0,0,1|2,0,0]=4 1790 B10R1.197 CCN1CCNC(=O)CC1 c00fc63757fc4a565477a63f60a2605b [0,1,0,0,0,1|2,0,0]=4 1791 B10R1.197 CN1CCCN(CC1)C=O dae680ef23b42ac483237fa402772a79 [0,1,0,0,0,1|2,0,0]=4 1792 B10R1.197 O=C1CCCN(CC1)CF 7556829700c0b08f447855e4809ddc05 [0,1,0,0,0,1|1,0,0]=3 1793 B10R1.197 O=C1CCCN(CC1)CO 0872ce793b88f95873340dc0aee0cac1 [0,1,0,0,0,1|1,0,0]=3 1794 B10R1.197 O=C1CCN(CCN1)CF 8cdda5f278ebe2a58c1637f4b1f87593 [0,1,0,0,0,1|2,0,0]=4 1795 B10R1.197 O=C1CCN(CCN1)CO 2c44e19b247ace033824833e187990ab [0,1,0,0,0,1|2,0,0]=4 1796 B10R1.197 O=CN1CCCC(=O)CC1 0fc8b2e662c190f08a028f30c6fa6c0e [0,1,0,0,0,1|1,0,1]=4 1797 B10R1.197 O=CN1CCCC(CC1)F 063cb542d0437eea52ad7ed38fb65de0 [0,1,0,0,0,1|2,0,0]=4 1798 B10R1.197 O=CN1CCCC(CC1)O cb48dbbabe7a1d17ce4f711ff2fc4ea5 [0,1,0,0,0,1|2,0,0]=4 1799 B10R1.197 O=CN1CCC[C@@H](CC1)O f1679d0bd86c075edcc421e88fc1e969 [0,1,0,0,0,1|2,0,0]=4 1800 B10R1.197 O=CN1CCC[C@H](CC1)O 52e26b23698adace6455f16a782f5f0f [0,1,0,0,0,1|2,0,0]=4 1801 B10R1.2 CC1C(=O)NCCN1CF ad7f915b8728b40cf9a80b50056a191f [0,2,0,0,0,0|2,0,0]=4 1802 B10R1.2 CC1C(=O)NCCN1CO 1d2326587dd62bb9d797a4784adae78c [0,2,0,0,0,0|2,0,0]=4 1803 B10R1.2 CC1C(CCCN1C=O)O 2a1b9d864824c13b5925eaf663265aef [0,2,0,0,0,0|2,0,0]=4 1804 B10R1.2 CCN1CCNC(=O)C1C 1949861d0793b6b8ae03ec2b2a69e898 [0,2,0,0,0,0|2,0,0]=4 1805 B10R1.2 CCN1CCNC(=O)[C@@H]1C c4a51bd1554d96874590f7d4cc1487c6 [0,2,0,0,0,0|2,0,0]=4 1806 B10R1.2 CCN1CCNC(=O)[C@H]1C bcec31f94ef37df55f250b70fe9271ce [0,2,0,0,0,0|2,0,0]=4 1807 B10R1.2 C[C@@H]1C(=O)NCCN1CF 1c7bfd9add2d07a4394cd2de2ae5aa06 [0,2,0,0,0,0|2,0,0]=4 1808 B10R1.2 C[C@@H]1C(=O)NCCN1CO a15fde02f6435d45091e5f443519ce6a [0,2,0,0,0,0|2,0,0]=4 1809 B10R1.2 C[C@@H]1[C@H](CCCN1C=O)O 6d7541523fecb90672f86793cf69bd27 [0,2,0,0,0,0|2,0,0]=4 1810 B10R1.2 C[C@H]1C(=O)NCCN1CF f68399a840a57ff2b1f8833ddd189f6f [0,2,0,0,0,0|2,0,0]=4 1811 B10R1.2 C[C@H]1C(=O)NCCN1CO 3ad1956cc0b01e2d0562e9754b1e4744 [0,2,0,0,0,0|2,0,0]=4 1812 B10R1.2 C[C@H]1[C@@H](CCCN1C=O)O b9b4b3538f04b83d7d0b8cfff1133139 [0,2,0,0,0,0|2,0,0]=4 1813 B10R1.8 CC1CC(CN(C1)C=O)C 0c5df02e192146816f01ef9f9eb2ca30 [0,2,0,0,0,0|1,0,0]=3 1814 B10R1.8 CC1CC(CN(C1)CF)C 604587ca919304676a35776c39cfb9ce [0,2,0,0,0,0|2,0,0]=4 1815 B10R1.8 CC1CC(CN(C1)CO)C 36a761af0cd42626f457d58d62163cab [0,2,0,0,0,0|1,0,1]=4 1816 B10R1.8 CC1CN(CC(=O)N1)C=O 07a6bf4b6afbad14c87cb378999eac61 [0,2,0,0,0,0|2,0,0]=4 1817 B10R1.8 CC1CN(CC(=O)N1)CF 4063643aa51b19a780dceb768a3fff81 [0,2,0,0,0,0|2,0,0]=4 1818 B10R1.8 CC1CN(CC(=O)N1)CO bc1f9a608d7a59245978c9728224f84f [0,2,0,0,0,0|2,0,0]=4 1819 B10R1.8 CC1CN(CC(O1)C)C=O 9397caf673e4372befa4872e54bad84b [0,2,0,0,0,0|2,0,0]=4 1820 B10R1.8 CCN1CC(=O)NC(C1)C 58e7c13b9960d75f4ce605e135b0f2fe [0,2,0,0,0,0|2,0,0]=4 1821 B10R1.8 CCN1CC(=O)N[C@@H](C1)C 5379bedf224a2fc026d78f75a235dc04 [0,2,0,0,0,0|2,0,0]=4 1822 B10R1.8 CCN1CC(=O)N[C@H](C1)C 2ad7ca617147c06f612a58c71c71da4e [0,2,0,0,0,0|2,0,0]=4 1823 B10R1.8 CCN1CC(CC(C1)C)C 58116df5a0c9e005401cbb85555a9e4c [0,2,0,0,0,0|2,0,0]=4 1824 B10R1.8 CCN1C[C@@H](C[C@@H](C1)C)C 56df8f8f2f1ab20a1db4b638c6b3fdb9 [0,2,0,0,0,0|2,0,0]=4 1825 B10R1.8 C[C@@H]1CN(CC(=O)N1)C=O e54af1591e7fa07aa65b7b0d01afd88a [0,2,0,0,0,0|2,0,0]=4 1826 B10R1.8 C[C@@H]1CN(CC(=O)N1)CF e4f2d6ceec7a1b1c89b162bd98973bb9 [0,2,0,0,0,0|2,0,0]=4 1827 B10R1.8 C[C@@H]1CN(CC(=O)N1)CO b3b9f4e27be7e1151e9b6b9033bf6aa4 [0,2,0,0,0,0|2,0,0]=4 1828 B10R1.8 C[C@@H]1CN(C[C@@H](O1)C)C=O b6b56373ef40a15da4924b286a9de3fb [0,2,0,0,0,0|2,0,0]=4 1829 B10R1.8 C[C@@H]1CN(C[C@H](O1)C)C=O 2b773ac021ac718b3067f0968cb9f7cc [0,2,0,0,0,0|2,0,0]=4 1830 B10R1.8 C[C@@H]1C[C@@H](CN(C1)C=O)C d39d4ab7d38561cd234cdaba15fcbad2 [0,2,0,0,0,0|1,0,0]=3 1831 B10R1.8 C[C@@H]1C[C@@H](CN(C1)CF)C dbaffccb77d4e133def316fbeb98ca84 [0,2,0,0,0,0|2,0,0]=4 1832 B10R1.8 C[C@@H]1C[C@@H](CN(C1)CO)C 9a1870682326458e1c1bd3b58dcc00fa [0,2,0,0,0,0|1,0,1]=4 1833 B10R1.8 C[C@H]1CN(CC(=O)N1)C=O 4f6b3998bf21ad79f5b0a05123564157 [0,2,0,0,0,0|2,0,0]=4 1834 B10R1.8 C[C@H]1CN(CC(=O)N1)CF bc368a7e9653a101541bcb118d862511 [0,2,0,0,0,0|2,0,0]=4 1835 B10R1.8 C[C@H]1CN(CC(=O)N1)CO 67f8fd79b785d5799eedafced227c139 [0,2,0,0,0,0|2,0,0]=4 1836 B10R1.8 C[C@H]1CN(C[C@@H](O1)C)C=O 8fd682d065eaf614cf168cd310c41c10 [0,2,0,0,0,0|2,0,0]=4 1837 B10R1.8 O=CN1CC(CC(C1)O)O 31a57cc36aa0f52de1ce0ff965f759ab [0,2,0,0,0,0|2,0,0]=4 1838 B10R1.8 O=CN1C[C@@H](C[C@@H](C1)O)O 1894c7debc93308bec38ec7ee3bcbbc0 [0,2,0,0,0,0|2,0,0]=4 1839 B10R1.8 O=CN1C[C@@H](C[C@H](C1)O)O 70c13e1a82c11281e7c248fd076f0349 [0,2,0,0,0,0|2,0,0]=4 1840 B10R1.8 O=CN1C[C@H](C[C@@H](C1)O)O b18871984865aca4d1d589c9c913783d [0,2,0,0,0,0|2,0,0]=4 1841 B10R1.10 C#CCN1CCCC(=O)C1 684d48b65dafa89d3d16dcd5647d7722 [0,2,0,0,0,0|1,0,0]=3 1842 B10R1.10 C#CCN1CCCC(C1)C ff0eea99973e07574910982f516889fc [0,2,0,0,0,0|2,0,0]=4 1843 B10R1.10 C#CCN1CCC[C@@H](C1)C 9e8872ef9ae215c05ffae5a48b681067 [0,2,0,0,0,0|2,0,0]=4 1844 B10R1.10 C#CCN1CCC[C@H](C1)C f620605eaf883c3b1002d66bd1506f1a [0,2,0,0,0,0|2,0,0]=4 1845 B10R1.10 C#CCN1CCNC(=O)C1 b19572f05565e6b0cb80b1e32a563895 [0,2,0,0,0,0|2,0,0]=4 1846 B10R1.10 C#CCN1CCOC(=O)C1 a5cae80661715fdaa3c66cb1bf6434d8 [0,2,0,0,0,0|2,0,0]=4 1847 B10R1.10 C=CCN1CCCC(=O)C1 192f6b3cabea3f49d2e42174bce65436 [0,2,0,0,0,0|1,0,0]=3 1848 B10R1.10 C=CCN1CCCC(C1)C ec067262f3f4afde97dcd22b3b2f0ea0 [0,2,0,0,0,0|2,0,0]=4 1849 B10R1.10 C=CCN1CCC[C@@H](C1)C ea65ec47e239ecd79f6d4c8b23f87f01 [0,2,0,0,0,0|2,0,0]=4 1850 B10R1.10 C=CCN1CCC[C@H](C1)C c777c0295f899c88258a9ce18d129edf [0,2,0,0,0,0|2,0,0]=4 1851 B10R1.10 C=CCN1CCNC(=O)C1 22b3a1ca068e16cc4fec9674b0331fc5 [0,2,0,0,0,0|2,0,0]=4 1852 B10R1.10 C=CCN1CCOC(=O)C1 d910b016030431b1405b5ed7158eaee2 [0,2,0,0,0,0|2,0,0]=4 1853 B10R1.10 CC1=CC(CCC1)OCF c8be5b734216a5d337765aea40934a28 [0,2,0,0,0,0|1,0,1]=4 1854 B10R1.10 CC1CC(CCO1)NC=O c7bcfd7524476396c24b1f526ff5629c [0,2,0,0,0,0|1,0,1]=4 1855 B10R1.10 CC1CCCC(C1)NC=O a17cbd4e3036778885ce3068174816a1 [0,2,0,0,0,0|0,0,1]=3 1856 B10R1.10 CC1CCCC(C1)NCF 3a585411dc52b2db016103bbb5bbb45f [0,2,0,0,0,0|1,0,1]=4 1857 B10R1.10 CC1CCCC(C1)NCO 5b990827fa9fea6446790d320ee857b3 [0,2,0,0,0,0|0,0,2]=4 1858 B10R1.10 CC1CCCC(C1)OCF ee42c01f55e35e9a46ba40b0962955f9 [0,2,0,0,0,0|0,0,2]=4 1859 B10R1.10 CC1CCCN(C1)CC#N 0b31d2043449a0b19d0df217adb32111 [0,2,0,0,0,0|2,0,0]=4 1860 B10R1.10 CC1CCCN(C1)CC=O d9fa3f7f2e4956f00565cdd1d0a6c0b8 [0,2,0,0,0,0|1,0,0]=3 1861 B10R1.10 CC1CCCN(C1)CCF 07f1ab70e5952c64ca6a3962ccbba32b [0,2,0,0,0,0|2,0,0]=4 1862 B10R1.10 CC1CCCN(C1)CCO ba86102b0c87b4591c14e578dd3e6a87 [0,2,0,0,0,0|1,0,1]=4 1863 B10R1.10 CC1CCCN(C1)CCS da9f051aa6378e914840cb798ae39222 [0,2,0,0,0,0|1,1,0]=4 1864 B10R1.10 CC1CN(CCO1)CC=O 602ff319c6f01c1227f58f2744b59224 [0,2,0,0,0,0|2,0,0]=4 1865 B10R1.10 CCCN1CCCC(=O)C1 7297bca07aecf137a110922d2e01ce93 [0,2,0,0,0,0|1,0,0]=3 1866 B10R1.10 CCCN1CCCC(C1)C 10722657823b505b789ed627a8c61fd8 [0,2,0,0,0,0|2,0,0]=4 1867 B10R1.10 CCCN1CCC[C@@H](C1)C 42accd0af676748aeef95475de04bd47 [0,2,0,0,0,0|2,0,0]=4 1868 B10R1.10 CCCN1CCC[C@H](C1)C 3fdfd8108804c0fcef74b387a8d79dff [0,2,0,0,0,0|2,0,0]=4 1869 B10R1.10 CCCN1CCNC(=O)C1 d8e989a714f7948a3d5167ce4cee8b3b [0,2,0,0,0,0|2,0,0]=4 1870 B10R1.10 CCCN1CCOC(=O)C1 32566a616273931864f84b8dc9e1db89 [0,2,0,0,0,0|2,0,0]=4 1871 B10R1.10 CCNC1CCCC(C1)C 77f1f79b4adaf95ab4b9ef12620388b0 [0,2,0,0,0,0|1,0,1]=4 1872 B10R1.10 CCNC1CCCC(C1)O 113e722fc1e449e3e54ccf67b4ce78a7 [0,2,0,0,0,0|0,0,2]=4 1873 B10R1.10 CCNC1CCCN(C1)C 13e083064425b009ca1fb2ca02711930 [0,2,0,0,0,0|2,0,0]=4 1874 B10R1.10 CCNC1CCNC(=O)C1 479099502481b0bb9404cd03f14296cc [0,2,0,0,0,0|1,0,0]=3 1875 B10R1.10 CCN[C@@H]1CCCN(C1)C 33ba229c4b41f28a5913014ba225fa45 [0,2,0,0,0,0|2,0,0]=4 1876 B10R1.10 CCN[C@@H]1CCC[C@@H](C1)O 7f9bb0b6d56b12bb66d83f760d316ab1 [0,2,0,0,0,0|0,0,2]=4 1877 B10R1.10 CCN[C@@H]1CCC[C@H](C1)C b54432e71e2a2bf8bdf4246e5c24a915 [0,2,0,0,0,0|1,0,1]=4 1878 B10R1.10 CCN[C@@H]1CCC[C@H](C1)O 396290b6b5db7e9cb63a3fcf9b0c183b [0,2,0,0,0,0|0,0,2]=4 1879 B10R1.10 CCN[C@@H]1CCNC(=O)C1 9e0e4a482e7d76c713bd53a977e4018c [0,2,0,0,0,0|1,0,0]=3 1880 B10R1.10 CCN[C@H]1CCCN(C1)C b1bf2b4d750f6bfa987f4bb4ea7572fc [0,2,0,0,0,0|2,0,0]=4 1881 B10R1.10 CCN[C@H]1CCC[C@@H](C1)O 79d8666b7770f893e752839182a97ad1 [0,2,0,0,0,0|0,0,2]=4 1882 B10R1.10 CCN[C@H]1CCC[C@H](C1)O 5b66beda661cb9accdacd389931ec98f [0,2,0,0,0,0|0,0,2]=4 1883 B10R1.10 CCN[C@H]1CCNC(=O)C1 8a31d87f498d620fd6d53bbabeec5703 [0,2,0,0,0,0|1,0,0]=3 1884 B10R1.10 CCOC1C=C(CCC1)C d9eb6c6cd48b33da0c9d05cf485ca643 [0,2,0,0,0,0|1,0,1]=4 1885 B10R1.10 CCOC1CCCC(=O)C1 7694e8ef5c808ba4dfd648fc2fdd5673 [0,2,0,0,0,0|0,0,0]=2 1886 B10R1.10 CCOC1CCCC(C1)C 05d0af7621eacccee87006fe3e417b13 [0,2,0,0,0,0|0,0,2]=4 1887 B10R1.10 CCOC1CCCN(C1)C 7fac3ee0c7265cd3dee0d6def2acf995 [0,2,0,0,0,0|2,0,0]=4 1888 B10R1.10 CCOC1CCNC(=O)C1 d6924d66bc2960427a5aa83c3b834b70 [0,2,0,0,0,0|1,0,0]=3 1889 B10R1.10 CCO[C@@H]1CCCN(C1)C 8792e0ec2d00de10f4fb5369bf62dbd8 [0,2,0,0,0,0|2,0,0]=4 1890 B10R1.10 CCO[C@@H]1CCC[C@@H](C1)C ce55d21559242a12587fb793cf17f8c8 [0,2,0,0,0,0|0,0,2]=4 1891 B10R1.10 CCO[C@@H]1CCNC(=O)C1 2becd24c03a17e28797b47c03861b891 [0,2,0,0,0,0|1,0,0]=3 1892 B10R1.10 CCO[C@H]1CCCN(C1)C dc6a0d691a196305da622e2d54e468fe [0,2,0,0,0,0|2,0,0]=4 1893 B10R1.10 CCO[C@H]1CCC[C@@H](C1)C 39c7f1f81843ee831419d80230008049 [0,2,0,0,0,0|0,0,2]=4 1894 B10R1.10 CCO[C@H]1CCC[C@H](C1)C c3bbffbe08f75b723c5a87fe9bd00adc [0,2,0,0,0,0|0,0,2]=4 1895 B10R1.10 CCO[C@H]1CCNC(=O)C1 0c306295dc6c1bac8cf8e49e072469f8 [0,2,0,0,0,0|1,0,0]=3 1896 B10R1.10 CN1CCCC(C1)NCF b7a566bff5c04926b8b01d2f8cbd1b87 [0,2,0,0,0,0|2,0,0]=4 1897 B10R1.10 CN1CCCC(C1)NCO 1e183e971519c2dc5213fe5acac6cc05 [0,2,0,0,0,0|2,0,0]=4 1898 B10R1.10 CN1CCCC(C1)OCF a41355185de23693231d10dd3314a382 [0,2,0,0,0,0|2,0,0]=4 1899 B10R1.10 CN1CCC[C@@H](C1)NCF 4afaee2766dd40c676016672a9092213 [0,2,0,0,0,0|2,0,0]=4 1900 B10R1.10 CN1CCC[C@@H](C1)NCO bdf87a52d26249f4fc9d24bbec0d549e [0,2,0,0,0,0|2,0,0]=4 1901 B10R1.10 CN1CCC[C@@H](C1)OCF 7d7b78691af2225b5d9adf493e3f3f2d [0,2,0,0,0,0|2,0,0]=4 1902 B10R1.10 CN1CCC[C@H](C1)NCF 04f2d0f4979753fdcab526c0bced2186 [0,2,0,0,0,0|2,0,0]=4 1903 B10R1.10 CN1CCC[C@H](C1)NCO b7e544884840d351064557686ae9e16c [0,2,0,0,0,0|2,0,0]=4 1904 B10R1.10 CN1CCC[C@H](C1)OCF 53fb15ceeed817b2752a59cc27f9f66b [0,2,0,0,0,0|2,0,0]=4 1905 B10R1.10 COCN1CCCC(=O)C1 317af02d006d13a065b06a81b628f169 [0,2,0,0,0,0|1,0,0]=3 1906 B10R1.10 COCN1CCCC(C1)C bf093e792251e76d266715ec7ee91176 [0,2,0,0,0,0|1,0,1]=4 1907 B10R1.10 COCN1CCC[C@@H](C1)C 72fbfd2caaa53b791baf65dd33123752 [0,2,0,0,0,0|1,0,1]=4 1908 B10R1.10 COCN1CCC[C@H](C1)C 1fd53d060a3d6cc4e6de7c2e95d473bd [0,2,0,0,0,0|1,0,1]=4 1909 B10R1.10 COCN1CCNC(=O)C1 0892f7e22849799e71988f53c756f8c5 [0,2,0,0,0,0|2,0,0]=4 1910 B10R1.10 COCN1CCOC(=O)C1 1f678b780528d8dd6ae8707466e83f96 [0,2,0,0,0,0|2,0,0]=4 1911 B10R1.10 CSCN1CCCC(=O)C1 b21514babe8d2894f6c60bd55dd61e0c [0,2,0,0,0,0|1,0,0]=3 1912 B10R1.10 CSCN1CCCC(C1)C 0545220da235ed7795d52ddb8115f21a [0,2,0,0,0,0|1,1,0]=4 1913 B10R1.10 CSCN1CCC[C@@H](C1)C 67b032cfcdc1fc66c546f24b26cab6cb [0,2,0,0,0,0|1,1,0]=4 1914 B10R1.10 CSCN1CCC[C@H](C1)C 3de2f4f0e3143be827bcc0b058d92530 [0,2,0,0,0,0|1,1,0]=4 1915 B10R1.10 CSCN1CCNC(=O)C1 9bc3cc3b232fae45ace382828b90121d [0,2,0,0,0,0|2,0,0]=4 1916 B10R1.10 CSCN1CCOC(=O)C1 ba931a4611f1eae2ed2dcd6a30007c61 [0,2,0,0,0,0|2,0,0]=4 1917 B10R1.10 C[C@@H]1CCCN(C1)CC#N 94212a44e9178f45dbe9b16bb7011367 [0,2,0,0,0,0|2,0,0]=4 1918 B10R1.10 C[C@@H]1CCCN(C1)CC=O b86b114d3af9a694a07458e5e4aa562b [0,2,0,0,0,0|1,0,0]=3 1919 B10R1.10 C[C@@H]1CCCN(C1)CCF c34730d3046e5ad339abc9d6bca688de [0,2,0,0,0,0|2,0,0]=4 1920 B10R1.10 C[C@@H]1CCCN(C1)CCO 390fd7e427ef0d2b45fad2f3fb4e7e58 [0,2,0,0,0,0|1,0,1]=4 1921 B10R1.10 C[C@@H]1CCCN(C1)CCS fc1b84c551af8d5911a98cd83aa2d664 [0,2,0,0,0,0|1,1,0]=4 1922 B10R1.10 C[C@@H]1CCC[C@@H](C1)OCF 81bb9715deaae3cbc92a9e1504fe0c1c [0,2,0,0,0,0|0,0,2]=4 1923 B10R1.10 C[C@@H]1CCC[C@H](C1)NC=O 6f39176ec4d5e01852d746d6dbd970d4 [0,2,0,0,0,0|0,0,1]=3 1924 B10R1.10 C[C@@H]1CCC[C@H](C1)NCF 40b2f07b0b83e2e23e28dfa98670612b [0,2,0,0,0,0|1,0,1]=4 1925 B10R1.10 C[C@@H]1CCC[C@H](C1)NCO 0141010beb818bcf4396f3fc169829fc [0,2,0,0,0,0|0,0,2]=4 1926 B10R1.10 C[C@@H]1CN(CCO1)CC=O dbfc8abfec2d8df0b3bb264d1bb4ed4b [0,2,0,0,0,0|2,0,0]=4 1927 B10R1.10 C[C@@H]1C[C@@H](CCO1)NC=O e664930704097e37968ab84b33ff0ada [0,2,0,0,0,0|1,0,1]=4 1928 B10R1.10 C[C@@H]1C[C@H](CCO1)NC=O a06ca4084ced461924de5f48b6f078f6 [0,2,0,0,0,0|1,0,1]=4 1929 B10R1.10 C[C@H]1CCCN(C1)CC#N c4798d3b1ce0eabf262a9e8f8cd93ee6 [0,2,0,0,0,0|2,0,0]=4 1930 B10R1.10 C[C@H]1CCCN(C1)CC=O 162c9ac6ba03ec25d91f62b0932e7148 [0,2,0,0,0,0|1,0,0]=3 1931 B10R1.10 C[C@H]1CCCN(C1)CCF 770f123ff90042b696e8901301ff4327 [0,2,0,0,0,0|2,0,0]=4 1932 B10R1.10 C[C@H]1CCCN(C1)CCO a9b661232e7064900663e6084314cf02 [0,2,0,0,0,0|1,0,1]=4 1933 B10R1.10 C[C@H]1CCCN(C1)CCS d139348d43f1f80bd71c5a0f33936d5c [0,2,0,0,0,0|1,1,0]=4 1934 B10R1.10 C[C@H]1CCC[C@@H](C1)OCF bbbcaf6195e1239bf9227a22fb623886 [0,2,0,0,0,0|0,0,2]=4 1935 B10R1.10 C[C@H]1CCC[C@H](C1)OCF 36d2c58f8018d103e578ffcb512be0bc [0,2,0,0,0,0|0,0,2]=4 1936 B10R1.10 C[C@H]1CN(CCO1)CC=O 3d530be17fda5edbf2fd89f82505a5a8 [0,2,0,0,0,0|2,0,0]=4 1937 B10R1.10 C[C@H]1C[C@@H](CCO1)NC=O fa37c8a57a26750c8e7f06650d6f57c0 [0,2,0,0,0,0|1,0,1]=4 1938 B10R1.10 C[C@H]1C[C@H](CCO1)NC=O 0f313ccbd6319e50063f96e2171144bf [0,2,0,0,0,0|1,0,1]=4 1939 B10R1.10 N#CCN1CCCC(=O)C1 dec323a4c16346928c9aae6a05b41122 [0,2,0,0,0,0|1,0,0]=3 1940 B10R1.10 N#CCN1CCNC(=O)C1 4f7f8928ce2268ca88ef9d03597ad01d [0,2,0,0,0,0|2,0,0]=4 1941 B10R1.10 N#CCN1CCOC(=O)C1 86b7f0d54f085380de4aabd736db34af [0,2,0,0,0,0|2,0,0]=4 1942 B10R1.10 N#CNC1CCCC(=O)C1 d3ac761c3d678de3726d8d9c23bfae03 [0,2,0,0,0,0|0,0,1]=3 1943 B10R1.10 O=C1CC(CCN1)NCF 7a835b4abf83f642783dfd9a0c32e6ca [0,2,0,0,0,0|1,0,0]=3 1944 B10R1.10 O=C1CC(CCN1)NCO 0c7374984516c1745cd09de8ffda0fa2 [0,2,0,0,0,0|1,0,0]=3 1945 B10R1.10 O=C1CC(CCN1)OCF c12a2223dbd89b7f0cb18c0ed6ec81a9 [0,2,0,0,0,0|1,0,0]=3 1946 B10R1.10 O=C1CCCC(C1)OCF 3ef4074d9d8cde512776f61233cdd122 [0,2,0,0,0,0|0,0,0]=2 1947 B10R1.10 O=C1CCCN(C1)CCF df6897b009456e691cbb1a32e848f708 [0,2,0,0,0,0|1,0,0]=3 1948 B10R1.10 O=C1CCCN(C1)CCO 6865bbc1bbed842c379aefac569dc87d [0,2,0,0,0,0|1,0,0]=3 1949 B10R1.10 O=C1CCCN(C1)CCS d9f8fccd11178e50e7151700008525ca [0,2,0,0,0,0|1,0,0]=3 1950 B10R1.10 O=C1CN(CCN1)CCF 4943683fff8d57ebc360fe8404e45069 [0,2,0,0,0,0|2,0,0]=4 1951 B10R1.10 O=C1CN(CCN1)CCO 850c29d0618d59b5858f2d77130624fd [0,2,0,0,0,0|2,0,0]=4 1952 B10R1.10 O=C1CN(CCN1)CCS 20dc1af2f69af1dddf962f1fd573bbef [0,2,0,0,0,0|2,0,0]=4 1953 B10R1.10 O=C1CN(CCO1)CCF 3203cb1562e696348ba1ee3b691431ea [0,2,0,0,0,0|2,0,0]=4 1954 B10R1.10 O=C1CN(CCO1)CCO b61cc9af051cfe4ea23a0c44d1e79e3f [0,2,0,0,0,0|2,0,0]=4 1955 B10R1.10 O=C1CN(CCO1)CCS 51d95f2a46cf96d74a6eaef127922c9e [0,2,0,0,0,0|2,0,0]=4 1956 B10R1.10 O=C1C[C@@H](CCN1)NCF 67dcb02258bac1102d9f8ea8db5c0c56 [0,2,0,0,0,0|1,0,0]=3 1957 B10R1.10 O=C1C[C@@H](CCN1)NCO a831a67bdc955e2a763b21021344b657 [0,2,0,0,0,0|1,0,0]=3 1958 B10R1.10 O=C1C[C@@H](CCN1)OCF ed4ec2cbc87e456ae7136ca9bef968de [0,2,0,0,0,0|1,0,0]=3 1959 B10R1.10 O=C1C[C@H](CCN1)NCF ca7227f1c557ff36ec212435e80ef895 [0,2,0,0,0,0|1,0,0]=3 1960 B10R1.10 O=C1C[C@H](CCN1)NCO f45cbe6c410fbb15683f964fb87dfefb [0,2,0,0,0,0|1,0,0]=3 1961 B10R1.10 O=C1C[C@H](CCN1)OCF 06af1737e897ce607d618daa23e70335 [0,2,0,0,0,0|1,0,0]=3 1962 B10R1.10 O=CCN1CCCC(=O)C1 c4b9600e4614d8322ef72d868498cfe4 [0,2,0,0,0,0|1,0,0]=3 1963 B10R1.10 O=CCN1CCCC(C1)F 5dc7e1b75d75755d41eac602ca32cceb [0,2,0,0,0,0|2,0,0]=4 1964 B10R1.10 O=CCN1CCCC(C1)O 8254680454cd1053f35d938e118c657f [0,2,0,0,0,0|2,0,0]=4 1965 B10R1.10 O=CCN1CCC[C@@H](C1)F 8d9fd0d39761ef0663af46cedcecde03 [0,2,0,0,0,0|2,0,0]=4 1966 B10R1.10 O=CCN1CCC[C@@H](C1)O 573838c28f87425f300a1f5d52196fde [0,2,0,0,0,0|2,0,0]=4 1967 B10R1.10 O=CCN1CCC[C@H](C1)F b4a4b47977f583ffdbfce59e9e25fbcd [0,2,0,0,0,0|2,0,0]=4 1968 B10R1.10 O=CCN1CCC[C@H](C1)O 1471afae81ffc2f8a2808598eede4d50 [0,2,0,0,0,0|2,0,0]=4 1969 B10R1.10 O=CCN1CCNC(=O)C1 1eb29f89f47ca82546c13bc4af9377ee [0,2,0,0,0,0|2,0,0]=4 1970 B10R1.10 O=CCN1CCOC(=O)C1 908d3b7fdac7f8878edfb01069b9e710 [0,2,0,0,0,0|2,0,0]=4 1971 B10R1.10 O=CNC1CCCC(C1)O be289b67b44feff11a16be8f83687208 [0,2,0,0,0,0|1,0,1]=4 1972 B10R1.10 O=CNC1CCNC(=O)C1 d47a9ff12078ea45926ce99e6dc19669 [0,2,0,0,0,0|1,0,1]=4 1973 B10R1.10 O=CN[C@@H]1CCC[C@@H](C1)O 80de9e33010ceb3e9e383f0de5dd8037 [0,2,0,0,0,0|1,0,1]=4 1974 B10R1.10 O=CN[C@@H]1CCC[C@H](C1)O 0a4e567a3dea037b8cbf40b1b45f85a9 [0,2,0,0,0,0|1,0,1]=4 1975 B10R1.10 O=CN[C@@H]1CCNC(=O)C1 939e0de9e707ac9fd7ff5b73a3d70f40 [0,2,0,0,0,0|1,0,1]=4 1976 B10R1.10 O=CN[C@H]1CCC[C@@H](C1)O 194e997088c52158a934d22d39f37a2a [0,2,0,0,0,0|1,0,1]=4 1977 B10R1.10 O=CN[C@H]1CCC[C@H](C1)O 8faf5308afd82ed307b9535e7d0477e8 [0,2,0,0,0,0|1,0,1]=4 1978 B10R1.10 O=CN[C@H]1CCNC(=O)C1 352532a44c9585014214a6f948f5ade2 [0,2,0,0,0,0|1,0,1]=4 1979 B10R1.10 OC1CCCC(C1)NCF 8a745a6d70ab94cc540c9679db0a760c [0,2,0,0,0,0|0,0,2]=4 1980 B10R1.10 OCNC1CCCC(C1)O c242f1fcf5b733230ae6c14c936017b4 [0,2,0,0,0,0|0,0,2]=4 1981 B10R1.10 OCN[C@@H]1CCC[C@@H](C1)O 2715cc509d59e00e7158a0f3effd79e5 [0,2,0,0,0,0|0,0,2]=4 1982 B10R1.10 OCN[C@@H]1CCC[C@H](C1)O 29b5d367f68c7c22f2925e4a466996a0 [0,2,0,0,0,0|0,0,2]=4 1983 B10R1.10 OCN[C@H]1CCC[C@@H](C1)O 725152d27935eb8ad0a4918c5ba21ba4 [0,2,0,0,0,0|0,0,2]=4 1984 B10R1.10 OCN[C@H]1CCC[C@H](C1)O c77145f28c5be1778489ce317c2759c7 [0,2,0,0,0,0|0,0,2]=4 1985 B10R1.10 O[C@@H]1CCC[C@@H](C1)NCF 6a7c7b5690f770f5f6e1688d5c0c73d4 [0,2,0,0,0,0|0,0,2]=4 1986 B10R1.10 O[C@@H]1CCC[C@H](C1)NCF 70fad0b4c77fcbd7d0261473720fb421 [0,2,0,0,0,0|0,0,2]=4 1987 B10R1.10 O[C@H]1CCC[C@@H](C1)NCF 10ddf1c30cda850d1b9feb2799bb9d2f [0,2,0,0,0,0|0,0,2]=4 1988 B10R1.10 O[C@H]1CCC[C@H](C1)NCF 5f97eb2e97a969091f1ed985f89dfa4c [0,2,0,0,0,0|0,0,2]=4 1989 B10R1.30 CC1CCC(CN1C=O)O 7b005dd5eef9df2edfa5eb5e1ac782fd [0,2,0,0,0,0|2,0,0]=4 1990 B10R1.30 CC1CN(C(CO1)C)C=O 4bd196d8b826302d59a3529dbfbd9ba4 [0,2,0,0,0,0|2,0,0]=4 1991 B10R1.30 CC1CNC(=O)CN1CF a3ba8e8aefb2e8acd180d5c6f79af42b [0,2,0,0,0,0|2,0,0]=4 1992 B10R1.30 CC1CNC(=O)CN1CO a54211f72aaefd0609bc79e34369380b [0,2,0,0,0,0|2,0,0]=4 1993 B10R1.30 CCN1CC(=O)NCC1C 5d3ef9320a404fa74540da48e92ed823 [0,2,0,0,0,0|2,0,0]=4 1994 B10R1.30 CCN1CC(=O)NC[C@@H]1C 801e297755e1037bac07c3c33e73eb5c [0,2,0,0,0,0|2,0,0]=4 1995 B10R1.30 CCN1CC(=O)NC[C@H]1C 3a77f88312708bef1a80d56339b93d2a [0,2,0,0,0,0|2,0,0]=4 1996 B10R1.30 C[C@@H]1CC[C@H](CN1C=O)O afd6f269a6e3407d07512f25baf71ffe [0,2,0,0,0,0|2,0,0]=4 1997 B10R1.30 C[C@@H]1CN([C@@H](CO1)C)C=O a49368416a591c3163ae84fb03aad8cc [0,2,0,0,0,0|2,0,0]=4 1998 B10R1.30 C[C@@H]1CN([C@H](CO1)C)C=O 749a94077d28509b4eda9cfb756d4ef5 [0,2,0,0,0,0|2,0,0]=4 1999 B10R1.30 C[C@@H]1CNC(=O)CN1CF 5d8aa0b761ab286941a9bf7d1b24df6e [0,2,0,0,0,0|2,0,0]=4 2000 B10R1.30 C[C@@H]1CNC(=O)CN1CO 221603aa183e124e7a2955d9bccb9606 [0,2,0,0,0,0|2,0,0]=4 2001 B10R1.30 C[C@@H]1CO[C@H](CN1C=O)C 65b8f31fd78ba1789b7b99b9c6672438 [0,2,0,0,0,0|2,0,0]=4 2002 B10R1.30 C[C@H]1CN([C@H](CO1)C)C=O b452e84e2d6687fa0f0f06d1a042e231 [0,2,0,0,0,0|2,0,0]=4 2003 B10R1.30 C[C@H]1CNC(=O)CN1CF 8319d0ada51439d392bfd349b5691d97 [0,2,0,0,0,0|2,0,0]=4 2004 B10R1.30 C[C@H]1CNC(=O)CN1CO f630e990b0dbe79f9b144c8cacc85dcd [0,2,0,0,0,0|2,0,0]=4 2005 B10R1.113 CC(=O)N1CCCC(=O)C1 99ed04f0f8f0c457aeb4f4aaf4f20d81 [0,2,0,0,0,0|1,0,0]=3 2006 B10R1.113 CC(=O)N1CCCC(C1)C 0e9a46771d1161daa776ff1d4221f7fe [0,2,0,0,0,0|1,0,0]=3 2007 B10R1.113 CC(=O)N1CCCC(C1)F ecfd90044ded717974c316fb37c4acae [0,2,0,0,0,0|2,0,0]=4 2008 B10R1.113 CC(=O)N1CCCC(C1)O ee540cedaa1a73223284cbbba0d7cd09 [0,2,0,0,0,0|2,0,0]=4 2009 B10R1.113 CC(=O)N1CCC[C@@H](C1)C b765ed1c62124058c9e1d3ef1c7b9e7a [0,2,0,0,0,0|1,0,0]=3 2010 B10R1.113 CC(=O)N1CCC[C@@H](C1)F 8eefb09c059e9a4a8a9ca29f030a2153 [0,2,0,0,0,0|2,0,0]=4 2011 B10R1.113 CC(=O)N1CCC[C@@H](C1)O 7fdf4d521b5ee53ca37891b5a4dd6495 [0,2,0,0,0,0|2,0,0]=4 2012 B10R1.113 CC(=O)N1CCC[C@H](C1)C 69b5ef44bfcf1188d639c1f277bb097d [0,2,0,0,0,0|1,0,0]=3 2013 B10R1.113 CC(=O)N1CCC[C@H](C1)F 7833fe84784a72fa516bed041bd9bac2 [0,2,0,0,0,0|2,0,0]=4 2014 B10R1.113 CC(=O)N1CCC[C@H](C1)O 45f5d9af1194bdf7e75f97a0993057a0 [0,2,0,0,0,0|2,0,0]=4 2015 B10R1.113 CC(=O)N1CCNC(=O)C1 217671aad9b9eb791a5952ae6818e660 [0,2,0,0,0,0|2,0,0]=4 2016 B10R1.113 CC(=O)N1CCOC(=O)C1 16b698f5541e2d821d5802509ff4d672 [0,2,0,0,0,0|2,0,0]=4 2017 B10R1.113 CC(=O)N1CCOC(C1)C 2b7fd14b8d30a5a11b2e13ef0a74a0cd [0,2,0,0,0,0|2,0,0]=4 2018 B10R1.113 CC(=O)N1CCO[C@@H](C1)C 5da3f6f4fd12dc4ae6d56debd02449c5 [0,2,0,0,0,0|2,0,0]=4 2019 B10R1.113 CC(=O)N1CCO[C@H](C1)C b8b08f92cddab8fa4532c89b84685382 [0,2,0,0,0,0|2,0,0]=4 2020 B10R1.113 CC(C)N1CCCC(=O)C1 68d41201ab078f64eb64f8bf262cabc1 [0,2,0,0,0,0|1,0,0]=3 2021 B10R1.113 CC(C)N1CCC[C@@H](C1)C 0ce149c7d91515458b7f8878a76df29c [0,2,0,0,0,0|2,0,0]=4 2022 B10R1.113 CC(C)N1CCC[C@H](C1)C d98e6d982dec1f92b044dd55dd40bf40 [0,2,0,0,0,0|2,0,0]=4 2023 B10R1.113 CC(C)N1CCNC(=O)C1 4cbfb834f301ca15ca9d3d9f621d8746 [0,2,0,0,0,0|2,0,0]=4 2024 B10R1.113 CC(C)N1CCOC(=O)C1 8aa7e803f7ef2f776de242d3abd6b117 [0,2,0,0,0,0|2,0,0]=4 2025 B10R1.113 CC1CCCN(C1)C(C)C 48f987625da4ac866352b14cd92f696f [0,2,0,0,0,0|2,0,0]=4 2026 B10R1.171 CC1(CCCN(C1)C=O)C 5754a7e7c93728818de7a81ccc20d1b3 [0,2,0,0,0,0|1,0,0]=3 2027 B10R1.171 CC1(CCCN(C1)C=O)O 4139709d265c5ba3a89f5053e6d827b0 [0,2,0,0,0,0|1,0,0]=3 2028 B10R1.171 CC1(CCCN(C1)CF)C 02e67538c21d9062e8c5b93fbd5ee597 [0,2,0,0,0,0|2,0,0]=4 2029 B10R1.171 CC1(CCCN(C1)CF)O 3bcb1ec59ed5b39f5d373d15fbb442e3 [0,2,0,0,0,0|2,0,0]=4 2030 B10R1.171 CC1(CCCN(C1)CO)C 4a0eaacabe1849c0e13e897f14166532 [0,2,0,0,0,0|1,0,1]=4 2031 B10R1.171 CC1(CCCN(C1)CO)O 8025c3f425b909daca77ac4ffb51d7e4 [0,2,0,0,0,0|1,0,1]=4 2032 B10R1.171 CC1(CN(CCO1)C=O)C 991226255b9df449c5cb7a0d0a18c0e8 [0,2,0,0,0,0|2,0,0]=4 2033 B10R1.171 CCN1CCCC(C1)(C)C 306b807388cc6c1e65d2be4c41b72519 [0,2,0,0,0,0|2,0,0]=4 2034 B10R1.171 CCN1CCCC(C1)(C)O 612ed16d21d02b7a39faf13392cce03b [0,2,0,0,0,0|2,0,0]=4 2035 B10R1.171 CCN1CCC[C@@](C1)(C)O 45b98b3ed8af289ccb27046270ece494 [0,2,0,0,0,0|2,0,0]=4 2036 B10R1.171 CCN1CCC[C@](C1)(C)O 187d6f983c5289ffcd24b2f67dc96915 [0,2,0,0,0,0|2,0,0]=4 2037 B10R1.171 C[C@@]1(CCCN(C1)C=O)O d68eab3d9fdee30a7134b5d7a6d4df3b [0,2,0,0,0,0|1,0,0]=3 2038 B10R1.171 C[C@@]1(CCCN(C1)CF)O 75f3df91b0f2ea5ef743be82eacb4a73 [0,2,0,0,0,0|2,0,0]=4 2039 B10R1.171 C[C@@]1(CCCN(C1)CO)O a74b458b3f6814d749514a8a45fafbc5 [0,2,0,0,0,0|1,0,1]=4 2040 B10R1.171 C[C@]1(CCCN(C1)C=O)O 9a79cdb7bca8732469e9dbf227d70fc1 [0,2,0,0,0,0|1,0,0]=3 2041 B10R1.171 C[C@]1(CCCN(C1)CF)O 3c6345078116cf2f0d78176936d44a69 [0,2,0,0,0,0|2,0,0]=4 2042 B10R1.171 C[C@]1(CCCN(C1)CO)O 5da6c7d6d5b55d1d31e6c0a5f468ec8c [0,2,0,0,0,0|1,0,1]=4 2043 B10R1.171 O=CN1CCCC(C1)(F)F d5133f82b2ac1d616b12007c04cb618c [0,2,0,0,0,0|2,0,0]=4 2044 B10R1.172 C#CC1CCCN(C1)C=O a2a52cca6755cbd284967ceae258cf20 [0,2,0,0,0,0|1,0,1]=4 2045 B10R1.172 CCC1CCCN(C1)C=O ebb5f49a23f9ba47a405491329eb8ec3 [0,2,0,0,0,0|1,0,0]=3 2046 B10R1.172 CCC1CCCN(C1)CC 67c05aafcfa3d3cf07698e15bf34fccd [0,2,0,0,0,0|2,0,0]=4 2047 B10R1.172 CCC1CCCN(C1)CF 2970aac1148e817f8b52224941abd01b [0,2,0,0,0,0|2,0,0]=4 2048 B10R1.172 CCC1CCCN(C1)CO 51047d936112b9100f77771ef3e65c88 [0,2,0,0,0,0|1,0,1]=4 2049 B10R1.172 CCC1CN(CCO1)C=O f8018d8cfb7077bc6b9f0e5e7372167c [0,2,0,0,0,0|2,0,0]=4 2050 B10R1.172 CCN1CCCC(C1)CO e28961560029b2d16edf5d16a11fc80a [0,2,0,0,0,0|2,0,0]=4 2051 B10R1.172 CCN1CCCC(C1)OC 1a5a6f037876af791002db223edd942f [0,2,0,0,0,0|2,0,0]=4 2052 B10R1.172 CCN1CCC[C@@H](C1)CO 37d72bf8907adb4bf6aac4d4f7fab023 [0,2,0,0,0,0|2,0,0]=4 2053 B10R1.172 CCN1CCC[C@@H](C1)OC 21806eef8a2b5176551886d532047029 [0,2,0,0,0,0|2,0,0]=4 2054 B10R1.172 CCN1CCC[C@H](C1)CO e07058baf3367524331c8527ed000824 [0,2,0,0,0,0|2,0,0]=4 2055 B10R1.172 CCN1CCC[C@H](C1)OC 14b7fa9c141d0b0057c9ff1c10466190 [0,2,0,0,0,0|2,0,0]=4 2056 B10R1.172 CC[C@@H]1CN(CCO1)C=O 390e2095dd36170fb72a7d5cd264e7ae [0,2,0,0,0,0|2,0,0]=4 2057 B10R1.172 CC[C@H]1CN(CCO1)C=O 8da636dfeeee1570cf8c01c0814bfb71 [0,2,0,0,0,0|2,0,0]=4 2058 B10R1.172 COC1CCCN(C1)C=O 80a959e1c2efc6f23dedd1932f1dcd6d [0,2,0,0,0,0|1,0,0]=3 2059 B10R1.172 COC1CCCN(C1)CF 841d8d69a0a5466abe20b38e14067324 [0,2,0,0,0,0|2,0,0]=4 2060 B10R1.172 COC1CCCN(C1)CO 2e7b847c8da2ff2142c9d462dc614b6d [0,2,0,0,0,0|1,0,1]=4 2061 B10R1.172 CO[C@@H]1CCCN(C1)C=O 2ab3c028b04f24329a50af0b00160664 [0,2,0,0,0,0|1,0,0]=3 2062 B10R1.172 CO[C@@H]1CCCN(C1)CF f2b058778d2e5368c2b9396f35a88090 [0,2,0,0,0,0|2,0,0]=4 2063 B10R1.172 CO[C@@H]1CCCN(C1)CO f232f915ba18c5b0a96f09abe5bb6876 [0,2,0,0,0,0|1,0,1]=4 2064 B10R1.172 CO[C@H]1CCCN(C1)C=O 0d0fe13862db3a99303868adf81624f7 [0,2,0,0,0,0|1,0,0]=3 2065 B10R1.172 CO[C@H]1CCCN(C1)CF 4ce8a32c9cb1f46891a0b9f67b53b059 [0,2,0,0,0,0|2,0,0]=4 2066 B10R1.172 CO[C@H]1CCCN(C1)CO 0f29e815fc94444c24d33138d54f7ea4 [0,2,0,0,0,0|1,0,1]=4 2067 B10R1.172 N#CC1CCCN(C1)C=O ee5d57cf13e43ca80d40bd86032f4b73 [0,2,0,0,0,0|1,0,1]=4 2068 B10R1.172 N#C[C@@H]1CCCN(C1)C=O 1f74f5db43870fd53159cf9935b87ec8 [0,2,0,0,0,0|1,0,1]=4 2069 B10R1.172 O=CN1CCCC(C1)CO e018e125acbd02f7ec52656e0f5f6cf0 [0,2,0,0,0,0|1,0,0]=3 2070 B10R1.172 O=CN1CCC[C@@H](C1)CO 2dd87be154f33d8c4064a366fa6de983 [0,2,0,0,0,0|1,0,0]=3 2071 B10R1.172 O=CN1CCC[C@H](C1)CO 8a9bdff0624156c45228762999f26961 [0,2,0,0,0,0|1,0,0]=3 2072 B10R1.172 O=CN1CCOC(C1)CCl b3b7a2bd1914329415afb4de19040df9 [0,2,0,0,0,0|2,0,0]=4 2073 B10R1.172 O=CN1CCOC(C1)CO aa1d1b5fadfecc55ae371eed87c07c9e [0,2,0,0,0,0|2,0,0]=4 2074 B10R1.172 O=CN1CCO[C@@H](C1)CO 456a5915a2cfcdcab2a3c73cf07037a5 [0,2,0,0,0,0|2,0,0]=4 2075 B10R1.172 O=CN1CCO[C@H](C1)CO 9f0d79bfc8523ec6f4bdfc666030ee13 [0,2,0,0,0,0|2,0,0]=4 2076 B10R1.172 OCC1CCCN(C1)CF 92bb7fb25f174d3605a60348ef9560eb [0,2,0,0,0,0|2,0,0]=4 2077 B10R1.172 OCC1CCCN(C1)CO 199821c49a0e7dfe22fa1c2447bdfad2 [0,2,0,0,0,0|1,0,1]=4 2078 B10R1.172 OC[C@@H]1CCCN(C1)CF 8094f366c130da28b2bce8a914a4f4f7 [0,2,0,0,0,0|2,0,0]=4 2079 B10R1.172 OC[C@@H]1CCCN(C1)CO 144bcb1dbed57b513552e4650de93ddc [0,2,0,0,0,0|1,0,1]=4 2080 B10R1.172 OC[C@H]1CCCN(C1)CF 59fd8e10602a423d2dcf5be3ac9543e9 [0,2,0,0,0,0|2,0,0]=4 2081 B10R1.172 OC[C@H]1CCCN(C1)CO 57948800f69acf31bac9dbabaeb41047 [0,2,0,0,0,0|1,0,1]=4 2082 B10R1.176 CC1CCN(CC1O)C=O d5f48301a87769511e2a5cfb323fec6d [0,2,0,0,0,0|2,0,0]=4 2083 B10R1.176 CC1CN(CCC1=O)C=O 7130d3f5a4ed9ab24fda18b098db4539 [0,2,0,0,0,0|1,0,1]=4 2084 B10R1.176 CC1CN(CCC1O)C=O 4595f1e35c69e74c1ad9d41eab5effe7 [0,2,0,0,0,0|1,0,0]=3 2085 B10R1.176 CC1CN(CCC1O)CF 3ad9b496ac17a2d66ff648fc41374e17 [0,2,0,0,0,0|2,0,0]=4 2086 B10R1.176 CC1CN(CCC1O)CO cd84d54734c77090a11af4f16a380b11 [0,2,0,0,0,0|1,0,1]=4 2087 B10R1.176 CC1CN(CCN1C)C=O d4515784c5a5a7ed26de6548adf07eb9 [0,2,0,0,0,0|2,0,0]=4 2088 B10R1.176 CCN1CCC(C(C1)C)O 4105d29e0d82d093021b830abceb004b [0,2,0,0,0,0|2,0,0]=4 2089 B10R1.176 CCN1CCN(C(=O)C1)C c3a1966f022f109770c05e110e5e7769 [0,2,0,0,0,0|2,0,0]=4 2090 B10R1.176 CCN1CC[C@H]([C@@H](C1)C)O 6af99498332585a1f30c67391df73ab6 [0,2,0,0,0,0|2,0,0]=4 2091 B10R1.176 CCN1CC[C@H]([C@H](C1)C)O 65400182734da3a5f12a92447c8f68f4 [0,2,0,0,0,0|2,0,0]=4 2092 B10R1.176 CN1CCN(CC1=O)CF 7854ee94f1b07c30cb232bcff264f03e [0,2,0,0,0,0|2,0,0]=4 2093 B10R1.176 CN1CCN(CC1=O)CO f31566ecaac09e24866ef2cec551dc08 [0,2,0,0,0,0|2,0,0]=4 2094 B10R1.176 C[C@@H]1CCN(C[C@@H]1O)C=O 5c05d1905416723ded5c27a877a60d26 [0,2,0,0,0,0|2,0,0]=4 2095 B10R1.176 C[C@@H]1CCN(C[C@H]1O)C=O 6fbbe27cfdd366fc29bd762ca5d56bb3 [0,2,0,0,0,0|2,0,0]=4 2096 B10R1.176 C[C@@H]1CN(CCN1C)C=O 82ab8ab38aa87cc4fbf2905ef0e851a3 [0,2,0,0,0,0|2,0,0]=4 2097 B10R1.176 C[C@@H]1CN(CC[C@H]1O)C=O b4085edf87586a0e1dc0ffc7bd57480d [0,2,0,0,0,0|1,0,0]=3 2098 B10R1.176 C[C@@H]1CN(CC[C@H]1O)CF 06af0d8bf8594590161d814faf2afbb5 [0,2,0,0,0,0|2,0,0]=4 2099 B10R1.176 C[C@@H]1CN(CC[C@H]1O)CO f8ccd3b93e4cdd5a8f463195e7ac7885 [0,2,0,0,0,0|1,0,1]=4 2100 B10R1.176 C[C@H]1CCN(C[C@@H]1O)C=O e449325255df37632a68e029ef16c8b7 [0,2,0,0,0,0|2,0,0]=4 2101 B10R1.176 C[C@H]1CCN(C[C@H]1O)C=O 6636344910345cf4445cbbd06d804ffe [0,2,0,0,0,0|2,0,0]=4 2102 B10R1.176 C[C@H]1CN(CCN1C)C=O 79ecd9356d77dd6e349fa0b5e9108dc8 [0,2,0,0,0,0|2,0,0]=4 2103 B10R1.176 C[C@H]1CN(CC[C@H]1O)C=O f94d8bd6f3ceee32551e6a3c2b186d51 [0,2,0,0,0,0|1,0,0]=3 2104 B10R1.176 C[C@H]1CN(CC[C@H]1O)CF adb28513792a099f8b7a1ed960945e14 [0,2,0,0,0,0|2,0,0]=4 2105 B10R1.176 C[C@H]1CN(CC[C@H]1O)CO a4ed0c487d7c403dcb1709fbcc4de7a3 [0,2,0,0,0,0|1,0,1]=4 2106 B10R1.176 O=CN1CC[C@@H]([C@H](C1)O)O 20d75aa3c112f2b9dba4fc06d3f3d4e5 [0,2,0,0,0,0|2,0,0]=4 2107 B10R1.176 O=CN1CC[C@H]([C@@H](C1)F)O 3e8f6f838abfbbd73b8bebd41624ef03 [0,2,0,0,0,0|2,0,0]=4 2108 B10R1.176 O=CN1CC[C@H]([C@@H](C1)O)F eecc9eae4feefdbe5b5c836d82282826 [0,2,0,0,0,0|2,0,0]=4 2109 B10R1.176 O=CN1CC[C@H]([C@H](C1)F)O 43428ee554c9064f368724323b99caad [0,2,0,0,0,0|2,0,0]=4 2110 B10R1.176 O=CN1CC[C@H]([C@H](C1)O)F 6f46f6a65a3c4d868ce4ae7828d4ec77 [0,2,0,0,0,0|2,0,0]=4 2111 B8R1.20 CC(=O)NC1CC1C 1768a28e3842ccc949f84e026e8d58f3 [0,0,1,1,0,0|1,0,0]=3 2112 B8R1.20 CC(=O)N[C@@H]1C[C@H]1F bc7a6eb1a99ce556c18fcaf7f0c75c37 [0,0,1,1,0,0|2,0,0]=4 2113 B8R1.20 CC(=O)N[C@H]1C[C@@H]1F 576115c90eccc628d4e941f7a7852f6c [0,0,1,1,0,0|2,0,0]=4 2114 B8R1.20 CC(=O)N[C@H]1C[C@H]1F 8cb83b6d110bbd78098fefdd41f3f45a [0,0,1,1,0,0|2,0,0]=4 2115 B8R1.34 C=C(C)CN1CCC1 19d6aea172318893485802428f6f2b52 [0,0,1,1,0,0|2,0,0]=4 2116 B8R1.34 CC(=O)NC1CCC1 46894fd3aa8761205eba8795d61a04cf [0,0,1,1,0,0|1,0,0]=3 2117 B8R1.34 CC(=O)NC1COC1 434b9f924b049f8d9fb83819938927c2 [0,0,1,1,0,0|2,0,0]=4 2118 B8R1.34 CC(C)CN1CCC1 5cd648faa02f9a3a3e7088ca07d904cb [0,0,1,1,0,0|2,0,0]=4 2119 B8R1.34 NC(=O)CN1CCC1 6c3508be38699fc0f43e1dd694ce2a15 [0,0,1,1,0,0|2,0,0]=4 2120 B8R1.34 O=C(O)CN1CCC1 ae8e836e7c2a4bf3a61b53e9068f6f2f [0,0,1,1,0,0|2,0,0]=4 2121 B8R1.40 CCC(=O)NC1CC1 bc1edd04b4e58cbfa3a5f5c726ebfe6b [0,0,1,1,0,0|1,0,0]=3 2122 B8R1.40 CCN(C)CC1CC1 54cb31e95fbf3de98bdb1be424bfef82 [0,0,1,1,0,0|2,0,0]=4 2123 B8R1.40 O=C(CF)NC1CC1 9ccf83dad7006c7283aead2cfdfd9cfa [0,0,1,1,0,0|2,0,0]=4 2124 B8R1.40 O=C(CO)NC1CC1 bb096758b55cfb0505bd2d10961bc923 [0,0,1,1,0,0|2,0,0]=4 2125 B8R1.40 O=C(CS)NC1CC1 47ed3dec057db245af795d634c1f00f4 [0,0,1,1,0,0|2,0,0]=4 2126 B8R1.53 CCN1CC(C1)(C)C 769cc4143e2b2ac2202c3fe193b14ac3 [0,0,1,1,0,0|2,0,0]=4 2127 B8R1.6 CCOC1CC(=O)C1 7245371a51b98874574252c09e474e49 [0,0,1,1,0,0|1,0,0]=3 2128 B8R1.6 CN1CC(C1)NC=O 2bb9fe7b14eef0f45302baaf417a686a [0,0,1,1,0,0|2,0,0]=4 2129 B8R1.6 O=C1CC(C1)OCF c33823c82929be54a27457e340273af2 [0,0,1,1,0,0|2,0,0]=4 2130 B8R1.6 O=CCN1CC(C1)F 7167532f6af44ef8118ab6a0997eb38b [0,0,1,1,0,0|2,0,0]=4 2131 B8R1.6 O=CCN1CC(C1)O 05c491e4c8809ba1f982b958ba6277d0 [0,0,1,1,0,0|2,0,0]=4 2132 B8R1.6 O=CNC1CC(C1)O 0f0e219872cea0d90b55ea99cc9bac7d [0,0,1,1,0,0|2,0,0]=4 2133 B8R1.6 O=CN[C@H]1C[C@@H](C1)O 997cc39f2c608872229bb298dcf4a06f [0,0,1,1,0,0|2,0,0]=4 2134 B8R1.6 O=CN[C@H]1C[C@H](C1)O 66b7baee91e54b401401d333ec9a6247 [0,0,1,1,0,0|2,0,0]=4 2135 B8R1.7 CC(=O)N1CCSC1 df98add89dd15161c9f678ec3ecd18ec [0,0,1,1,0,0|2,0,0]=4 2136 B8R1.9 C=C1CC1COCC e60a01e41c746d08a053302fe8867db6 [0,0,1,1,0,0|2,0,0]=4 2137 B8R1.9 C=CCNC1CC1C b0ff888915c2d21b161d67161a001a2b [0,0,1,1,0,0|2,0,0]=4 2138 B8R1.9 CC1CC1NCC=O 892d613b2191180ffc95c583aabe7b25 [0,0,1,1,0,0|1,0,0]=3 2139 B8R1.9 O=CCN[C@@H]1C[C@H]1F 1b30ed4a609cd2619bcd787e45fd7f37 [0,0,1,1,0,0|2,0,0]=4 2140 B8R1.9 O=CCN[C@H]1C[C@@H]1F a1495db808f21a1e52da1e1d9590d29a [0,0,1,1,0,0|2,0,0]=4 2141 B8R1.9 O=CCN[C@H]1C[C@H]1F 317579e6fc51976ad113a70571610a12 [0,0,1,1,0,0|2,0,0]=4 2142 B8R1.27 C=CCN1CC1(C)C 3c1d7da03767a8dea7479c0c20fc0b42 [0,0,1,1,0,0|2,0,0]=4 2143 B8R1.27 CC1(CC1NC=O)C 1eba7b19977ef6314debf1d7d2b38b51 [0,0,1,1,0,0|1,0,0]=3 2144 B8R1.27 CC1(CN1CC=O)C 079c8663ebf5941900323baa2b372da1 [0,0,1,1,0,0|1,0,0]=3 2145 B8R1.27 CC1(C[C@@H]1NC=O)C 4c0edb90401b625188d015207fc18655 [0,0,1,1,0,0|1,0,0]=3 2146 B8R1.27 CC1(C[C@H]1NC=O)C ccea647979ee4862d824980bf0f41c3e [0,0,1,1,0,0|1,0,0]=3 2147 B8R1.35 C=C(C)CNC1CC1 d7b88e809441d579b0399cecfd2ac93a [0,0,1,1,0,0|2,0,0]=4 2148 B8R1.35 C=C(C)COC1CC1 63ffc7725ab16da355947b48ca968597 [0,0,1,1,0,0|2,0,0]=4 2149 B8R1.35 CC(=O)CNC1CC1 bc0778517edf8997c2cb438d2c68c0b3 [0,0,1,1,0,0|1,0,0]=3 2150 B8R1.35 CC(=O)COC1CC1 609f3b6a39f515f0075f8f8591a3a733 [0,0,1,1,0,0|1,0,0]=3 2151 B8R1.35 CC(=O)NCC1CC1 a9186e5a31a6f613e1b56d3a88df1d54 [0,0,1,1,0,0|1,0,0]=3 2152 B8R1.35 NC(=O)CNC1CC1 a00288a750d00bc42baa6fd0a0cd1bb6 [0,0,1,1,0,0|2,0,0]=4 2153 B8R1.35 NC(=O)COC1CC1 d832967b8065c8155f8f7bfb171fc20f [0,0,1,1,0,0|2,0,0]=4 2154 B8R1.35 O=C(O)CNC1CC1 b2ef6ef58e3db3eafb40e50595acdfb4 [0,0,1,1,0,0|2,0,0]=4 2155 B8R1.35 O=C(O)COC1CC1 7246c239d90b158329e958bbc0895f52 [0,0,1,1,0,0|2,0,0]=4 2156 B8R1.36 C=CCCNC1CC1 b8af55f20970d1f1dc53b7e019b02470 [0,0,1,1,0,0|2,0,0]=4 2157 B8R1.36 C=CCCOC1CC1 622d5e6791ce97e84bbc7a97a3048372 [0,0,1,1,0,0|2,0,0]=4 2158 B8R1.36 C=CCNCC1CC1 d574a4997f534ed53b974c2012f0d8e6 [0,0,1,1,0,0|2,0,0]=4 2159 B8R1.36 C=CCOCC1CC1 f479c640d2485abdcaf0be1cb3ece5ee [0,0,1,1,0,0|2,0,0]=4 2160 B8R1.36 O=CCCNC1CC1 f4d8039ccf048cb8f4199c1b08351d63 [0,0,1,1,0,0|1,0,0]=3 2161 B8R1.36 O=CCCOC1CC1 15be0a51dabb82df31730d1a8c7404a9 [0,0,1,1,0,0|1,0,0]=3 2162 B8R1.36 O=CCNCC1CC1 5fa5000fcca08c1b84197a398701c7b4 [0,0,1,1,0,0|1,0,0]=3 2163 B8R1.36 O=CCOCC1CC1 5be38468eaa20836e46ac65ce100c945 [0,0,1,1,0,0|1,0,0]=3 2164 B8R1.36 O=CNCCC1CC1 9542a5931e0c3890dfcf8d7169cc9114 [0,0,1,1,0,0|1,0,0]=3 2165 B8R1.36 O=CNCCN1CC1 188c39e271fc235da7afbcf399854612 [0,0,1,1,0,0|2,0,0]=4 2166 B8R1.8 CCCN1CC=CC1 dffb66591d4209c0345506bebd28f7c4 [0,0,1,1,0,0|2,0,0]=4 2167 B8R1.8 CCNC1CC=CC1 a91d0c1c4516e5b7b75119739c97d720 [0,0,1,1,0,0|2,0,0]=4 2168 B8R1.8 CCOC1CC=CC1 e0d02274580f3ec492bcb66ee71bce9b [0,0,1,1,0,0|2,0,0]=4 2169 B8R1.8 O=CCN1CCSC1 14861ad96d7cd5c90441f6d38859a442 [0,0,1,1,0,0|2,0,0]=4 2170 B8R1.8 O=CNC1CCCC1 9941fb95f5bfd095412442670e9f2499 [0,0,1,1,0,0|1,0,0]=3 2171 B8R1.8 O=CNC1CCOC1 e7b13204a0b810870373335ae06b13c2 [0,0,1,1,0,0|2,0,0]=4 2172 B8R1.8 O=CNC1CCSC1 82c5edb5966e6ade7f67bb51f82f09ea [0,0,1,1,0,0|2,0,0]=4 2173 B8R1.8 O=CN[C@@H]1CCOC1 8b6fe9f11693342d0eb8e36d1ad51ff3 [0,0,1,1,0,0|2,0,0]=4 2174 B8R1.8 O=CN[C@H]1CCOC1 f295aedd4a6355b7f9c423148debde31 [0,0,1,1,0,0|2,0,0]=4 2175 B8R1.16 CC1CC(N1C=O)C 68c6aa262d7808ae64f1cc90fbae1b29 [0,0,1,1,0,0|1,0,0]=3 2176 B8R1.16 C[C@@H]1C[C@@H](N1C=O)C 860cbeb088034e7b4fcbfe6227656475 [0,0,1,1,0,0|1,0,0]=3 2177 B8R1.16 C[C@@H]1C[C@H](N1C=O)C a942dc7508eed2df043adb56af93c0ca [0,0,1,1,0,0|1,0,0]=3 2178 B8R1.16 C[C@H]1C[C@@H](N1C=O)C e7d0a04d7866353e7bd9f9d9825a0417 [0,0,1,1,0,0|1,0,0]=3 2179 B8R1.17 CO[C@H]1C[C@H]1NC=O 1b79bd8913fb3b88422ac4c515f2fdfc [0,0,1,1,0,0|2,0,0]=4 2180 B8R1.17 O=CN[C@@H]1C[C@H]1CO 10a8417564f04103fe2c352e0df4f7b1 [0,0,1,1,0,0|2,0,0]=4 2181 B8R1.17 O=CN[C@H]1C[C@@H]1CO fcec26220579a84c0c9bdf6d03f8b348 [0,0,1,1,0,0|2,0,0]=4 2182 B8R1.17 O=CN[C@H]1C[C@H]1CO ea8cc98580a13b71ee31b79f516fe4f2 [0,0,1,1,0,0|2,0,0]=4 2183 B8R1.37 C=CCN(C)C1CC1 1719ae8d2105217ae7863bb23ae93ade [0,0,1,1,0,0|2,0,0]=4 2184 B8R1.37 CCCN(C)C1CC1 a74d24dd9139700310f848728ff8f1ee [0,0,1,1,0,0|2,0,0]=4 2185 B8R1.37 CN(CC=O)C1CC1 da61bbfc7021687d89d59d54bd0f05ba [0,0,1,1,0,0|1,0,0]=3 2186 B8R1.37 C[C@@H](NC=O)C1CC1 6df7776a8a6084e948c30aaa6bcc8106 [0,0,1,1,0,0|1,0,0]=3 2187 B8R1.37 C[C@H](NC=O)C1CC1 a44318147b26c551e56d43565edc198d [0,0,1,1,0,0|1,0,0]=3 2188 B8R1.66 CC1(CCC1)NC=O c4f5dcbe0c8abcae670d3c633c591542 [0,0,1,1,0,0|1,0,0]=3 2189 B8R1.66 CC1(CSC1)NC=O ac457225714b1c6c4a8f7f67f00588e6 [0,0,1,1,0,0|2,0,0]=4 2190 B10R2.99 CCN1CC2CCC1C2 9a88ae77aebe768272bf08042f59b227 [0,1,0,1,0,0|2,0,0]=4 2191 B10R2.99 CCN1C[C@@H]2CC[C@H]1C2 a9d13446afba5cb3742f034b89f92e2e [0,1,0,1,0,0|2,0,0]=4 2192 B10R2.99 CCN1C[C@H]2CC[C@@H]1C2 37c53875b8891b94fcb1a30a016396e3 [0,1,0,1,0,0|2,0,0]=4 2193 B10R2.99 FCN1CC2CCC1C2 9ed86e7dd9d6a415d07f66b746274352 [0,1,0,1,0,0|2,0,0]=4 2194 B10R2.99 FCN1C[C@@H]2CC[C@H]1C2 8a3d3f1263216149e7d3dbfeea57e6de [0,1,0,1,0,0|2,0,0]=4 2195 B10R2.99 FCN1C[C@H]2CC[C@@H]1C2 75cac652b082d55d125d0bff00f86944 [0,1,0,1,0,0|2,0,0]=4 2196 B10R2.99 O=CN1CC2CC1CO2 034280ea8e1a796d519741b73a98f2bc [0,1,0,1,0,0|2,0,0]=4 2197 B10R2.99 O=CN1CC2CCC1C2 fb6b7e0ef92e42506c098017125b9993 [0,1,0,1,0,0|1,0,0]=3 2198 B10R2.99 O=CN1C[C@@H]2CC[C@H]1C2 bac69a458f156f15a1ea0f7ccd77ffe5 [0,1,0,1,0,0|1,0,0]=3 2199 B10R2.99 O=CN1C[C@@H]2C[C@H]1CO2 0c266d56e2dc5f73d437ba63e9d76f96 [0,1,0,1,0,0|2,0,0]=4 2200 B10R2.99 O=CN1C[C@H]2CC[C@@H]1C2 01fb5bef17589312025e69c77444e0a6 [0,1,0,1,0,0|1,0,0]=3 2201 B10R2.99 O=CN1C[C@H]2C[C@@H]1CO2 de114c64a12a09f194dcc73e88a37bb7 [0,1,0,1,0,0|2,0,0]=4 2202 B10R2.99 OCN1CC2CCC1C2 72489350cd7931c3ca29023e75a8c86d [0,1,0,1,0,0|1,0,1]=4 2203 B10R2.99 OCN1C[C@@H]2CC[C@H]1C2 f8ed534250dfa6642c27e8f371cbde63 [0,1,0,1,0,0|1,0,1]=4 2204 B10R2.99 OCN1C[C@H]2CC[C@@H]1C2 ed6d16a9125e6c8ce76a532055448a12 [0,1,0,1,0,0|1,0,1]=4 2205 B10R2.100 O=CN1CC2CC(C1)O2 c3a4df6e61b68f6030655b4c34d0d55a [0,1,0,1,0,0|2,0,0]=4 2206 B10R2.100 O=CN1C[C@H]2C[C@@H](C1)O2 7d1cfbfe0c80d01c08c00f2429c62943 [0,1,0,1,0,0|2,0,0]=4 2207 B10R2.109 CCN1CCC2CC2C1 f21090fa3edd3d3600249d33808a6b0c [0,1,0,1,0,0|2,0,0]=4 2208 B10R2.109 FCN1CCC2CC2C1 24030b061263b6c5a61359eb9d830ac8 [0,1,0,1,0,0|2,0,0]=4 2209 B10R2.109 O=CN1CCC2CC2C1 2db05f41517837ccff5ea5089c869488 [0,1,0,1,0,0|1,0,0]=3 2210 B10R2.109 OCN1CCC2CC2C1 0c79f54b453b148568c2092ca2aa72d6 [0,1,0,1,0,0|1,0,1]=4 2211 B10R2.402 O=CN1CCOC2C1C2 0f9161890e59b5289f8ab6ca4eee6bf0 [0,1,0,1,0,0|2,0,0]=4 2212 B6R0.3 CCN(C)C(=O)C ad9227383f4996d412a5ced11e9c5417 [0,0,1,0,1,0|1,0,0]=3 2213 B6R0.3 CCN(C)C(C)C 515b7690a64e89945d29d623804849df [0,0,1,0,1,0|2,0,0]=4