0 B6R0.1 C#CCN(C)CC df628b2fb59d020a233c7468342e16c7 [0,0,0,0,0,0|2,0,2]=4 1 B6R0.1 C=C(C=O)OCC 64c18fcc04a22b045ebc35a9eb4d4363 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.1 C=CCN(C)CC 66590de6b708bb2b2b2945a656dd0b8f [0,0,0,0,0,0|2,0,2]=4 3 B6R0.1 CCC(=O)NC#N 73537d427a9f3c7ed521fc0320b94de6 [0,0,0,0,0,0|2,0,1]=3 4 B6R0.1 CCC(C)NCF cd789606d14d277b4095dc11d6d1f629 [0,0,0,0,0,0|3,0,1]=4 5 B6R0.1 CCC(C)NCO 2f150bbe96920869e15d5d5aa816b484 [0,0,0,0,0,0|3,0,1]=4 6 B6R0.1 CCC(C)OCF b1f4704464bbfd0265fa8845c1d734e2 [0,0,0,0,0,0|3,0,1]=4 7 B6R0.1 CCCN(C)C=O f55d615150194d8a2881f113e75957ad [0,0,0,0,0,0|3,0,1]=4 8 B6R0.1 CCCN(C)CC 063caa89be0fdd356f6455d1751457ac [0,0,0,0,0,0|2,0,0]=2 9 B6R0.1 CCCN(C)CF 5c995bfd39cfefd185b6001ca8e730f3 [0,0,0,0,0,0|3,0,0]=3 10 B6R0.1 CCCN(C)CO fa8c399923bf908abe4d1198e252c43d [0,0,0,0,0,0|3,0,0]=3 11 B6R0.1 CCN(C)CC#N 2853a7af5707f71aff1eef2c0f44a019 [0,0,0,0,0,0|3,0,1]=4 12 B6R0.1 CCN(C)CC=O 027065f0dd139518bb2cdfff7d6533ae [0,0,0,0,0,0|3,0,1]=4 13 B6R0.1 CCN(C)CCF 15aa448f2958342e872fe1eff4da2f7c [0,0,0,0,0,0|3,0,0]=3 14 B6R0.1 CCN(C)CCO d3ce6c3bd65198b22911f821b13f3685 [0,0,0,0,0,0|3,0,0]=3 15 B6R0.1 CCN(C)CCS 1ccbd256497b3a342f1d9474525ca49a [0,0,0,0,0,0|3,0,0]=3 16 B6R0.1 CCN(C)COC 2dba1e0fec030895fe26248c793df52e [0,0,0,0,0,0|3,0,0]=3 17 B6R0.1 CCN(C)CSC 613c63b39ee46a6bdda90b076e70e35a [0,0,0,0,0,0|3,0,0]=3 18 B6R0.1 CCNC(C)CC 396d13a5c682c09283d5fcc86ff55a86 [0,0,0,0,0,0|2,0,1]=3 19 B6R0.1 CCNC(C)CO 31c32677d35319c7bce72f49aa59533d [0,0,0,0,0,0|3,0,1]=4 20 B6R0.1 CCN[C@@H](C)CC 8864275bc593322b499f8ffa253a175e [0,0,0,0,0,0|2,0,1]=3 21 B6R0.1 CCN[C@@H](C)CO 1b5cec79590e2129f58d3514073a1390 [0,0,0,0,0,0|3,0,1]=4 22 B6R0.1 CCN[C@H](C)CC 2ca98ce961a0f1b51c5b9bb18e4cf730 [0,0,0,0,0,0|2,0,1]=3 23 B6R0.1 CCN[C@H](C)CO 4334eb4497c625ddabbfceeac7d82066 [0,0,0,0,0,0|3,0,1]=4 24 B6R0.1 CCOC(C)CC 56a4de537882754d70714e008cda003f [0,0,0,0,0,0|2,0,1]=3 25 B6R0.1 CCOC(C)CF 65f06da7a639a9baf133860813b79ea3 [0,0,0,0,0,0|3,0,1]=4 26 B6R0.1 CCOC(C)CS eb3404d1a98d8fb6f364ecf6e98ac96e [0,0,0,0,0,0|3,0,1]=4 27 B6R0.1 CCO[C@@H](C)CC 1c34d8425f39e9be808db66bb381a14c [0,0,0,0,0,0|2,0,1]=3 28 B6R0.1 CCO[C@H](C)CC 08a1e8fcc5a32008da3650c30e1472a7 [0,0,0,0,0,0|2,0,1]=3 29 B6R0.1 CCO[C@H](C)CS 7d1ac13ead965fd5112ee05598239ca1 [0,0,0,0,0,0|3,0,1]=4 30 B6R0.1 CC[C@@H](C)NCF 6dbb95a50e3976893bdb1627db012fbb [0,0,0,0,0,0|3,0,1]=4 31 B6R0.1 CC[C@@H](C)NCO ac0974a6f9b0bb6d16f90be7439490a9 [0,0,0,0,0,0|3,0,1]=4 32 B6R0.1 CC[C@@H](C)OCF f4fa7810a1d84f0f9cde4476fd8e3f60 [0,0,0,0,0,0|3,0,1]=4 33 B6R0.1 CC[C@H](C)NCF 5d430afc33b47de08bdee5a967987e85 [0,0,0,0,0,0|3,0,1]=4 34 B6R0.1 CC[C@H](C)NCO 3a0d2629be7074b261ab0759e7061769 [0,0,0,0,0,0|3,0,1]=4 35 B6R0.1 CC[C@H](C)OCF 7272126d7b60c9c2f9744715a5cbda1c [0,0,0,0,0,0|3,0,1]=4 36 B6R0.1 CN(CF)CCF 3637d23f051ca2593a5a5b98ee47a1b5 [0,0,0,0,0,0|4,0,0]=4 37 B6R0.1 CN(CF)CCO 45c87519ddef71b395da19084a38f5b6 [0,0,0,0,0,0|4,0,0]=4 38 B6R0.1 CN(CO)CCF e5dd1ecfdd1f28e155abf2012a360c21 [0,0,0,0,0,0|4,0,0]=4 39 B6R0.1 CN(CO)CCO 54f662b94257417f82a22aa2c84d65c3 [0,0,0,0,0,0|4,0,0]=4 40 B6R0.1 N#CNC(=O)CF 68c7bbf575858d00ec753fd2b8317ca7 [0,0,0,0,0,0|3,0,1]=4 41 B6R0.1 N#CNC(=O)CO 236f04c3f08af6bcd8e67780d27f25bf [0,0,0,0,0,0|3,0,1]=4 42 B5R0.1 CC(=O)NC#N 96e7b4266c4f58edb3348aa5d4644bfa [1,0,0,0,0,0|2,0,1]=4 43 B5R0.1 CCOC(C)C e40579e838af0384b34ea3d488054b89 [1,0,0,0,0,0|2,0,1]=4 44 B5R0.2 C#CCNCC b7f456a7c0046d69162917c7df90472c [1,0,0,0,0,0|1,0,2]=4 45 B5R0.2 C#CCOCC 625c68641a74502dc56dd1108cdba604 [1,0,0,0,0,0|1,0,2]=4 46 B5R0.2 CCCNC#N e55413a0eea711c89a0029efe46eb0b1 [1,0,0,0,0,0|2,0,1]=4 47 B5R0.2 CCCNC=O 394eea314e4a7e284e23571b2081e74b [1,0,0,0,0,0|2,0,1]=4 48 B5R0.2 CCCNCC 5224ca4332fe9f083a57aa92376290e9 [1,0,0,0,0,0|1,0,0]=2 49 B5R0.2 CCCNCF 5221ca3b6142d54e68ddcdccc04ade24 [1,0,0,0,0,0|2,0,0]=3 50 B5R0.2 CCCNCO d60b753d66bdce688dd2adf0f18abf34 [1,0,0,0,0,0|2,0,0]=3 51 B5R0.2 CCCOCC a0c48a14a19cfc2180230756acaf40ab [1,0,0,0,0,0|1,0,0]=2 52 B5R0.2 CCCOCF 3a09ada643594a0865eabd839c992d22 [1,0,0,0,0,0|2,0,0]=3 53 B5R0.2 CCNCC#N 8afea2f1bf8bfbfa2907ffe05f260d21 [1,0,0,0,0,0|2,0,1]=4 54 B5R0.2 CCNCCBr 6acf983ca8c05ad7adfc0e3d5b4f64f7 [1,0,0,0,0,0|2,0,0]=3 55 B5R0.2 CCNCCF f147a768cf60514004e1bcbf470c3410 [1,0,0,0,0,0|2,0,0]=3 56 B5R0.2 CCNCCI 8421b8d41316967e2680f733246bab7d [1,0,0,0,0,0|2,0,0]=3 57 B5R0.2 CCNCCO 2fc34530a6c959b43319124309163fa3 [1,0,0,0,0,0|2,0,0]=3 58 B5R0.2 CCNCCS e4a2a02ec4ecae7b609beae190ea9ee1 [1,0,0,0,0,0|2,0,0]=3 59 B5R0.2 CCOCC#N 0fd8a1783429ce080c52b3010d70b565 [1,0,0,0,0,0|2,0,1]=4 60 B5R0.2 CCOCCF e5d78433fc996ba51bd8a100b7998155 [1,0,0,0,0,0|2,0,0]=3 61 B5R0.2 CCOCCS 56f6087ed887f762fd2bdcb15935222f [1,0,0,0,0,0|2,0,0]=3 62 B5R0.2 CCOCOC 6cd815448945789916c4199ac0685ffd [1,0,0,0,0,0|2,0,0]=3 63 B5R0.2 COCOCF 8b21adc85de0de107e0e54e13944287c [1,0,0,0,0,0|3,0,0]=4 64 B5R0.2 FCCNCF 3f146e38f81fa4f5bf67d0f4217d666d [1,0,0,0,0,0|3,0,0]=4 65 B5R0.2 FCCOCF ca742562f732a5154eefbdd51554f094 [1,0,0,0,0,0|3,0,0]=4 66 B5R0.2 FCNCCBr ebb4ae71bfedb68f39fc2b9156885a92 [1,0,0,0,0,0|3,0,0]=4 67 B5R0.2 FCNCCI 6147f2646233ff1a06aa8fb273c4329d [1,0,0,0,0,0|3,0,0]=4 68 B5R0.2 FCNCCS ce51a6a3077027e3188387d313defd97 [1,0,0,0,0,0|3,0,0]=4 69 B5R0.2 FCOCCS 3aade357eac7f8414966cbb46c36a193 [1,0,0,0,0,0|3,0,0]=4 70 B5R0.2 OCCNCF 7003ba7efdea8413ef4364037c1001a7 [1,0,0,0,0,0|3,0,0]=4 71 B5R0.2 OCCNCO 7bb8121d6904fe92ecf2faab37be4b2d [1,0,0,0,0,0|3,0,0]=4 72 B5R0.2 OCNCCBr ee34e5972b0522a370fb51b29c6bc7a6 [1,0,0,0,0,0|3,0,0]=4 73 B5R0.2 OCNCCF 01aec1945c7d4caf55669189450aba19 [1,0,0,0,0,0|3,0,0]=4 74 B5R0.2 OCNCCI d2779603e8c1e9f18b9fbe00ccefa227 [1,0,0,0,0,0|3,0,0]=4 75 B5R0.2 OCNCCS 87671363bbc8ed0ee87af951e0008679 [1,0,0,0,0,0|3,0,0]=4 76 B5R0.3 CCN(C)CC ab5b03184b17818ff0d4295949ca4956 [1,0,0,0,0,0|2,0,0]=3 77 B5R0.3 CCN(C)CF f1609b6f0307b235e83ada8bb1f6ec70 [1,0,0,0,0,0|3,0,0]=4 78 B5R0.3 CCN(C)CO 992ae963459eb3513b2ca42228fd2ef7 [1,0,0,0,0,0|3,0,0]=4 79 B7R0.2 C=C(C)CN(C)CC f46aa4737385fde5ecca127cfe0fb11b [0,1,0,0,0,0|2,0,1]=4 80 B7R0.2 CC(C)CN(C)CF f2a6b79f5877628929a1b31fd183a5d0 [0,1,0,0,0,0|3,0,0]=4 81 B7R0.2 CC(C)CN(C)CO 0b6bf7cc82aa91188fc000497729e3d4 [0,1,0,0,0,0|3,0,0]=4 82 B7R0.2 CC(O)CN(C)CF c09526189cafd23891f682c66649d125 [0,1,0,0,0,0|3,0,0]=4 83 B7R0.2 CC(O)CN(C)CO 3b7f6558a4b553a3af9a1035d866a39e [0,1,0,0,0,0|3,0,0]=4 84 B7R0.2 CCC(C)NC(C)C 0cb605662148972b343a2865e41d2f95 [0,1,0,0,0,0|2,0,1]=4 85 B7R0.2 CCC(C)OC(C)C 06c7f52afdb28395f9fa9574a364e474 [0,1,0,0,0,0|2,0,1]=4 86 B7R0.2 CCN(C)CC(C)C b1801f5d5c3a2fe65e0c5338da1b288f [0,1,0,0,0,0|2,0,0]=3 87 B7R0.2 CCN(C)CC(C)O 22c796f149474196e01f5a861b83c652 [0,1,0,0,0,0|2,0,0]=3 88 B7R0.2 CCN(C)CC(F)F ffb0011f568ae55bb7bb9747777b52af [0,1,0,0,0,0|3,0,0]=4 89 B7R0.2 CCN(C)CN(C)C f99659c98f126cf47210322e6b249111 [0,1,0,0,0,0|3,0,0]=4 90 B7R0.2 CCN(C)C[C@@H](C)O e1fc7c21afedf382169569842ae9d9da [0,1,0,0,0,0|2,0,0]=3 91 B7R0.2 CCN(C)C[C@H](C)O 2fe5de7e3e442679b65eac3f37bae166 [0,1,0,0,0,0|2,0,0]=3 92 B7R0.2 CC[C@@H](C)NC(C)C fbd46dfde63f10a9f545bd04d72d3565 [0,1,0,0,0,0|2,0,1]=4 93 B7R0.2 CC[C@@H](C)OC(C)C be2816eab25b2a9101da766270106c57 [0,1,0,0,0,0|2,0,1]=4 94 B7R0.2 CC[C@H](C)NC(C)C df85b8e0c4ded03d149c43327f4a7c4a [0,1,0,0,0,0|2,0,1]=4 95 B7R0.2 CC[C@H](C)OC(C)C 2c6d159b250df3bb005afd7417a4b5dc [0,1,0,0,0,0|2,0,1]=4 96 B7R0.2 C[C@H](O)CN(C)CF 5a09021deee6ed4ea8f52ce12dc22c90 [0,1,0,0,0,0|3,0,0]=4 97 B7R0.2 C[C@H](O)CN(C)CO c3ae4b5b307547a59cb2b787e087330e [0,1,0,0,0,0|3,0,0]=4 98 B7R0.3 C#CC(=O)NCCBr 4e7606b090d079dad338fcb3b3531ca6 [0,1,0,0,0,0|1,0,2]=4 99 B7R0.3 C#CC(=O)NCCC cae95b1c8d30c3884ac9714e15062442 [0,1,0,0,0,0|0,0,2]=3 100 B7R0.3 C#CC(=O)NCCF 0890b45106e9e8df323c27183e746605 [0,1,0,0,0,0|1,0,2]=4 101 B7R0.3 C#CC(=O)NCCI b79a2019875390d416fe2aefcbe1af43 [0,1,0,0,0,0|1,0,2]=4 102 B7R0.3 C#CC(=O)NCCO c110abd6360d09a8f1de8aab1b75fd14 [0,1,0,0,0,0|1,0,2]=4 103 B7R0.3 C#CC(=O)NCCS 422c567f724a0e38807951b59910dcb8 [0,1,0,0,0,0|1,0,2]=4 104 B7R0.3 C#CCCN(C)CC 01ca83eb61fbc9c94adbced8a51db44e [0,1,0,0,0,0|2,0,1]=4 105 B7R0.3 C#CCNC(=O)CC ef394171f7ba9dfda173330f309f7a5d [0,1,0,0,0,0|0,0,2]=3 106 B7R0.3 C#CCNC(=O)CF eb4eda342cbed92c949eab745f85779c [0,1,0,0,0,0|1,0,2]=4 107 B7R0.3 C#CCNC(=O)CO 2c93e118ea6c2ce38cf0db5343c819bd [0,1,0,0,0,0|1,0,2]=4 108 B7R0.3 C#CCNC(=O)CS cd4e37f8b8830653a130a09363dce8f6 [0,1,0,0,0,0|1,0,2]=4 109 B7R0.3 C/C=C/CN(C)CC a833def0c5a9483904429a6d4fa647bf [0,1,0,0,0,0|2,0,1]=4 110 B7R0.3 C/C=C\CN(C)CC 0d52835f1d4ec546901139cc9ef0efe3 [0,1,0,0,0,0|2,0,1]=4 111 B7R0.3 C=C(C#N)COCC 0c840f773075998533681b448d00e61c [0,1,0,0,0,0|2,0,1]=4 112 B7R0.3 C=C(C=O)OCCC 04efcca188a8b47a61c5130fe82b341f [0,1,0,0,0,0|2,0,1]=4 113 B7R0.3 C=C(CC)CNC#N ca2840cc6610dd15832093f0e1803ec7 [0,1,0,0,0,0|2,0,1]=4 114 B7R0.3 C=CC(=O)NCCBr e6f6b86f13e8187fabc94be948b883a9 [0,1,0,0,0,0|1,0,2]=4 115 B7R0.3 C=CC(=O)NCCC cbaf2af1e216a93f8d9916d9e14e472f [0,1,0,0,0,0|0,0,2]=3 116 B7R0.3 C=CC(=O)NCCF 603b2638e9cfb8f5ec21de15aad5486a [0,1,0,0,0,0|1,0,2]=4 117 B7R0.3 C=CC(=O)NCCI 3eb791874c2ca04ded681849c87dc345 [0,1,0,0,0,0|1,0,2]=4 118 B7R0.3 C=CC(=O)NCCO 6cddef02f32566caa65152d55a827db1 [0,1,0,0,0,0|1,0,2]=4 119 B7R0.3 C=CC(=O)NCCS 9889ebe2d1bfba26b1d473fa334f8376 [0,1,0,0,0,0|1,0,2]=4 120 B7R0.3 C=CCCN(C)CC 224a5773b1b84beacfc8f44066799c60 [0,1,0,0,0,0|2,0,1]=4 121 B7R0.3 CCC(=O)CNC#N 5c4d1d2cbca480d29fea538bd5160350 [0,1,0,0,0,0|1,0,1]=3 122 B7R0.3 CCC(=O)COCF 0dfc429bc09e415d47df418ebade007a [0,1,0,0,0,0|1,0,0]=2 123 B7R0.3 CCC(=O)NCC#N 8ad58c7a251d01ba78f75279da47aa27 [0,1,0,0,0,0|1,0,1]=3 124 B7R0.3 CCC(=O)NCCBr 622c7e0d01006938ab3182a350e1ebd0 [0,1,0,0,0,0|1,0,0]=2 125 B7R0.3 CCC(=O)NCCF 64c5d06137bf344ab2d9ef1c9d4f8989 [0,1,0,0,0,0|1,0,0]=2 126 B7R0.3 CCC(=O)NCCI a607114f95a86326e4b8a49fc0dc2b27 [0,1,0,0,0,0|1,0,0]=2 127 B7R0.3 CCC(=O)NCCO 7cd694fbe0a0792079b1131d041f8e7c [0,1,0,0,0,0|1,0,0]=2 128 B7R0.3 CCC(=O)NCCS 2d1553f99b093c5be0d2a8ed841e36c7 [0,1,0,0,0,0|1,0,0]=2 129 B7R0.3 CCC(C)CNCF b50ea40d2446dde4a785720e8c9ab76e [0,1,0,0,0,0|2,0,1]=4 130 B7R0.3 CCC(C)CNCO a95514de2db5be0c68571e33ca613f6e [0,1,0,0,0,0|2,0,1]=4 131 B7R0.3 CCC(C)COCF d83d0a95392ef09a2490e51164140783 [0,1,0,0,0,0|2,0,1]=4 132 B7R0.3 CCC(C)NCCBr a824f3363a2868a7206559546a3484f0 [0,1,0,0,0,0|2,0,1]=4 133 B7R0.3 CCC(C)NCCF 2a8d3394dec4d41ce38c860bf4ab17dd [0,1,0,0,0,0|2,0,1]=4 134 B7R0.3 CCC(C)NCCI 6c2db2487fbf25506eed8cabe391bbb0 [0,1,0,0,0,0|2,0,1]=4 135 B7R0.3 CCC(C)NCCO 513c7a6bd13dc3bbf026a87954b89604 [0,1,0,0,0,0|2,0,1]=4 136 B7R0.3 CCC(C)NCCS 7a8d315a94e5493fa661ae8da8c0d7d5 [0,1,0,0,0,0|2,0,1]=4 137 B7R0.3 CCC(C)NCOC 7706fa764743624f662862fda01b7a28 [0,1,0,0,0,0|2,0,1]=4 138 B7R0.3 CCC(C)NCSC c04eb7da5ed0a2a03e68485c2016666a [0,1,0,0,0,0|2,0,1]=4 139 B7R0.3 CCC(C)OCCF b50b83f4cc04a33902077c0b3a238cbc [0,1,0,0,0,0|2,0,1]=4 140 B7R0.3 CCC(C)OCCS 0b195719e1e4b78092bc0c0213134f4f [0,1,0,0,0,0|2,0,1]=4 141 B7R0.3 CCC(C)OCOC 7b2a5b8cb8aef52b76ee0f9de192d2d0 [0,1,0,0,0,0|2,0,1]=4 142 B7R0.3 CCC(C)OCSC a5a0b25f047959799e9ece96fa20b187 [0,1,0,0,0,0|2,0,1]=4 143 B7R0.3 CCC(O)CNCF 7b1de8624516487080ebd1a2aadc352e [0,1,0,0,0,0|1,0,2]=4 144 B7R0.3 CCC(O)CNCO 979e1feff1eac75f1747d85e3216f621 [0,1,0,0,0,0|1,0,2]=4 145 B7R0.3 CCCCN(C)CC 89876d3ca82726715f2f995cd8bda708 [0,1,0,0,0,0|2,0,0]=3 146 B7R0.3 CCCCN(C)CF be372279d4be2902bb76b9de8a48abc5 [0,1,0,0,0,0|3,0,0]=4 147 B7R0.3 CCCCN(C)CO 3f062a8d7718607e7a9f891ee2c89bec [0,1,0,0,0,0|3,0,0]=4 148 B7R0.3 CCCNC(=O)C=O d7ca29ecc0d8770667a3b66f38c8ad0e [0,1,0,0,0,0|1,0,1]=3 149 B7R0.3 CCCNC(=O)CC d52888c93ed9aa6cfb5138e6aae16063 [0,1,0,0,0,0|0,0,0]=1 150 B7R0.3 CCCNC(=O)CF 67a342107ae82918e7753da6150a6f54 [0,1,0,0,0,0|1,0,0]=2 151 B7R0.3 CCCNC(=O)CO 695700e0c0155474a56ee68a189e270e [0,1,0,0,0,0|1,0,0]=2 152 B7R0.3 CCCNC(=O)CS 91632e7a8866d5c8829272afb3b260d7 [0,1,0,0,0,0|1,0,0]=2 153 B7R0.3 CCCNC(C)CC 943eb030d61b8e5bd9a7ef7a782a9e18 [0,1,0,0,0,0|1,0,1]=3 154 B7R0.3 CCCNC(C)CO ef58a4cf57fdde87a0f1c08020c4e142 [0,1,0,0,0,0|2,0,1]=4 155 B7R0.3 CCCN[C@@H](C)CC 9b5d6f86dd01bda6e2759939f83bc7a8 [0,1,0,0,0,0|1,0,1]=3 156 B7R0.3 CCCN[C@@H](C)CO 9717e8befa87e4e1275959dce684e068 [0,1,0,0,0,0|2,0,1]=4 157 B7R0.3 CCCN[C@H](C)CC 1516fdad8637f0b3c763f64cc7a7beb7 [0,1,0,0,0,0|1,0,1]=3 158 B7R0.3 CCCN[C@H](C)CO 7bbdc293a56e3b9e5394e782c67eaddd [0,1,0,0,0,0|2,0,1]=4 159 B7R0.3 CCCOC(C)CC 98a624a488dc392a35e8b0b44aac3f30 [0,1,0,0,0,0|1,0,1]=3 160 B7R0.3 CCCOC(C)CF 9754423e03bd9c1680aa4f64130d3218 [0,1,0,0,0,0|2,0,1]=4 161 B7R0.3 CCCOC(C)CS 3831bbe85ee4c34ff42a76d0b53dbb5c [0,1,0,0,0,0|2,0,1]=4 162 B7R0.3 CCCO[C@@H](C)CC af9e77ade15ce19a7659cd0cba0e805a [0,1,0,0,0,0|1,0,1]=3 163 B7R0.3 CCCO[C@H](C)CC aceb38a7b284bb9c5e1ae0a6fb45caa0 [0,1,0,0,0,0|1,0,1]=3 164 B7R0.3 CCCO[C@H](C)CS 34c71dbcb154ce995a79e0481e98962a [0,1,0,0,0,0|2,0,1]=4 165 B7R0.3 CCN(C)CCC#N 911157a043342786564f3eb320b58369 [0,1,0,0,0,0|2,0,1]=4 166 B7R0.3 CCN(C)CCC=O 7943cc4d9a1ab8d439ad27cf7b079146 [0,1,0,0,0,0|2,0,1]=4 167 B7R0.3 CCN(C)CCCF 58d987982e58376deaac7a021f590114 [0,1,0,0,0,0|2,0,0]=3 168 B7R0.3 CCN(C)CCCO b1a93de8904fff1ed54369ee01ff1bc7 [0,1,0,0,0,0|2,0,0]=3 169 B7R0.3 CCN(C)CCCS 4332e180b042c428772cc564602cf5d6 [0,1,0,0,0,0|2,0,0]=3 170 B7R0.3 CCN(C)CCOC 4abfef839ac1a01d5b0d90f7c9bd6930 [0,1,0,0,0,0|2,0,0]=3 171 B7R0.3 CCN(C)CCON dca6e8ee84d04b2409e73b61f0963e17 [0,1,0,0,0,0|3,0,0]=4 172 B7R0.3 CCN(C)CCSC 4e1bdb1a0d6eba176a369aa29a4d6d63 [0,1,0,0,0,0|2,0,0]=3 173 B7R0.3 CCNCC(=O)NC 6e0bba6a22fc3bc37e6c3e6f60c6e36a [0,1,0,0,0,0|1,0,0]=2 174 B7R0.3 CCNCC(=O)NO 7228bb52838409a6b0afe1bee2beaf9e [0,1,0,0,0,0|2,0,0]=3 175 B7R0.3 CCNCC(=O)OC b1dca081e4a690ea6b077cbe8021ba9d [0,1,0,0,0,0|1,0,0]=2 176 B7R0.3 CCNCC(Br)CBr d36ffe1e96eb7cbab2cfb7f783eab3ca [0,1,0,0,0,0|2,0,1]=4 177 B7R0.3 CCNCC(C)CC 1a6ded6349edd095188d6a9fb8900c29 [0,1,0,0,0,0|1,0,1]=3 178 B7R0.3 CCNCC(C)CO ded6e5c82cb05dc8e16cf8630e1ca3b5 [0,1,0,0,0,0|2,0,1]=4 179 B7R0.3 CCNCC(F)CO 117f22342a13aa75ee6537d043ca9a79 [0,1,0,0,0,0|2,0,1]=4 180 B7R0.3 CCNCC(O)CC dc31e5e4e5da5852b809f33f35b18fd2 [0,1,0,0,0,0|0,0,2]=3 181 B7R0.3 CCNCC(O)CO 912f6e9829a436a31980d4e7e51ccc17 [0,1,0,0,0,0|1,0,2]=4 182 B7R0.3 CCNC[C@@H](C)CC 79edf92db75b8292301b7cbe642600de [0,1,0,0,0,0|1,0,1]=3 183 B7R0.3 CCNC[C@@H](C)OC 6e88fe4f7175c837d5238f2168d0e9a3 [0,1,0,0,0,0|2,0,1]=4 184 B7R0.3 CCNC[C@@H](F)CO 67c2661f5a7f3a3662b0ed433a86c18e [0,1,0,0,0,0|2,0,1]=4 185 B7R0.3 CCNC[C@@H](O)CO 3dd3012db0550f06ef7a0ae24c6afc49 [0,1,0,0,0,0|1,0,2]=4 186 B7R0.3 CCNC[C@H](C)CO ef051a7bca96170e9f6bad04a99231e7 [0,1,0,0,0,0|2,0,1]=4 187 B7R0.3 CCNC[C@H](C)OC 0584eeded494335d50fae9461e407d42 [0,1,0,0,0,0|2,0,1]=4 188 B7R0.3 CCNC[C@H](F)CO f2842022ba0aab28ac2537444b2b8a9e [0,1,0,0,0,0|2,0,1]=4 189 B7R0.3 CCNC[C@H](O)CC b4686830d8510fcc2b704c38b72f0503 [0,1,0,0,0,0|0,0,2]=3 190 B7R0.3 CCNC[C@H](O)CO f2bf6c02d84b0a754d29868d7e541576 [0,1,0,0,0,0|1,0,2]=4 191 B7R0.3 CCOC/C(=C/I)/C 92df24ec990a3895db2ac49e1b5a7038 [0,1,0,0,0,0|2,0,1]=4 192 B7R0.3 CCOCC(=CI)C fb53346fffa55ab558f152fe4ff2ec43 [0,1,0,0,0,0|2,0,1]=4 193 B7R0.3 CCOCC(=O)CC 13cc2d887732afb318f359551753b6fc [0,1,0,0,0,0|0,0,0]=1 194 B7R0.3 CCOCC(=O)NC c799fcda6efa9f3f97fe8695cdef5794 [0,1,0,0,0,0|1,0,0]=2 195 B7R0.3 CCOCC(=O)OC b7ea85ad64af7662897e0490968d63a7 [0,1,0,0,0,0|1,0,0]=2 196 B7R0.3 CCOCC(Br)CBr 899bba2d1c5835949acb4e9662ed4011 [0,1,0,0,0,0|2,0,1]=4 197 B7R0.3 CCOCC(C)CC b48ffd68a9924a596413f28a1f26cd9a [0,1,0,0,0,0|1,0,1]=3 198 B7R0.3 CCOCC(C)OC 00214de46f1604d32f121bd91c115789 [0,1,0,0,0,0|2,0,1]=4 199 B7R0.3 CCOCC(Cl)CCl 72c4c6886b79925133380a5669de62f5 [0,1,0,0,0,0|2,0,1]=4 200 B7R0.3 CCOCC(S)CS d80bb4af4d3d9e7ea521ee7f1ce8c4cb [0,1,0,0,0,0|1,1,1]=4 201 B7R0.3 CCOCN(C)CC 943ae7cd82ee7e4032615894df227ae8 [0,1,0,0,0,0|2,0,0]=3 202 B7R0.3 CCOC[C@@H](C)CC 24d1c149f27d56a7b1370d3d84a93c4a [0,1,0,0,0,0|1,0,1]=3 203 B7R0.3 CCOC[C@@H](C)OC ecceb3df9b78b58b5b76fdc0f6911e92 [0,1,0,0,0,0|2,0,1]=4 204 B7R0.3 CCOC[C@H](C)CC e4857d3b038c108c7619c84891e8a2f7 [0,1,0,0,0,0|1,0,1]=3 205 B7R0.3 CCOC[C@H](C)OC fd13d8de7d92a89af8eab0e711a6bd02 [0,1,0,0,0,0|2,0,1]=4 206 B7R0.3 CC[C@@H](C)COCF 27ee9a97e87757a57bbd2473b47c8a0b [0,1,0,0,0,0|2,0,1]=4 207 B7R0.3 CC[C@@H](C)NCCF 93d07692499e3b9aec2552214e2ff53f [0,1,0,0,0,0|2,0,1]=4 208 B7R0.3 CC[C@@H](C)NCCO 72cce7ce1a4c2aadd49ed6fa51eb30e5 [0,1,0,0,0,0|2,0,1]=4 209 B7R0.3 CC[C@@H](C)NCCS 34946916ab9d46b94332e25fb6d97f4b [0,1,0,0,0,0|2,0,1]=4 210 B7R0.3 CC[C@@H](C)NCOC 6f18e43812c50f5929ea1f0282d55276 [0,1,0,0,0,0|2,0,1]=4 211 B7R0.3 CC[C@@H](C)NCSC b2ccc0121f9ed49266567b6f15a655a0 [0,1,0,0,0,0|2,0,1]=4 212 B7R0.3 CC[C@@H](C)OCCF 9a9e445f08d44c81e417052c615c3334 [0,1,0,0,0,0|2,0,1]=4 213 B7R0.3 CC[C@@H](C)OCCS c58b0dc1d2db79db526d0ab1218bffc7 [0,1,0,0,0,0|2,0,1]=4 214 B7R0.3 CC[C@@H](C)OCOC 5dd2de1ba91f6cde19e7a670f775c35c [0,1,0,0,0,0|2,0,1]=4 215 B7R0.3 CC[C@@H](C)OCSC 07780bc57acd6b7b99e87c445c42d82f [0,1,0,0,0,0|2,0,1]=4 216 B7R0.3 CC[C@@H](O)CNCF 7d1b814c6cda97ec1056049a0891a12c [0,1,0,0,0,0|1,0,2]=4 217 B7R0.3 CC[C@@H](O)CNCO 3c3de5c9d0ff6c16983c8a1b36ce8a94 [0,1,0,0,0,0|1,0,2]=4 218 B7R0.3 CC[C@H](C)CNCF d271465589c016cce21e3753bb72dfde [0,1,0,0,0,0|2,0,1]=4 219 B7R0.3 CC[C@H](C)CNCO 0fe58ceb43d0411047b54aeefa27fcda [0,1,0,0,0,0|2,0,1]=4 220 B7R0.3 CC[C@H](C)COCF 4d1b50442964dee0f36120907b5bf9ca [0,1,0,0,0,0|2,0,1]=4 221 B7R0.3 CC[C@H](C)NCCF c11007e79ee49cb1e974e79b53eb68c8 [0,1,0,0,0,0|2,0,1]=4 222 B7R0.3 CC[C@H](C)NCCO 14df35d641eb74814d616543d777742c [0,1,0,0,0,0|2,0,1]=4 223 B7R0.3 CC[C@H](C)NCCS e1691e0903c1eea23ce2232b4f4ff483 [0,1,0,0,0,0|2,0,1]=4 224 B7R0.3 CC[C@H](C)NCOC 487baefd593a366fd401fe5a0b33d07a [0,1,0,0,0,0|2,0,1]=4 225 B7R0.3 CC[C@H](C)NCSC b4999c020810a33e4d86f949175dda2d [0,1,0,0,0,0|2,0,1]=4 226 B7R0.3 CC[C@H](C)OCCF b495df4c5acd12e724246ab7aab5bcc3 [0,1,0,0,0,0|2,0,1]=4 227 B7R0.3 CC[C@H](C)OCCS d78ff3c7dda26d3bc7cef65283cd3558 [0,1,0,0,0,0|2,0,1]=4 228 B7R0.3 CC[C@H](C)OCOC 841bb4da5d82dffee5f6f29fdb10c40b [0,1,0,0,0,0|2,0,1]=4 229 B7R0.3 CC[C@H](C)OCSC 879c6380126ff9fd0bdc6f15a431ea23 [0,1,0,0,0,0|2,0,1]=4 230 B7R0.3 CN(CF)CCCO d4f0b34db0d9c626af3b938b320480ee [0,1,0,0,0,0|3,0,0]=4 231 B7R0.3 CN(CO)CCCO 50d216450d408b356dcec2a42a299a65 [0,1,0,0,0,0|3,0,0]=4 232 B7R0.3 CNC(=O)CNC#N 7ba4abe3fad3b11746e82f87bf46d0a1 [0,1,0,0,0,0|2,0,1]=4 233 B7R0.3 CNC(=O)CNC=O c5a039538783b02b98603872d662eafb [0,1,0,0,0,0|2,0,1]=4 234 B7R0.3 CNC(=O)CNCF d5935a4dfdc95c99073aff1d972a237b [0,1,0,0,0,0|2,0,0]=3 235 B7R0.3 CNC(=O)CNCO 2e658419398257218282eb38e85373dc [0,1,0,0,0,0|2,0,0]=3 236 B7R0.3 CNC(=O)COCF ee658a087bac7b7433b26d422d1c0261 [0,1,0,0,0,0|2,0,0]=3 237 B7R0.3 COC(=O)CNC#N 05f4cf7e93aff5d764fa5ad76ede0782 [0,1,0,0,0,0|2,0,1]=4 238 B7R0.3 COC(=O)CNC=O 4035363612cad4721a397e3e776f2bc3 [0,1,0,0,0,0|2,0,1]=4 239 B7R0.3 COC(=O)CNCF d0cb09e31ddbdd9ba78eb9af662306ae [0,1,0,0,0,0|2,0,0]=3 240 B7R0.3 COC(=O)CNCO 4580192aaef22809041b4d69cba5e872 [0,1,0,0,0,0|2,0,0]=3 241 B7R0.3 COC(=O)COCF fd3305c5ca341d194c1950aa91cbc248 [0,1,0,0,0,0|2,0,0]=3 242 B7R0.3 COCCN(C)CF cbc818a22d9e0a334cc2dbb905dc990d [0,1,0,0,0,0|3,0,0]=4 243 B7R0.3 COCCN(C)CO f3ab77dcf49e4ea629dcebe32a49a2b1 [0,1,0,0,0,0|3,0,0]=4 244 B7R0.3 CSCCN(C)CF 890b5ffb8cf7a6973b2ee7dfd458ffb1 [0,1,0,0,0,0|3,0,0]=4 245 B7R0.3 CSCCN(C)CO 3bce2c59e540fe3e66c7fb7a4d29cc3f [0,1,0,0,0,0|3,0,0]=4 246 B7R0.3 N#CCNC(=O)CF 22102b1fd1778f1d4d858f860cd4e7f5 [0,1,0,0,0,0|2,0,1]=4 247 B7R0.3 N#CCNC(=O)CO 8dbd9904ced2105da92f338ff81f2cd3 [0,1,0,0,0,0|2,0,1]=4 248 B7R0.3 N#CCNC(=O)CS 86a7da4cf1eaa1e98a4819073113dcc9 [0,1,0,0,0,0|2,0,1]=4 249 B7R0.3 N#CNCC(=O)CO 70d7ce6c717a89b56589c42b1345533c [0,1,0,0,0,0|2,0,1]=4 250 B7R0.3 O=C(CF)NCCBr 673baad86e5eefbb1b8c6ebb8cd73ae0 [0,1,0,0,0,0|2,0,0]=3 251 B7R0.3 O=C(CF)NCCF 67f25bcd080b5d85cd6525c56f31ea47 [0,1,0,0,0,0|2,0,0]=3 252 B7R0.3 O=C(CF)NCCI 1267d8b8b0da94faf267955e2b6d3339 [0,1,0,0,0,0|2,0,0]=3 253 B7R0.3 O=C(CF)NCCO 249c36c08dc5400834b319c39099c4e4 [0,1,0,0,0,0|2,0,0]=3 254 B7R0.3 O=C(CF)NCCS 6fbf26912db8657dfac73b7a38962924 [0,1,0,0,0,0|2,0,0]=3 255 B7R0.3 O=C(CNCF)NO 56dda9ea00f77e2491394a26c36ddff8 [0,1,0,0,0,0|3,0,0]=4 256 B7R0.3 O=C(CNCO)NO be629e88994a31d4135b42794d1a980e [0,1,0,0,0,0|3,0,0]=4 257 B7R0.3 O=C(CO)NCCBr 0d2e958569fc4d07a30343b37bac9c1d [0,1,0,0,0,0|2,0,0]=3 258 B7R0.3 O=C(CO)NCCF b7f1aa95ae5b9ced38af3286ec11730a [0,1,0,0,0,0|2,0,0]=3 259 B7R0.3 O=C(CO)NCCI 800c7155616705269676d2b386ed78aa [0,1,0,0,0,0|2,0,0]=3 260 B7R0.3 O=C(CO)NCCO 50003864fda33c69c3e5fa91ade641a0 [0,1,0,0,0,0|2,0,0]=3 261 B7R0.3 O=C(CO)NCCS 26e52ec354a3b7189e72bcae6a8d0219 [0,1,0,0,0,0|2,0,0]=3 262 B7R0.3 O=C(CS)NCCBr 4b08241ea1d7b8a0c4334c82506d75b0 [0,1,0,0,0,0|2,0,0]=3 263 B7R0.3 O=C(CS)NCCF d3c5664c15544d35b4683a8663e5b57d [0,1,0,0,0,0|2,0,0]=3 264 B7R0.3 O=C(CS)NCCI 95020692b0f8665c0c31cb074bf3f310 [0,1,0,0,0,0|2,0,0]=3 265 B7R0.3 O=C(CS)NCCO 1770b4a33c0d2574e46d3e387e79cf7a [0,1,0,0,0,0|2,0,0]=3 266 B7R0.3 O=C(CS)NCCS a9285f587f9c002b8ab7f77509aee977 [0,1,0,0,0,0|2,0,0]=3 267 B7R0.3 O=CC(=O)NCCBr 2e764955e5b027229dc47aa131dbf662 [0,1,0,0,0,0|2,0,1]=4 268 B7R0.3 O=CC(=O)NCCF fc9621fe97219629ab963b2546f4b25a [0,1,0,0,0,0|2,0,1]=4 269 B7R0.3 O=CC(=O)NCCI e0a4f5a8499d8d769053243c1c1c0e74 [0,1,0,0,0,0|2,0,1]=4 270 B7R0.3 O=CC(=O)NCCO 0f54c9d799f4c0c4875a4c5afe26d691 [0,1,0,0,0,0|2,0,1]=4 271 B7R0.3 O=CC(=O)NCCS 8f21f47feaeb7f9710321d6778c69f89 [0,1,0,0,0,0|2,0,1]=4 272 B7R0.5 CC(C)N(C)CCF bb72ad0b6f8866b4436bef306a64fc30 [0,1,0,0,0,0|3,0,0]=4 273 B7R0.5 CC(C)N(C)CCO 81a28f5ee4f12e11b2d2f617ef1d3581 [0,1,0,0,0,0|3,0,0]=4 274 B7R0.5 CC(C)N(C)CCS c1764d6a23c86a90688037664afc4e82 [0,1,0,0,0,0|3,0,0]=4 275 B7R0.5 CC(O)C(=O)NC#N 01e60f22707e7d0fb66c0132404764a4 [0,1,0,0,0,0|2,0,1]=4 276 B7R0.5 CC(S)C(=O)NC#N 2287f22575cb61afc24dc510a74ce003 [0,1,0,0,0,0|2,0,1]=4 277 B7R0.5 CCCN(C)C(=O)C 2d9bc06e064dcb0b82800ab570f2482e [0,1,0,0,0,0|2,0,1]=4 278 B7R0.5 CCCN(C)C(C)C 3141e8fbdc6c20712cffde27068901ab [0,1,0,0,0,0|2,0,0]=3 279 B7R0.5 CCNC(C)C(C)C 6ff6c70a41ff0de8b891e50966ef9339 [0,1,0,0,0,0|2,0,1]=4 280 B7R0.5 CCNC(C)C(C)O 392d96cf423ba6d8f5882a82ddace883 [0,1,0,0,0,0|2,0,1]=4 281 B7R0.5 CCN[C@@H](C)C(C)C 54d4aa17c71caa18f971b7cc220c5c61 [0,1,0,0,0,0|2,0,1]=4 282 B7R0.5 CCN[C@H](C)C(C)C 26ce300d7da809c460e59e21a4343853 [0,1,0,0,0,0|2,0,1]=4 283 B7R0.5 CCOC(C)C(C)C bb142acd6bd0d3536405c513b06eea53 [0,1,0,0,0,0|2,0,1]=4 284 B7R0.5 CCOC(C)C(C)S e76d621ef1113c6e6d1e86237ce3aa29 [0,1,0,0,0,0|2,0,1]=4 285 B7R0.5 CCO[C@@H](C)C(C)C 730945e6bcfbc2b11622279903eef1de [0,1,0,0,0,0|2,0,1]=4 286 B7R0.5 CCO[C@H](C)C(C)C 443e2922f1cca86413940e6d728bd16d [0,1,0,0,0,0|2,0,1]=4 287 B7R0.5 COCN(C)C(C)C 56238f6328cf364463db0f0876210615 [0,1,0,0,0,0|3,0,0]=4 288 B7R0.5 CSCN(C)C(C)C 6bade958cb762672bfe3ad82fb307ca1 [0,1,0,0,0,0|3,0,0]=4 289 B7R0.5 C[C@@H](O)C(=O)NC#N 76e3f6ef549e300db1d42264e90cbc8a [0,1,0,0,0,0|2,0,1]=4 290 B7R0.5 C[C@H](O)C(=O)NC#N 014f599d32718a67561cd4fc505950a1 [0,1,0,0,0,0|2,0,1]=4 291 B7R0.7 C#CCN(C)CCC 612e0a8dc259a7d3bd70bcd5ce21a061 [0,1,0,0,0,0|2,0,1]=4 292 B7R0.7 C=CCN(C)CCC 4db190253ad01fc85a9136b104142548 [0,1,0,0,0,0|2,0,1]=4 293 B7R0.7 CCCC(=O)NC#N 766b016c5624be50103f3a22e25698f4 [0,1,0,0,0,0|1,0,1]=3 294 B7R0.7 CCCC(=S)OCC 1c7e19bdea536ef2f89edad836560238 [0,1,0,0,0,0|0,1,0]=2 295 B7R0.7 CCCC(=S)OCF 8dc901968f3491ced45b3f4cde755440 [0,1,0,0,0,0|1,1,0]=3 296 B7R0.7 CCCC(C)NCC 30687af6c4de8dad0ff98831d5157fbe [0,1,0,0,0,0|1,0,1]=3 297 B7R0.7 CCCC(C)NCF 6fe7178c87e8240823259ce8a94eea0d [0,1,0,0,0,0|2,0,1]=4 298 B7R0.7 CCCC(C)NCO a80a7e4a0f1d75fc2436d616e073099f [0,1,0,0,0,0|2,0,1]=4 299 B7R0.7 CCCC(C)OCC f8a13dff786165aad9d4cfd77470c868 [0,1,0,0,0,0|1,0,1]=3 300 B7R0.7 CCCC(C)OCF e53aa9a0be571d844376e05ef43b0243 [0,1,0,0,0,0|2,0,1]=4 301 B7R0.7 CCCN(C)CC#N c34e551c8e457e324f03b5cf2a22f014 [0,1,0,0,0,0|2,0,1]=4 302 B7R0.7 CCCN(C)CC=O 1c62a002dac50aaed88f0fc6ab9f5e8c [0,1,0,0,0,0|2,0,1]=4 303 B7R0.7 CCCN(C)CCC e4ba1afb5991f60dfc5178c264d147ac [0,1,0,0,0,0|2,0,0]=3 304 B7R0.7 CCCN(C)CCF 20bdd855ba3f41de089f8838592d613e [0,1,0,0,0,0|2,0,0]=3 305 B7R0.7 CCCN(C)CCO 78d0d1ebbc45bccd6d086b71283c0541 [0,1,0,0,0,0|2,0,0]=3 306 B7R0.7 CCCN(C)CCS b66b0b7cd1a916850f3ad9b440f8c270 [0,1,0,0,0,0|2,0,0]=3 307 B7R0.7 CCCN(C)COC 1bec3c8fb3df3a096c65e4d1b6c5e3f1 [0,1,0,0,0,0|2,0,0]=3 308 B7R0.7 CCCN(C)CSC 08af67ba2c61bafd912a4ccbd1478a94 [0,1,0,0,0,0|2,0,0]=3 309 B7R0.7 CCC[C@@H](C)OCC ad566fabe40b68a5eff8830d607c6d5f [0,1,0,0,0,0|1,0,1]=3 310 B7R0.7 CCC[C@@H](C)OCF 7663802c803efdb5ffdb71e415c741b7 [0,1,0,0,0,0|2,0,1]=4 311 B7R0.7 CCC[C@H](C)NCC 753d5a7572fe2b9f2fd164a2491a308c [0,1,0,0,0,0|1,0,1]=3 312 B7R0.7 CCC[C@H](C)NCF bb5a2f2a6bcb2a0616cca7690ac17090 [0,1,0,0,0,0|2,0,1]=4 313 B7R0.7 CCC[C@H](C)NCO b51a8cc4d30d5ddff8232517fc6ea6d0 [0,1,0,0,0,0|2,0,1]=4 314 B7R0.7 CCC[C@H](C)OCC 1fee3bcf808f20e21cce64abf5182523 [0,1,0,0,0,0|1,0,1]=3 315 B7R0.7 CCC[C@H](C)OCF aaf4041a99f006e154459098e0beb231 [0,1,0,0,0,0|2,0,1]=4 316 B7R0.7 CCNC(C)CCO 6d74a4cbe1e8603263eb7a06e9e0b8fd [0,1,0,0,0,0|2,0,1]=4 317 B7R0.7 CCNC(C)COC af3d09b9c16b18b44031a6b489b2fd56 [0,1,0,0,0,0|2,0,1]=4 318 B7R0.7 CCN[C@@H](C)CCO 120d76e4d5f3a5851fb1fd775a67dcd3 [0,1,0,0,0,0|2,0,1]=4 319 B7R0.7 CCN[C@@H](C)COC 3587673ce83b198299c531f233570bde [0,1,0,0,0,0|2,0,1]=4 320 B7R0.7 CCN[C@H](C)CCO d88e997127477e2d2a92514b9d55e900 [0,1,0,0,0,0|2,0,1]=4 321 B7R0.7 CCN[C@H](C)COC 769259f23e0c7be858a9664721e9e588 [0,1,0,0,0,0|2,0,1]=4 322 B7R0.7 CCOC(C)COC fe243350564a7dc6ae1ae7113d5524f6 [0,1,0,0,0,0|2,0,1]=4 323 B7R0.7 CCOC(C)CSC e325c79726bf48130f9e676fa3908dca [0,1,0,0,0,0|2,0,1]=4 324 B7R0.7 CCO[C@@H](C)COC f439908527642fb0fb69029fa9f8bc89 [0,1,0,0,0,0|2,0,1]=4 325 B7R0.7 CCO[C@H](C)COC 9a86a7ea1ccd0f751a8074ffc2bb4277 [0,1,0,0,0,0|2,0,1]=4 326 B7R0.7 CN(CCF)CCF bdb46c56f93255441856b85ff01eb9dd [0,1,0,0,0,0|3,0,0]=4 327 B7R0.7 CN(CCF)CCS 51a5a054c764c97b1b3f4764ff1b15f7 [0,1,0,0,0,0|3,0,0]=4 328 B7R0.7 CN(CCO)CCF 423bb7df0641cc2b0b9f40d044f22314 [0,1,0,0,0,0|3,0,0]=4 329 B7R0.7 CN(CCO)CCO ef0e337ef14d25ff6ba8a3c07f6d7053 [0,1,0,0,0,0|3,0,0]=4 330 B7R0.7 CN(CCO)CCS 8f9521937335f69fe4f66a692ec136fa [0,1,0,0,0,0|3,0,0]=4 331 B7R0.7 COCC(=O)NC#N e1a8b8d591fdb060371b5f9937269544 [0,1,0,0,0,0|2,0,1]=4 332 B7R0.7 COCN(C)CCF 462c4168e49a87fc94c059780d3b18c2 [0,1,0,0,0,0|3,0,0]=4 333 B7R0.7 COCN(C)CCO 5aba17f9d68b8c1f364bdcdaa93aa01e [0,1,0,0,0,0|3,0,0]=4 334 B7R0.7 CSCC(=O)NC#N b05a488e02281b18583d705ae1321716 [0,1,0,0,0,0|2,0,1]=4 335 B7R0.7 CSCN(C)CCF 9d16e27a475cba1630b67c24ce2c9bd7 [0,1,0,0,0,0|3,0,0]=4 336 B7R0.7 CSCN(C)CCO 7ed81f2aa884158a210c057b422414ea [0,1,0,0,0,0|3,0,0]=4 337 B7R0.7 N#CNC(=O)CCF 2d38b0a901d33b11182071085ffedd88 [0,1,0,0,0,0|2,0,1]=4 338 B7R0.7 N#CNC(=O)CCO 21159348c5eb316e27f10d66411c699d [0,1,0,0,0,0|2,0,1]=4 339 B7R0.7 N#CNC(=O)CCS 4c8d70dcb6c079601a678239569cd2dc [0,1,0,0,0,0|2,0,1]=4 340 B7R0.10 C#CC(=O)N(C)CC 4f67029623c6e5ee152bff61a129616e [0,1,0,0,0,0|1,0,2]=4 341 B7R0.10 C=CC(=O)N(C)CC 5cdce1a1cd893d8ab1284f8177670f55 [0,1,0,0,0,0|1,0,2]=4 342 B7R0.10 CCC(=O)N(C)CC 307c98a15c6ddf11013971017d018a3f [0,1,0,0,0,0|1,0,0]=2 343 B7R0.10 CCC(C)N(C)CC 7f98f3cb5d001a509589f6f457ffe6ca [0,1,0,0,0,0|2,0,0]=3 344 B7R0.10 CCC(C)N(C)CF d256e2823039dc8016c48630c6e9d811 [0,1,0,0,0,0|3,0,0]=4 345 B7R0.10 CCC(C)N(C)CO 1b36e6675b647f3c2b421b00c5b597a7 [0,1,0,0,0,0|3,0,0]=4 346 B7R0.10 CCN(C)C(=O)C=O db5732fec82020b1e06387d47e0f63dc [0,1,0,0,0,0|2,0,1]=4 347 B7R0.10 CCN(C)C(=O)CF 54aaf1a54644f658afd3f400769d8763 [0,1,0,0,0,0|2,0,0]=3 348 B7R0.10 CCN(C)C(=O)CO ed09d31f2cea5da5288bffcd06a685cb [0,1,0,0,0,0|2,0,0]=3 349 B7R0.10 CCN(C)C(=O)CS 733bcf40a4acbb7ca1e0cf3589cee1e7 [0,1,0,0,0,0|2,0,0]=3 350 B7R0.10 CCN(C)C(C)CO bebabfe649434d11c02db23f8c999491 [0,1,0,0,0,0|3,0,0]=4 351 B7R0.10 CCN(C)[C@@H](C)CO 0928581d52d4c504aa98f7d51aa86889 [0,1,0,0,0,0|3,0,0]=4 352 B7R0.10 CCN(C)[C@H](C)CO 9f8b649df632bf19345f656ecd33a6ed [0,1,0,0,0,0|3,0,0]=4 353 B7R0.11 CCNC(C)(C)CC adae57986ab49a20b402c3b11b898ff8 [0,1,0,0,0,0|2,0,1]=4 354 B7R0.12 C#CC(CC)OCC 6abeb838fcea8b6a2cba4e33dc1c0f32 [0,1,0,0,0,0|2,0,1]=4 355 B7R0.12 C=CC(CC)OCC 3384f4e6ac585bde2972dae19026fd2c [0,1,0,0,0,0|2,0,1]=4 356 B7R0.12 CCCN(C=O)CC c9c4d92e42201b75307332d9c7692aa9 [0,1,0,0,0,0|1,0,0]=2 357 B7R0.12 CCCN(CC)CC cee9a7f56e1e423b5ee592f89dcd5a79 [0,1,0,0,0,0|2,0,0]=3 358 B7R0.12 CCCN(CC)CF bb959a7f19e3a674eec89c0630b059f9 [0,1,0,0,0,0|2,0,0]=3 359 B7R0.12 CCCN(CC)CO 0db6153d76ded508e5655e9e69753d11 [0,1,0,0,0,0|1,0,1]=3 360 B7R0.12 CCN(C=O)CC#N 5144a4fd650d7585538e4f3d90f2669b [0,1,0,0,0,0|2,0,1]=4 361 B7R0.12 CCN(C=O)CCCl 03512ce3018e8845973ab6d439faef81 [0,1,0,0,0,0|2,0,0]=3 362 B7R0.12 CCN(C=O)CCO f06d113e63228ddd0fbad99b8e842127 [0,1,0,0,0,0|2,0,0]=3 363 B7R0.12 CCN(CC)CCCl af83f640ef226b8187817c489013777d [0,1,0,0,0,0|3,0,0]=4 364 B7R0.12 CCN(CC)CCO 3ebc0ce6d105088470f67e45ca611640 [0,1,0,0,0,0|3,0,0]=4 365 B7R0.12 CCN(CF)CCCl 43d98c1b9c6047c990dec488ba94ffde [0,1,0,0,0,0|3,0,0]=4 366 B7R0.12 CCN(CF)CCO 94620f9ce7407b818d47be3cba0eb6a5 [0,1,0,0,0,0|3,0,0]=4 367 B7R0.12 CCN(CO)CCCl d55a60f7f194d512983e9fafa067d11c [0,1,0,0,0,0|2,0,1]=4 368 B7R0.12 CCN(CO)CCO 7d4857243f6d87024376644d456f8437 [0,1,0,0,0,0|2,0,1]=4 369 B7R0.12 CCNC(CC)CC dd1a7011b4f855f8c1ad87e5ad908f9a [0,1,0,0,0,0|2,0,1]=4 370 B7R0.12 CCNC(CC)CO 69eb8cb0bab039daf9654224be723bd4 [0,1,0,0,0,0|1,0,2]=4 371 B7R0.12 CCN[C@@H](CC)CO 58754a8a804d698e6257db6bc4cb95b3 [0,1,0,0,0,0|1,0,2]=4 372 B7R0.12 CCN[C@H](CC)CO 5b608cb220323f541c9afa99df78f847 [0,1,0,0,0,0|1,0,2]=4 373 B7R0.12 CCOC(C#N)CC 7e047b05d0e19c947a2b74261d14c997 [0,1,0,0,0,0|2,0,1]=4 374 B7R0.12 CCOC(CC)CC 60351d1ac9a51febe159ba00076742a6 [0,1,0,0,0,0|2,0,1]=4 375 B7R0.12 O=CN(CO)CCO 04adc48d7b0506cc852e54ed640113a1 [0,1,0,0,0,0|3,0,0]=4 376 B7R1.1 CCN1CCSC1 730634b8317de27b8a9a28fdabe291cf [0,0,0,1,0,0|3,0,0]=4 377 B7R1.5 CCNC1CC1C f508b0aca7d0eee090ca628f208f8e9f [0,0,0,1,0,0|2,0,1]=4 378 B7R1.6 CCCN1CCC1 a259a8722cbac8bcd506f8443743eda0 [0,0,0,1,0,0|2,0,0]=3 379 B7R1.6 CCNC1CCC1 70dad6b0302b94a460da5136f772c3a8 [0,0,0,1,0,0|2,0,1]=4 380 B7R1.6 CCOC1CCC1 1be1aa1621ba0b71d53802beb6ef9946 [0,0,0,1,0,0|2,0,1]=4 381 B7R1.6 COCN1CCC1 fdad72c8566c59cd906eeb990103d9b4 [0,0,0,1,0,0|3,0,0]=4 382 B7R1.6 CSCN1CCC1 8d8000922b7cbeced70675a205703dc0 [0,0,0,1,0,0|3,0,0]=4 383 B7R1.6 FCCN1CCC1 52ac16ebd7ad59d3186f1b7ac85be8d4 [0,0,0,1,0,0|3,0,0]=4 384 B7R1.6 OCCN1CCC1 1d260cf3c54be4529d167a32e498c498 [0,0,0,1,0,0|3,0,0]=4 385 B7R1.6 SCCN1CCC1 ec2df4a9d0cd081fc93da3aeca69b593 [0,0,0,1,0,0|3,0,0]=4 386 B7R1.10 CCN1CC(C1)F 32dfb695f78a1b5517c30939c82ebced [0,0,0,1,0,0|3,0,0]=4 387 B7R1.10 CCN1CC(C1)O 64169be24f24ac0d0d4e63cfda9c5a6f [0,0,0,1,0,0|3,0,0]=4 388 B7R1.21 CCNC1(CC1)C 49ee171fcc771c5e16d08c11c421eefd [0,0,0,1,0,0|2,0,1]=4 389 B7R1.22 CCN(C)C1CC1 476aa428dda8fdb06e16725a89d0042d [0,0,0,1,0,0|2,0,0]=3 390 B7R1.22 CN(CF)C1CC1 54383ec2d9da18df279ed6de4a3d8d6d [0,0,0,1,0,0|3,0,0]=4 391 B7R1.22 CN(CO)C1CC1 6f2172a1520d8d373b29f297b52bc26d [0,0,0,1,0,0|3,0,0]=4 392 B6R0.3 CCN(C)C(=O)C ad9227383f4996d412a5ced11e9c5417 [1,1,0,0,0,0|1,0,0]=3 393 B6R0.4 C#CCNC(=O)C 4ea0ed9dc6fd35fd030056afb0c47f4f [1,1,0,0,0,0|0,0,2]=4 394 B6R0.4 C=C(Br)CNCC 6e3319104262483598a48b6dc3c212f9 [1,1,0,0,0,0|1,0,1]=4 395 B6R0.4 C=C(Br)COCC 4e277d2c9c73644afe7a0bce57cdf0b5 [1,1,0,0,0,0|1,0,1]=4 396 B6R0.4 C=C(C)CNCC ebc18c3c665b43c324efb5852b5613cc [1,1,0,0,0,0|1,0,0]=3 397 B6R0.4 C=C(C)CNCF 1e221a22fcfa2f630690e0e1cc1b686c [1,1,0,0,0,0|2,0,0]=4 398 B6R0.4 C=C(C)CNCO aed1efb8ed6b634f66b125805c14e3c3 [1,1,0,0,0,0|2,0,0]=4 399 B6R0.4 C=C(C)COCC 6d74b37620be58d1bea5b1911ab2feb1 [1,1,0,0,0,0|1,0,0]=3 400 B6R0.4 C=C(C)COCF cb102a3037e49fdd230dfa87a9a6cd9a [1,1,0,0,0,0|2,0,0]=4 401 B6R0.4 C=C(Cl)COCC 7e83f9548d27b7a69b77fbea42966073 [1,1,0,0,0,0|1,0,1]=4 402 B6R0.4 C=C(F)COCC 1657b1ef40f20a415ed1946b6e445fbb [1,1,0,0,0,0|1,0,1]=4 403 B6R0.4 C=C(I)COCC 91286c7e570d24c12cb1f7709ecbaf14 [1,1,0,0,0,0|1,0,1]=4 404 B6R0.4 CC(=O)CNC=O 799a78176c711722415c8986d9015770 [1,1,0,0,0,0|1,0,1]=4 405 B6R0.4 CC(=O)CNCF b7881e88fb8b8e6cf10e5a033e11f317 [1,1,0,0,0,0|1,0,0]=3 406 B6R0.4 CC(=O)CNCO 088e087d20fb510bb88def586900e34f [1,1,0,0,0,0|1,0,0]=3 407 B6R0.4 CC(=O)COCF dfbfbe0c756744937aaeae603856ac60 [1,1,0,0,0,0|1,0,0]=3 408 B6R0.4 CC(=O)NCC#N 06834e3e3e893456bdb75cd1758cd048 [1,1,0,0,0,0|1,0,1]=4 409 B6R0.4 CC(=O)NCCBr a50b84b8e00a5eea33926a7cde86e5c2 [1,1,0,0,0,0|1,0,0]=3 410 B6R0.4 CC(=O)NCCF 40474d3cc8ff0aef7c3ef76344b9eebb [1,1,0,0,0,0|1,0,0]=3 411 B6R0.4 CC(=O)NCCI baf3590450994f173452759880fb646a [1,1,0,0,0,0|1,0,0]=3 412 B6R0.4 CC(=O)NCCO c7b03ecf194f0f03f4d08fd319920ef5 [1,1,0,0,0,0|1,0,0]=3 413 B6R0.4 CC(=O)NCCS 3cdd66626928bc1a9bac11e682b344a1 [1,1,0,0,0,0|1,0,0]=3 414 B6R0.4 CCCNC(=O)C 2a730f252c249036b45b0d2d9cd73ca4 [1,1,0,0,0,0|0,0,0]=2 415 B6R0.4 CCCNC(C)C 4cc952815a9d9d6816d0fb90ac14a178 [1,1,0,0,0,0|1,0,1]=4 416 B6R0.4 CCCOC(C)C 9e8901dd10ed96aa593b6a5525365a05 [1,1,0,0,0,0|1,0,1]=4 417 B6R0.4 CCNCC(=O)C f174d94c45d739e3b909d0bcb7f774b6 [1,1,0,0,0,0|0,0,0]=2 418 B6R0.4 CCNCC(=O)N 9af72e08b410c4df60bd96241a267974 [1,1,0,0,0,0|1,0,0]=3 419 B6R0.4 CCNCC(=O)O 4ff54ca579c6d0dc364629f4b9806db8 [1,1,0,0,0,0|1,0,0]=3 420 B6R0.4 CCNCC(C)C 7e39c7f79a4a74429f1ae559b7eef67a [1,1,0,0,0,0|1,0,1]=4 421 B6R0.4 CCNCC(C)O 23f38b24d1514a42c01693786c45a1e6 [1,1,0,0,0,0|0,0,2]=4 422 B6R0.4 CCNC[C@@H](C)O 72a96453a23c9791f4ab7ea0647d5c76 [1,1,0,0,0,0|0,0,2]=4 423 B6R0.4 CCNC[C@H](C)O 8a893664491d34251811ef315cfcf0f6 [1,1,0,0,0,0|0,0,2]=4 424 B6R0.4 CCOCC(=O)C 810b545b1a0c4af358d406c93928b4de [1,1,0,0,0,0|0,0,0]=2 425 B6R0.4 CCOCC(=O)N 8c3995d7bbe4bbb5793da2590cf6473e [1,1,0,0,0,0|1,0,0]=3 426 B6R0.4 CCOCC(=O)O ebe16b0612391447f19756491b2bd7a3 [1,1,0,0,0,0|1,0,0]=3 427 B6R0.4 CCOCC(=S)N 193178db836031b13efc39b5ff902efa [1,1,0,0,0,0|1,1,0]=4 428 B6R0.4 CCOCC(C)C 2ccacce0745bb2fe2e67c6f95de49a4c [1,1,0,0,0,0|1,0,1]=4 429 B6R0.4 CCOCC(C)F 44ebcc9497b122666f7d5bc3ab3ef961 [1,1,0,0,0,0|1,0,1]=4 430 B6R0.4 CCOCC(C)S 1b6e2c538b0c5040f1c381953bd73f14 [1,1,0,0,0,0|0,1,1]=4 431 B6R0.4 CCOCS(=O)O 631a28bb34068ba6343c83c466f36b33 [1,1,0,0,0,0|2,0,0]=4 432 B6R0.4 CCOC[C@@H](C)F 2d70ac2d3ad9d2770f50309e83cd9521 [1,1,0,0,0,0|1,0,1]=4 433 B6R0.4 CCOC[C@H](C)F b1411946299fa054261b7f4dedb203a5 [1,1,0,0,0,0|1,0,1]=4 434 B6R0.4 NC(=O)CNCF 1d1f788bdfbf1bf0db2a27d18231d6bd [1,1,0,0,0,0|2,0,0]=4 435 B6R0.4 NC(=O)CNCO d301de02518fc5358c97c5b15c4b68ec [1,1,0,0,0,0|2,0,0]=4 436 B6R0.4 NC(=O)COCF 5fb009cd2e813c9f1f9e35766b0ec8cb [1,1,0,0,0,0|2,0,0]=4 437 B6R0.4 O=C(O)CNCF d8e91f69db1ad3140a3502718cd0d10f [1,1,0,0,0,0|2,0,0]=4 438 B6R0.4 O=C(O)CNCO 03950869097643d435459ad5a0985e95 [1,1,0,0,0,0|2,0,0]=4 439 B6R0.4 O=C(O)COCF 7c32fa44d83e7ce6c73842137b12fe20 [1,1,0,0,0,0|2,0,0]=4 440 B6R0.6 C#CCCNCC 1f87af2c40b1a88e3547559e235746b5 [1,1,0,0,0,0|1,0,1]=4 441 B6R0.6 C#CCCOCC 949a5248ab77dc0ee2e21f1625533803 [1,1,0,0,0,0|1,0,1]=4 442 B6R0.6 C#CCNCCC 2f565aea009adc9794b09620d2466479 [1,1,0,0,0,0|1,0,1]=4 443 B6R0.6 C#CCOCCC 07db973fd9ed633d1826ec45446b3187 [1,1,0,0,0,0|1,0,1]=4 444 B6R0.6 C/C=C/COCC 38bee8c8a9ca6a51c65d50ef4a373d85 [1,1,0,0,0,0|0,0,1]=3 445 B6R0.6 C/C=C/COCF f876c9a9946a26dc2666a1d7b3c464e2 [1,1,0,0,0,0|1,0,1]=4 446 B6R0.6 C/C=C\COCC ec2c513a47c68c3910a66e2b1ca05a58 [1,1,0,0,0,0|0,0,1]=3 447 B6R0.6 C/C=C\COCF 4437c9e2b6a458c6fd2a427b36a619ed [1,1,0,0,0,0|1,0,1]=4 448 B6R0.6 C=CCCNCC e2aebda5e16fd2d2916f2bc1829c315b [1,1,0,0,0,0|1,0,1]=4 449 B6R0.6 C=CCCOCC 6e23d9941af9b2d0c85f8cbdda9dfc6d [1,1,0,0,0,0|1,0,1]=4 450 B6R0.6 C=CCNCCC 4ba17ed70ce803f63c3c4c2f245e9995 [1,1,0,0,0,0|1,0,1]=4 451 B6R0.6 C=CCOCCC 1dbb1c31b2e886af57d9e977bbb54c80 [1,1,0,0,0,0|1,0,1]=4 452 B6R0.6 CC#CCNCC a6f1b76f7ded3d3d75d35a122acc0b8f [1,1,0,0,0,0|0,0,2]=4 453 B6R0.6 CC#CCOCC 150599371f7a5020048fdfb73583470c [1,1,0,0,0,0|0,0,2]=4 454 B6R0.6 CC=CCNCC bcab2e681f9487cbafa8d0c52ed70b5a [1,1,0,0,0,0|0,0,1]=3 455 B6R0.6 CC=CCNCF 92c4cdfc4b494474241467ecc4ab1212 [1,1,0,0,0,0|1,0,1]=4 456 B6R0.6 CC=CCNCO c2d6aa2f6263348f8e93d5ad39fb9704 [1,1,0,0,0,0|1,0,1]=4 457 B6R0.6 CC=CCOCC 1bf4842cf68ff7130be8f9549d740c80 [1,1,0,0,0,0|0,0,1]=3 458 B6R0.6 CC=CCOCF edbe5371c567ee2412f3784e58a84892 [1,1,0,0,0,0|1,0,1]=4 459 B6R0.6 CCCCNCC 92b5580e2e0a5bde623d85d4114fa5b8 [1,1,0,0,0,0|0,0,1]=3 460 B6R0.6 CCCCNCF 2dc017f5f1e2c9397dbf0c4166cd224f [1,1,0,0,0,0|1,0,1]=4 461 B6R0.6 CCCCNCO 618fd93ff0c440b25c4141ff5dfc5703 [1,1,0,0,0,0|1,0,1]=4 462 B6R0.6 CCCCOCC 95dd02bf16a1c429e6d73e015abd355f [1,1,0,0,0,0|0,0,1]=3 463 B6R0.6 CCCCOCF 0477e5eebf9ea464372af9c3f610bbb3 [1,1,0,0,0,0|1,0,1]=4 464 B6R0.6 CCCNCC#N 700c5060d13b84376c28debe23872de5 [1,1,0,0,0,0|1,0,1]=4 465 B6R0.6 CCCNCC=O 6f90aab08cc8a4799f8c9819fe03dcf0 [1,1,0,0,0,0|1,0,1]=4 466 B6R0.6 CCCNCCBr 4580e94d6156274002f94ca88fed008a [1,1,0,0,0,0|1,0,0]=3 467 B6R0.6 CCCNCCC 1b094650055fd0b18522f92a665c0499 [1,1,0,0,0,0|0,0,1]=3 468 B6R0.6 CCCNCCF 735cf6bc8c20816e92fa14d59534e4a3 [1,1,0,0,0,0|1,0,0]=3 469 B6R0.6 CCCNCCI 005cf13853f56eac57a7dac0ea522018 [1,1,0,0,0,0|1,0,0]=3 470 B6R0.6 CCCNCCO 6b27698ebbebd4cb74f83b272f0d15e6 [1,1,0,0,0,0|1,0,0]=3 471 B6R0.6 CCCNCCS 99a3fb47b747dc1242515be7d85bbd80 [1,1,0,0,0,0|1,0,0]=3 472 B6R0.6 CCCNCOC e97c2d5a22ce001afa1236daa1cad7bc [1,1,0,0,0,0|1,0,0]=3 473 B6R0.6 CCCNCSC 9d2bba1337aa149b0d3e1fa022653bf5 [1,1,0,0,0,0|1,0,0]=3 474 B6R0.6 CCCOCC#N e105adcae6a2d05300d2abe580f4db2b [1,1,0,0,0,0|1,0,1]=4 475 B6R0.6 CCCOCC=O a311990c6ea11edb5945b3bbc64330c1 [1,1,0,0,0,0|1,0,1]=4 476 B6R0.6 CCCOCCC 0a4e87c7914309a78635e74e08d2777c [1,1,0,0,0,0|0,0,1]=3 477 B6R0.6 CCCOCCF 89739e8ca8e097a040faf9b1b5d8fe97 [1,1,0,0,0,0|1,0,0]=3 478 B6R0.6 CCCOCCS 0132493e794a98d77c26358a94dc4e29 [1,1,0,0,0,0|1,0,0]=3 479 B6R0.6 CCCOCOC c11e71c41afe194d616e687f4176c864 [1,1,0,0,0,0|1,0,0]=3 480 B6R0.6 CCCOCSC 1c1d3e4eeaee5d66440c30d368585d8f [1,1,0,0,0,0|1,0,0]=3 481 B6R0.6 CCNCCC#N c72118a2f8fbc184811608d26943fad0 [1,1,0,0,0,0|1,0,1]=4 482 B6R0.6 CCNCCCCl f420c80c72cde7ae412c1f8074858784 [1,1,0,0,0,0|1,0,0]=3 483 B6R0.6 CCNCCCO 8cb6c3a632b620aeb28c86d99bc4b414 [1,1,0,0,0,0|1,0,0]=3 484 B6R0.6 CCNCCOC f1fb223c89b0752d151e88a41e5b29d9 [1,1,0,0,0,0|1,0,0]=3 485 B6R0.6 CCNCCON 8ffd4b6dce6c6f323c5766eadd20f707 [1,1,0,0,0,0|2,0,0]=4 486 B6R0.6 CCNCCSC 3a09ff3676749a10d2a9ca69484831c2 [1,1,0,0,0,0|1,0,0]=3 487 B6R0.6 CCOC/C=C/Cl da3696907b7fb9db442b9b20d9bcb8d2 [1,1,0,0,0,0|1,0,1]=4 488 B6R0.6 CCOCC=CCl c81d128531002285a68f4ce8014c7151 [1,1,0,0,0,0|1,0,1]=4 489 B6R0.6 CCOCCC#N d9853a6ec1c1aeff0229e06f57e329f8 [1,1,0,0,0,0|1,0,1]=4 490 B6R0.6 CCOCCC=O d3b853feb6192f624a9d6e96cbf29efa [1,1,0,0,0,0|1,0,1]=4 491 B6R0.6 CCOCCCF c39806e94fc6c284e7443799411e61ef [1,1,0,0,0,0|1,0,0]=3 492 B6R0.6 CCOCCCS 1518d71ef49a78a374e5431ada0f3cb8 [1,1,0,0,0,0|1,0,0]=3 493 B6R0.6 CCOCCOC dd0438a106c25c5532b546a1007f90ac [1,1,0,0,0,0|1,0,0]=3 494 B6R0.6 CCOCCSC 5ebca3b7e051ee8b31eb2b56fedcebce [1,1,0,0,0,0|1,0,0]=3 495 B6R0.6 COCCNCF e77dc04900c9c99d5994a5d30132520a [1,1,0,0,0,0|2,0,0]=4 496 B6R0.6 COCCNCO aeefc508a99790e9ff885514143e167b [1,1,0,0,0,0|2,0,0]=4 497 B6R0.6 COCCOCF c6fb5a621cf5e8cd94e24b0621578457 [1,1,0,0,0,0|2,0,0]=4 498 B6R0.6 COCNCCBr cc0c7490b746ceca79f01407d355ea03 [1,1,0,0,0,0|2,0,0]=4 499 B6R0.6 COCNCCF 2f29adbcc69c16fb45653c78fbf21233 [1,1,0,0,0,0|2,0,0]=4 500 B6R0.6 COCNCCI 397b4e96463dc133fb2c78ebc9b4b8aa [1,1,0,0,0,0|2,0,0]=4 501 B6R0.6 COCNCCO d157601c59ef2c697e67935359e46769 [1,1,0,0,0,0|2,0,0]=4 502 B6R0.6 COCNCCS 786afdf72bf335f5d127e835a740393a [1,1,0,0,0,0|2,0,0]=4 503 B6R0.6 COCOCCF 2e4d69c3ff16b703ccfaad8173ebee7c [1,1,0,0,0,0|2,0,0]=4 504 B6R0.6 COCOCCS fcfa81efb868e68483c1465ed07af8f4 [1,1,0,0,0,0|2,0,0]=4 505 B6R0.6 COCOCOC d3131f37af1710bbb3d5077bedf5507c [1,1,0,0,0,0|2,0,0]=4 506 B6R0.6 COCOCSC 260c220356aac0c84d20de9f8b1dabb1 [1,1,0,0,0,0|2,0,0]=4 507 B6R0.6 CSCCNCF f9e826d56784386e3fbd3943c2c335d4 [1,1,0,0,0,0|2,0,0]=4 508 B6R0.6 CSCCNCO d257ffa86b2e710c05d83eea0cd201f0 [1,1,0,0,0,0|2,0,0]=4 509 B6R0.6 CSCCOCF e4905492719aa8fe7bcec7641ead64f3 [1,1,0,0,0,0|2,0,0]=4 510 B6R0.6 CSCNCCBr bcad065c861badf94807934e6680f65f [1,1,0,0,0,0|2,0,0]=4 511 B6R0.6 CSCNCCF 80c1e887cd7ee5f3261a9c98dd841f62 [1,1,0,0,0,0|2,0,0]=4 512 B6R0.6 CSCNCCI d531c5e507282acb11ff5d835981aa6c [1,1,0,0,0,0|2,0,0]=4 513 B6R0.6 CSCNCCO e6ff3afea97e31bf42a862cf845047cf [1,1,0,0,0,0|2,0,0]=4 514 B6R0.6 CSCNCCS b1c5df5844cf8935aabb3648e61465f2 [1,1,0,0,0,0|2,0,0]=4 515 B6R0.6 CSCOCCF 79adbc24d28c875ba839b99727b1e512 [1,1,0,0,0,0|2,0,0]=4 516 B6R0.6 CSCOCCS 4bd5c15be5c967caa94433f55b38b0fd [1,1,0,0,0,0|2,0,0]=4 517 B6R0.6 FCCCOCF 0d2e96eb165fd76b18d8df4690900872 [1,1,0,0,0,0|2,0,0]=4 518 B6R0.6 FCCNCCBr c0dd83437a27180e7ee1639145895f8f [1,1,0,0,0,0|2,0,0]=4 519 B6R0.6 FCCNCCF 6bada8e319adf5ac09144c46a4ecaa71 [1,1,0,0,0,0|2,0,0]=4 520 B6R0.6 FCCNCCI 6f97b887bfc0689337515f90a40660b8 [1,1,0,0,0,0|2,0,0]=4 521 B6R0.6 FCCNCCS 5771e4e946cf04a10b11168c2a26cfba [1,1,0,0,0,0|2,0,0]=4 522 B6R0.6 FCCOCCF 834b8c77ba6896712d1d6af7c59dbfbc [1,1,0,0,0,0|2,0,0]=4 523 B6R0.6 FCCOCCS e5c5db3e08a0f53018e2b973416b7c32 [1,1,0,0,0,0|2,0,0]=4 524 B6R0.6 FCNCCCCl 44349a2e6a1b6f1dc0f8b9fd71ed7936 [1,1,0,0,0,0|2,0,0]=4 525 B6R0.6 FCOCCCS d4006571dbef2280a4ff5f23f38e7165 [1,1,0,0,0,0|2,0,0]=4 526 B6R0.6 OCCCNCF d0f340a016e65bbf382f89af7024bb1f [1,1,0,0,0,0|2,0,0]=4 527 B6R0.6 OCCCNCO 61393d5d06c9202c0b94fa047d6ff099 [1,1,0,0,0,0|2,0,0]=4 528 B6R0.6 OCCNCCBr 0fc2af5bc6b566cb15b8698ad81d8a28 [1,1,0,0,0,0|2,0,0]=4 529 B6R0.6 OCCNCCF d8f328cc7923b202178773c12bcca59d [1,1,0,0,0,0|2,0,0]=4 530 B6R0.6 OCCNCCI 5ea510c923b7656c706e335f0707f13f [1,1,0,0,0,0|2,0,0]=4 531 B6R0.6 OCCNCCO 5ec55d5ff951afeb186b052871d5aed1 [1,1,0,0,0,0|2,0,0]=4 532 B6R0.6 OCCNCCS 3dc5bdb4440e31f22d01b06893c66b5e [1,1,0,0,0,0|2,0,0]=4 533 B6R0.6 OCNCCCCl b5a3a94f1af195c7e59393df3fce5e89 [1,1,0,0,0,0|2,0,0]=4 534 B6R0.6 SCCNCCBr c48d02c84e30a7b9706b2ad380ca4923 [1,1,0,0,0,0|2,0,0]=4 535 B6R0.6 SCCNCCI 36ec37d0883791420ffed69138b467d3 [1,1,0,0,0,0|2,0,0]=4 536 B6R0.6 SCCNCCS 69e177fa948b956df81550ba37304c74 [1,1,0,0,0,0|2,0,0]=4 537 B6R0.6 SCCOCCS 87c2cb04f9bb7dbaacc12a2547a6f936 [1,1,0,0,0,0|2,0,0]=4 538 B8R0.2 C=C(C)C(=O)N(C)CC 6ad58cb6364f07a649e141535260901d [0,2,0,0,0,0|1,0,1]=4 539 B8R0.2 CC(C)N(C)C(=O)CO d1898419d3ec12ff050916a4a6cb896f [0,2,0,0,0,0|2,0,0]=4 540 B8R0.2 CCC(=O)N(C)C(C)C 3feb699597734e703dbc4fe539ecb6bb [0,2,0,0,0,0|1,0,0]=3 541 B8R0.2 CCC(C)N(C)C(C)C 5cfcc2695d4d86b7b3e42635fc9a7caa [0,2,0,0,0,0|2,0,0]=4 542 B8R0.2 CCN(C)C(=O)C(=O)C f60b3512bf731817ed8f594771284a74 [0,2,0,0,0,0|1,0,1]=4 543 B8R0.2 CCN(C)C(=O)C(C)F 19b9ff8d46076997b028bc3c05129e24 [0,2,0,0,0,0|1,0,0]=3 544 B8R0.2 CCN(C)C(=O)C(C)O a5352a247e4fbdbde43951bdd76212cf [0,2,0,0,0,0|1,0,0]=3 545 B8R0.2 CCN(C)C(=O)C(C)S 90f65a1dd234927c177aa83dd88742df [0,2,0,0,0,0|1,0,0]=3 546 B8R0.2 CCN(C)C(=O)C(F)F 173b22ed50254cc99077e9faadbe8b05 [0,2,0,0,0,0|2,0,0]=4 547 B8R0.2 CCN(C)C(=O)C(O)O e997434c90008a11252134a14784ebce [0,2,0,0,0,0|2,0,0]=4 548 B8R0.2 CCN(C)C(=O)[C@@H](C)F 98c85f2c98da43a1b0d0fc26fa39c6bb [0,2,0,0,0,0|1,0,0]=3 549 B8R0.2 CCN(C)C(=O)[C@@H](C)O c93f85b1b0b9a2ae0efa6c73e0a102c2 [0,2,0,0,0,0|1,0,0]=3 550 B8R0.2 CCN(C)C(=O)[C@H](C)F aea23cf9051deae31a359b32bf8bf1d7 [0,2,0,0,0,0|1,0,0]=3 551 B8R0.2 CCN(C)C(=O)[C@H](C)O fffa58851af97e9d3a93b166b97ca289 [0,2,0,0,0,0|1,0,0]=3 552 B8R0.2 CCN(C)C(C)C(C)C 63bc6c1ea4030c348ad97e4229fb9c6b [0,2,0,0,0,0|2,0,0]=4 553 B8R0.5 C=C(C)CN(C)CCC 67a547626d9fe48bc4d555dd9d8ee25d [0,2,0,0,0,0|2,0,0]=4 554 B8R0.5 CC(C)CC(=O)NC#N e0f6c1c62407c36da220e653124131f5 [0,2,0,0,0,0|1,0,1]=4 555 B8R0.5 CC(C)CN(C)CCF 710152e558acdec66d05a66b002702bb [0,2,0,0,0,0|2,0,0]=4 556 B8R0.5 CC(C)CN(C)CCO 88c09d521cd5d8864d09de40f53a5749 [0,2,0,0,0,0|2,0,0]=4 557 B8R0.5 CC(C)CN(C)CCS 0b3ba8d7f9060567fc9ae93ef8f9a73d [0,2,0,0,0,0|2,0,0]=4 558 B8R0.5 CC(O)CN(C)CCF d208e2a32e1219be6f4dc40c04cbf782 [0,2,0,0,0,0|2,0,0]=4 559 B8R0.5 CC(O)CN(C)CCO b8c93809fd363b893059df214df9a71f [0,2,0,0,0,0|2,0,0]=4 560 B8R0.5 CC(O)CN(C)CCS e7d6706e63901057284fa2788897ed93 [0,2,0,0,0,0|2,0,0]=4 561 B8R0.5 CCCC(=S)OC(C)C 79ff90d7e7d68c5664ea5acd6b8154a5 [0,2,0,0,0,0|0,1,0]=3 562 B8R0.5 CCCC(C)NC(C)C f8bb5c8de6d4ec16bb81d8451bfb16da [0,2,0,0,0,0|1,0,1]=4 563 B8R0.5 CCCC(C)OC(C)C af28c67907ad8e9b80a1443e1881a09f [0,2,0,0,0,0|1,0,1]=4 564 B8R0.5 CCCN(C)CC(C)C 2b43726cfeef4d65e0d306fc15d81329 [0,2,0,0,0,0|2,0,0]=4 565 B8R0.5 CCCN(C)CC(C)O ba71d19aa94a205bc2a8e63dac164472 [0,2,0,0,0,0|2,0,0]=4 566 B8R0.5 CCCN(C)CC(F)F 8d7496120ef329ed87a83856ed455d01 [0,2,0,0,0,0|2,0,0]=4 567 B8R0.5 CCCN(C)CN(C)C 725cda20ff150950ad5ab0e5958dcc55 [0,2,0,0,0,0|2,0,0]=4 568 B8R0.5 CCCN(C)C[C@@H](C)O e21d8a4c9925e7ebdd999960638ddfd2 [0,2,0,0,0,0|2,0,0]=4 569 B8R0.5 CCCN(C)C[C@H](C)O 8866f4aefe80bbaf9ef0e79e608206ab [0,2,0,0,0,0|2,0,0]=4 570 B8R0.5 CCC[C@@H](C)OC(C)C 38af500727caf5ac56759d6ba34645ea [0,2,0,0,0,0|1,0,1]=4 571 B8R0.5 CCC[C@H](C)NC(C)C f5cc882f68b964118786668968029765 [0,2,0,0,0,0|1,0,1]=4 572 B8R0.5 CCC[C@H](C)OC(C)C 39fe789680e7206034f6b275f2ba377c [0,2,0,0,0,0|1,0,1]=4 573 B8R0.5 CCNC(C)CC(C)C 865caec34869d14200fe8a23ded15c61 [0,2,0,0,0,0|1,0,1]=4 574 B8R0.5 CCNC(C)CC(C)O 43b202ae8ff1647314607d5a8e6eab62 [0,2,0,0,0,0|1,0,1]=4 575 B8R0.5 CCOC(C)CC(C)C 30e2f8e558cfdda4b507d2297dd2dc70 [0,2,0,0,0,0|1,0,1]=4 576 B8R0.5 CCO[C@@H](C)CC(C)C 1e2bdc5c56411fd3cd17ac1c2858063c [0,2,0,0,0,0|1,0,1]=4 577 B8R0.5 CCO[C@H](C)CC(C)C 914881db7ee4a9dab17d292ad412afd8 [0,2,0,0,0,0|1,0,1]=4 578 B8R0.5 COCN(C)CC(C)C ccfc06333099a194fdf9a9972dfaab0f [0,2,0,0,0,0|2,0,0]=4 579 B8R0.5 COCN(C)CC(C)O 236ef8cf66ea95220e886cd11f898eee [0,2,0,0,0,0|2,0,0]=4 580 B8R0.5 COCN(C)C[C@H](C)O d0cec2a0e9e49d3fd200a1f1b3460073 [0,2,0,0,0,0|2,0,0]=4 581 B8R0.5 CSCN(C)CC(C)C b4880058f7b62851863b99827752cd7e [0,2,0,0,0,0|2,0,0]=4 582 B8R0.5 CSCN(C)CC(C)O 19b09d20f60ba10a7233c42a0094d940 [0,2,0,0,0,0|2,0,0]=4 583 B8R0.5 CSCN(C)C[C@H](C)O a1cd0a54d282bd0dcdd24b2e9143dd2d [0,2,0,0,0,0|2,0,0]=4 584 B8R0.5 C[C@@H](O)CN(C)CCF 126ff326a556bc086395534b8f58a986 [0,2,0,0,0,0|2,0,0]=4 585 B8R0.5 C[C@@H](O)CN(C)CCO b2075f300e9096bf9f56060a06fe5fff [0,2,0,0,0,0|2,0,0]=4 586 B8R0.5 C[C@H](O)CN(C)CCF 0035923f0b284ef55440b2a2ec1d53f8 [0,2,0,0,0,0|2,0,0]=4 587 B8R0.5 C[C@H](O)CN(C)CCO 3ac89c90dc792061538bdb13c697b5b7 [0,2,0,0,0,0|2,0,0]=4 588 B8R0.5 C[C@H](O)CN(C)CCS 4eb7ed53de9d466688e0eafcb5798f80 [0,2,0,0,0,0|2,0,0]=4 589 B8R0.16 C=C(C)CN(C=O)CC 5c2806787b75a62cfaae63fad2e8f32f [0,2,0,0,0,0|1,0,1]=4 590 B8R0.16 CCC(C=O)OC(C)C 64971e54da0bc5dd8c61368ff4482427 [0,2,0,0,0,0|1,0,1]=4 591 B8R0.16 CCN(C=O)CC(C)C a0d4f7e2b09765b708dd4f00ebe2d340 [0,2,0,0,0,0|1,0,0]=3 592 B8R0.16 CCN(C=O)CC(C)O 2437be87a2e81f295f09928becec40c6 [0,2,0,0,0,0|1,0,0]=3 593 B8R0.16 CCN(C=O)CC(F)F fef5c33754c2da4e91f59c606aea6814 [0,2,0,0,0,0|2,0,0]=4 594 B8R0.16 CCN(C=O)C[C@H](C)O 1f7ddfd4388d4f78b5345d6a6e9121a1 [0,2,0,0,0,0|1,0,0]=3 595 B8R0.16 CCN(CC)CC(C)C 87a5706d2b796b063f175db9c5e79998 [0,2,0,0,0,0|2,0,0]=4 596 B8R0.16 CCN(CC)CC(C)O d8bc58b8f382f5371f0e94bb242901d6 [0,2,0,0,0,0|2,0,0]=4 597 B8R0.16 CCN(CC)C[C@H](C)O e8ae75fa00192b49e2affddcedaf538e [0,2,0,0,0,0|2,0,0]=4 598 B8R0.16 CCN(CF)CC(C)C 744b366c959b404d2df0a0600b06b37b [0,2,0,0,0,0|2,0,0]=4 599 B8R0.16 CCN(CF)CC(C)O b42e3cb8d43d72a360d85cc8de4205f1 [0,2,0,0,0,0|2,0,0]=4 600 B8R0.16 CCN(CF)C[C@H](C)O c4e347000f8a76e4029d2cbec68d72c2 [0,2,0,0,0,0|2,0,0]=4 601 B8R0.16 CCN(CO)CC(C)C f806f0f6352a8332de429236acf734d1 [0,2,0,0,0,0|1,0,1]=4 602 B8R0.16 CCN(CO)CC(C)O 0648cddbdd177d68fe137b4e015914f3 [0,2,0,0,0,0|1,0,1]=4 603 B8R0.16 CCN(CO)C[C@H](C)O e524c4415f69604a18e716f7cb9197fa [0,2,0,0,0,0|1,0,1]=4 604 B8R0.19 C#CC(=O)NC(C)CC 61d9b7eb83f4ff7eb7086f9d7e1ae285 [0,2,0,0,0,0|0,0,2]=4 605 B8R0.19 C#CC(=O)N[C@@H](C)CC e4430e1df3d27e1f60bfd6ac8cb2107b [0,2,0,0,0,0|0,0,2]=4 606 B8R0.19 C#CC(=O)N[C@H](C)CC 4b809239b5091186dfbcfe36ab818a64 [0,2,0,0,0,0|0,0,2]=4 607 B8R0.19 C#CC(C)NC(=O)CC b3d62cd02b21ed8b92bc6b4f40f79ec6 [0,2,0,0,0,0|1,0,0]=3 608 B8R0.19 C#CC(C)NC(=O)CF e8333ceaa22e2bfcb3cb2f6a7a9f649b [0,2,0,0,0,0|2,0,0]=4 609 B8R0.19 C#CC(C)NC(=O)CO 702ffb71c324a35e34d91444846fafe2 [0,2,0,0,0,0|2,0,0]=4 610 B8R0.19 C#CC(C)NC(=O)CS 5d136db82cbd1d3d5d2516021e5d1353 [0,2,0,0,0,0|2,0,0]=4 611 B8R0.19 C#C[C@@H](C)NC(=O)CC 4b8ef19bb31b8f4e485e026e78b7f5f3 [0,2,0,0,0,0|1,0,0]=3 612 B8R0.19 C#C[C@@H](C)NC(=O)CF dd6921011a643173cae3bc6615aaee23 [0,2,0,0,0,0|2,0,0]=4 613 B8R0.19 C#C[C@@H](C)NC(=O)CO 78f287368a403bf2071949db9cf15f95 [0,2,0,0,0,0|2,0,0]=4 614 B8R0.19 C#C[C@@H](C)NC(=O)CS 6d872300609bddebee6c89178f613762 [0,2,0,0,0,0|2,0,0]=4 615 B8R0.19 C#C[C@H](C)NC(=O)CC 82b030abf3ba07e5b870033df09c7669 [0,2,0,0,0,0|1,0,0]=3 616 B8R0.19 C#C[C@H](C)NC(=O)CF 6dfac9cc7db67ff9f3646003f00842b0 [0,2,0,0,0,0|2,0,0]=4 617 B8R0.19 C#C[C@H](C)NC(=O)CO 2415c234d694c139fd6864b147fc33dd [0,2,0,0,0,0|2,0,0]=4 618 B8R0.19 C#C[C@H](C)NC(=O)CS 7eb1372a3c6097baaeb3392705ab140a [0,2,0,0,0,0|2,0,0]=4 619 B8R0.19 C=C(CC)CN(C)CC a5edac56bd516c3e08abe80274b2ef4e [0,2,0,0,0,0|1,0,0]=3 620 B8R0.19 C=C(CN(C)CC)OC ae7aed41eaced6b8d6d4f4656a97dade [0,2,0,0,0,0|2,0,0]=4 621 B8R0.19 C=C(CO)CN(C)CC 9c16b8a0e80d8cd55610766797cfa55c [0,2,0,0,0,0|2,0,0]=4 622 B8R0.19 C=CC(=O)NC(C)CC 618b63daf38e12edf0af1cf418a0bd56 [0,2,0,0,0,0|0,0,2]=4 623 B8R0.19 C=CC(=O)N[C@@H](C)CC a3ffc6e9f98d3fec0068c30de1c1aa9d [0,2,0,0,0,0|0,0,2]=4 624 B8R0.19 C=CC(=O)N[C@H](C)CC 7381476a5c4cd38996f0fa157a298c50 [0,2,0,0,0,0|0,0,2]=4 625 B8R0.19 C=CC(C)NC(=O)CC 839432ec7d3f0e80c7881e3c8ea6f7fd [0,2,0,0,0,0|1,0,0]=3 626 B8R0.19 C=CC(C)NC(=O)CF c652d80a887d36f14a3d2448ef99a4a1 [0,2,0,0,0,0|2,0,0]=4 627 B8R0.19 C=CC(C)NC(=O)CO bfff0c86eaaef97d8840737c1dae3696 [0,2,0,0,0,0|2,0,0]=4 628 B8R0.19 C=CC(C)NC(=O)CS 228bfbee1410a32d12dd2f88d9077252 [0,2,0,0,0,0|2,0,0]=4 629 B8R0.19 CC(C#N)NC(=O)CF d445591d61b01258a3cb45a90999980a [0,2,0,0,0,0|2,0,0]=4 630 B8R0.19 CC(C#N)NC(=O)CO 1966565fed6c98aafc0894510067c50f [0,2,0,0,0,0|2,0,0]=4 631 B8R0.19 CC(C#N)NC(=O)CS 738a2f76770aff8cb902f1d745734577 [0,2,0,0,0,0|2,0,0]=4 632 B8R0.19 CC(CO)NC(=O)CF ef2266eb5061b2bffbd30285b120264a [0,2,0,0,0,0|2,0,0]=4 633 B8R0.19 CC(CO)NC(=O)CO 36e7f0a9d41f765505ec00dee787948b [0,2,0,0,0,0|2,0,0]=4 634 B8R0.19 CC(CO)NC(=O)CS 4ca68b24b40823bba6f492cc34b6d41b [0,2,0,0,0,0|2,0,0]=4 635 B8R0.19 CCC(=O)CN(C)CC 5ff470863ab78226aff558b26acaa6bb [0,2,0,0,0,0|0,0,0]=2 636 B8R0.19 CCC(=O)NC(C)C#N 12108e2444e1ebb9139d2cf557129000 [0,2,0,0,0,0|1,0,0]=3 637 B8R0.19 CCC(=O)NC(C)CC 276f63d9911911bef583b63399d6babf [0,2,0,0,0,0|0,0,0]=2 638 B8R0.19 CCC(=O)NC(C)CO 31f73ee0dabaaa5a17015c929f45f2fd [0,2,0,0,0,0|1,0,0]=3 639 B8R0.19 CCC(=O)N[C@@H](C)CC 5015556f6119dada9330f459ef8b4a95 [0,2,0,0,0,0|0,0,0]=2 640 B8R0.19 CCC(=O)N[C@@H](C)CO a3bcc6db0615cc40ae6703cd20d3dc45 [0,2,0,0,0,0|1,0,0]=3 641 B8R0.19 CCC(=O)N[C@H](C)CC 0aeecce7ca86d9a6cf7c4003d6b8deb5 [0,2,0,0,0,0|0,0,0]=2 642 B8R0.19 CCC(=O)N[C@H](C)CO 3449d5b097ace6785d86df28155e11e4 [0,2,0,0,0,0|1,0,0]=3 643 B8R0.19 CCC(C)CN(C)CC c97a2f07dd5fecc0e91af558e8842f65 [0,2,0,0,0,0|1,0,1]=4 644 B8R0.19 CCC(C)NC(=O)C=O d87e951102d767f8f5aa3b902ef92349 [0,2,0,0,0,0|1,0,1]=4 645 B8R0.19 CCC(C)NC(=O)CF be99e999222b335d1cb75f36b6d9cd45 [0,2,0,0,0,0|1,0,0]=3 646 B8R0.19 CCC(C)NC(=O)CO 33a44afa4449469b04b268f3719a3e59 [0,2,0,0,0,0|1,0,0]=3 647 B8R0.19 CCC(C)NC(=O)CS 2bbecd1472ce4a0c07af9c3693119c31 [0,2,0,0,0,0|1,0,0]=3 648 B8R0.19 CCC(C)NC(C)CC 876c9dcdc0f8168933f9842ebfb49dcc [0,2,0,0,0,0|1,0,1]=4 649 B8R0.19 CCC(C)N[C@@H](C)CC 07e48a2963d6dfeaa91702f20bef1cab [0,2,0,0,0,0|1,0,1]=4 650 B8R0.19 CCC(C)N[C@H](C)CC a2f8af3677e9bd218ed8125518b8e1d7 [0,2,0,0,0,0|1,0,1]=4 651 B8R0.19 CCC(C)OC(C)CC 3470543b91d3e4ca0bc1a393ace3b2b7 [0,2,0,0,0,0|1,0,1]=4 652 B8R0.19 CCC(C)O[C@@H](C)CC 5b5f6724583f0bba5fdaf3b11471f3c4 [0,2,0,0,0,0|1,0,1]=4 653 B8R0.19 CCC(C)O[C@H](C)CC 0baa98fec5db8845d4182fe89ad327a5 [0,2,0,0,0,0|1,0,1]=4 654 B8R0.19 CCC(O)CN(C)CC 05ba2ce1cbf52722b11091eb58aa8124 [0,2,0,0,0,0|0,0,2]=4 655 B8R0.19 CCN(C)CC(=O)CO cfedb43af4bce24aac2f06a8534d30e0 [0,2,0,0,0,0|1,0,0]=3 656 B8R0.19 CCN(C)CC(=O)NC 8baa1dde5886fc0147e3d3c2a9f34306 [0,2,0,0,0,0|1,0,0]=3 657 B8R0.19 CCN(C)CC(=O)OC dc6eaad4d2fa330c4e11c97ae3abe5a3 [0,2,0,0,0,0|1,0,0]=3 658 B8R0.19 CCN(C)CC(C)C#N ca62233b1666e43d3f05afa05fd153a2 [0,2,0,0,0,0|2,0,0]=4 659 B8R0.19 CCN(C)CC(C)CO 57aed0ddb41a49ac36f9f8539801655e [0,2,0,0,0,0|2,0,0]=4 660 B8R0.19 CCN(C)CC(C)OC 377b6e41a65d04757b988ceba2b54f82 [0,2,0,0,0,0|2,0,0]=4 661 B8R0.19 CCN(C)CC(O)CF 9b5f95856fc2428b6d2e975cfa34b30b [0,2,0,0,0,0|2,0,0]=4 662 B8R0.19 CCN(C)CC(O)CO 1d1312ada3c341da8de27cc3789abca2 [0,2,0,0,0,0|2,0,0]=4 663 B8R0.19 CCN(C)C[C@@H](C)CO ddade9d6e3ba337d6b393a00c773647d [0,2,0,0,0,0|2,0,0]=4 664 B8R0.19 CCN(C)C[C@@H](C)OC 423ec57342e946c8b4839b0ec5409baa [0,2,0,0,0,0|2,0,0]=4 665 B8R0.19 CCN(C)C[C@@H](O)CO e64e4131d671816539b2429b245cd316 [0,2,0,0,0,0|2,0,0]=4 666 B8R0.19 CCN(C)C[C@H](C)CO 0a9476f9cc602f73744eac4366c36b7c [0,2,0,0,0,0|2,0,0]=4 667 B8R0.19 CCN(C)C[C@H](C)OC fbb444e22eeeab9bc96df09d063788d3 [0,2,0,0,0,0|2,0,0]=4 668 B8R0.19 CCN(C)C[C@H](O)CO f45fa40fd7de9da18f9df806f59986f2 [0,2,0,0,0,0|2,0,0]=4 669 B8R0.19 CC[C@@H](C)CN(C)CC c7c9b5c0068d5d12f050f43bd2f96d97 [0,2,0,0,0,0|1,0,1]=4 670 B8R0.19 CC[C@@H](C)NC(=O)C=O 21ac8ac32e78a362dc133e8e3bbda567 [0,2,0,0,0,0|1,0,1]=4 671 B8R0.19 CC[C@@H](C)NC(=O)CF 972ccf96eab46daa18ae78e952074e33 [0,2,0,0,0,0|1,0,0]=3 672 B8R0.19 CC[C@@H](C)NC(=O)CO 102bc53795a33daa61b0e6c2cdbc40e6 [0,2,0,0,0,0|1,0,0]=3 673 B8R0.19 CC[C@@H](C)NC(=O)CS 6576ffdd87c3ad0b66c846698b8c9218 [0,2,0,0,0,0|1,0,0]=3 674 B8R0.19 CC[C@H](C)CN(C)CC a2f007d5d2fc9c89853c614ebf5a2522 [0,2,0,0,0,0|1,0,1]=4 675 B8R0.19 CC[C@H](C)NC(=O)C=O e638670223a406eb6167bccd4c1dfde1 [0,2,0,0,0,0|1,0,1]=4 676 B8R0.19 CC[C@H](C)NC(=O)CF 4effc7db6392db0aa027693c9704097d [0,2,0,0,0,0|1,0,0]=3 677 B8R0.19 CC[C@H](C)NC(=O)CO 7070ce3ef500a05442ee4538ea055e46 [0,2,0,0,0,0|1,0,0]=3 678 B8R0.19 CC[C@H](C)NC(=O)CS 035bd81fae7cc99474ceaac0a841b71d [0,2,0,0,0,0|1,0,0]=3 679 B8R0.19 CNC(=O)CN(C)C=O 182361f0200c9026118bb2e6708907e3 [0,2,0,0,0,0|2,0,0]=4 680 B8R0.19 CNC(=O)CN(C)CF c4335c7de1ec7a5bdf4619e54da80079 [0,2,0,0,0,0|2,0,0]=4 681 B8R0.19 CNC(=O)CN(C)CO 5e5aacc592b2dd5b7a781dd38b53445b [0,2,0,0,0,0|2,0,0]=4 682 B8R0.19 COC(=O)CN(C)C=O 943cc5729a7d321dfa7dcb2f4fa86c17 [0,2,0,0,0,0|2,0,0]=4 683 B8R0.19 COC(=O)CN(C)CF 315bad3552c61e9bc012d524d408a643 [0,2,0,0,0,0|2,0,0]=4 684 B8R0.19 COC(=O)CN(C)CO ead5047548ab9512878dca6e9fed3e38 [0,2,0,0,0,0|2,0,0]=4 685 B8R0.19 C[C@@H](CO)NC(=O)CF 2c1d0a1ab5fcd3bc348406e1eae8d857 [0,2,0,0,0,0|2,0,0]=4 686 B8R0.19 C[C@@H](CO)NC(=O)CO 4ef5922646eca2409cc0528bbe495536 [0,2,0,0,0,0|2,0,0]=4 687 B8R0.19 C[C@@H](CO)NC(=O)CS ecb25931c5ecf30a1072b0ef0c850951 [0,2,0,0,0,0|2,0,0]=4 688 B8R0.19 C[C@H](CO)NC(=O)CF 47adba76c977441bf582f65bebd39947 [0,2,0,0,0,0|2,0,0]=4 689 B8R0.19 C[C@H](CO)NC(=O)CO 02a86c975d92184b3a8afd5bdd788d80 [0,2,0,0,0,0|2,0,0]=4 690 B8R0.19 C[C@H](CO)NC(=O)CS ecf3d50d57e6bb41773d96b1c96ed61c [0,2,0,0,0,0|2,0,0]=4 691 B8R0.23 CC(C)CN(C)C(C)C b51beb028657f748b3783403daf9db19 [0,2,0,0,0,0|2,0,0]=4 692 B8R0.23 CC(C)N(C)C[C@@H](C)O edda2e38f0c2b068751a472716b6316d [0,2,0,0,0,0|2,0,0]=4 693 B8R0.23 CC(C)N(C)C[C@H](C)O 6c78ca3105da9d74005d52bf31383b62 [0,2,0,0,0,0|2,0,0]=4 694 B8R0.23 CC(O)CN(C)C(C)C 95a92a6cab6529312851036d37141b0c [0,2,0,0,0,0|2,0,0]=4 695 B8R0.24 CC(C)(C)NC(=O)CF eaf2c955300b2105c1bb32d1cd07b20a [0,2,0,0,0,0|2,0,0]=4 696 B8R0.24 CC(C)(C)NC(=O)CO 036f0d5d96292df8d1908352e5576a0c [0,2,0,0,0,0|2,0,0]=4 697 B8R0.24 CCC(=O)NC(C)(C)C 26a2f5ebe28b3d4c326c1e70f6823a38 [0,2,0,0,0,0|1,0,0]=3 698 B8R0.24 CCN(C)CC(C)(C)C ad9a32359488b3a57efd7a0f91b8539b [0,2,0,0,0,0|2,0,0]=4 699 B8R0.24 CCN(C)CC(C)(C)F 7a7eae4f3fa39ffa021a7e60015b3c3a [0,2,0,0,0,0|2,0,0]=4 700 B8R0.24 CCN(C)CC(C)(C)O 3a82767057043d9df3fecda73f227fdf [0,2,0,0,0,0|2,0,0]=4 701 B8R0.24 CCN(C)CC(C)(F)F 8c75a093db85e3306d9782ac68ca89af [0,2,0,0,0,0|2,0,0]=4 702 B8R0.1 C#CCC(=O)NCCBr 4f440cf4aa09e3206cdd4605bcf9c58a [0,2,0,0,0,0|0,0,2]=4 703 B8R0.1 C#CCC(=O)NCCC 02e18d00f6cac127c3ba925ff7cc6fd1 [0,2,0,0,0,0|0,0,1]=3 704 B8R0.1 C#CCC(=O)NCCF 3341dd3a6feefef883ce57321d1fc3ac [0,2,0,0,0,0|0,0,2]=4 705 B8R0.1 C#CCC(=O)NCCI f8d66d321b4bbc9c77f62120eae5ed27 [0,2,0,0,0,0|0,0,2]=4 706 B8R0.1 C#CCC(=O)NCCO 2552cbe45ed2acb76bf35f0ed2d399d1 [0,2,0,0,0,0|0,0,2]=4 707 B8R0.1 C#CCC(=O)NCCS 476873863e83bab04e03ba1c343d1800 [0,2,0,0,0,0|0,0,2]=4 708 B8R0.1 C#CCCN(C)CCC cdc20a350213388c78fedf3324acbb02 [0,2,0,0,0,0|2,0,0]=4 709 B8R0.1 C#CCNC(=O)CCC 988fe137497a657fd02a96648cfc31de [0,2,0,0,0,0|0,0,1]=3 710 B8R0.1 C#CCNC(=O)CCF e0694077da982de0e89a1640dd836e88 [0,2,0,0,0,0|0,0,2]=4 711 B8R0.1 C#CCNC(=O)CCO 96fe99b94bbe3f359921b98b2650505f [0,2,0,0,0,0|0,0,2]=4 712 B8R0.1 C#CCNC(=O)CCS 2ccb181d20fbfebe9499fb936abe7e8c [0,2,0,0,0,0|0,0,2]=4 713 B8R0.1 C#CCNC(=O)COC 0339c52ff36ce70a96ce9a88fff2f8c4 [0,2,0,0,0,0|0,0,2]=4 714 B8R0.1 C#CCNC(=O)CSC 87e0bffb35588c26836ab5c0ad0adb52 [0,2,0,0,0,0|0,0,2]=4 715 B8R0.1 C#CCOC(=S)CCC 666ad0aff10dc8dec2740f151b5514b6 [0,2,0,0,0,0|0,1,1]=4 716 B8R0.1 C/C=C/C(=O)NCCBr 1a948754dff20d168e9361d04d66258d [0,2,0,0,0,0|0,0,2]=4 717 B8R0.1 C/C=C/C(=O)NCCC 3112d70c0159afb044aaeb01584dde68 [0,2,0,0,0,0|0,0,1]=3 718 B8R0.1 C/C=C/C(=O)NCCF f849769f8bdb582b93b497aea7baa092 [0,2,0,0,0,0|0,0,2]=4 719 B8R0.1 C/C=C/C(=O)NCCI 52e8106e222480d032713c2c859846aa [0,2,0,0,0,0|0,0,2]=4 720 B8R0.1 C/C=C/C(=O)NCCO a9d7e927df580e87cdbec0136302f443 [0,2,0,0,0,0|0,0,2]=4 721 B8R0.1 C/C=C/C(=O)NCCS 5eb021a8ec06b5b9d6208abe4a08327e [0,2,0,0,0,0|0,0,2]=4 722 B8R0.1 C/C=C/CN(C)CCC 68fa4beb90f4e459d9bc957a029629eb [0,2,0,0,0,0|2,0,0]=4 723 B8R0.1 C/C=C\CN(C)CCC d8f36325b90dad42a1f23b0fb5c73ea6 [0,2,0,0,0,0|2,0,0]=4 724 B8R0.1 C=CCC(=O)NCCBr 88693f23f16092ca5dd266571e10a0e0 [0,2,0,0,0,0|0,0,2]=4 725 B8R0.1 C=CCC(=O)NCCC 0464f3619ee0131de1206f24520111fa [0,2,0,0,0,0|0,0,1]=3 726 B8R0.1 C=CCC(=O)NCCF b423ce63ff163e8a3f1e834dcf6b878a [0,2,0,0,0,0|0,0,2]=4 727 B8R0.1 C=CCC(=O)NCCI 3e84a2a94db213ccfed4bfa0a31b248c [0,2,0,0,0,0|0,0,2]=4 728 B8R0.1 C=CCC(=O)NCCO 463fba4a469c234daf13b2d2f72392b1 [0,2,0,0,0,0|0,0,2]=4 729 B8R0.1 C=CCC(=O)NCCS 6f95ca251253e31286d39bbf0aa786fe [0,2,0,0,0,0|0,0,2]=4 730 B8R0.1 C=CCCN(C)CCC dab57175e9273de33949da20b7fb71b3 [0,2,0,0,0,0|2,0,0]=4 731 B8R0.1 C=CCOC(=S)CCC 0e2b2dcb05bb2d160479b58f052e05d1 [0,2,0,0,0,0|0,1,1]=4 732 B8R0.1 CC#CC(=O)NCCBr 88fb977d43b76e3334f184344ba493ef [0,2,0,0,0,0|0,0,2]=4 733 B8R0.1 CC#CC(=O)NCCC f3929637650271102a5b6c505641e7e8 [0,2,0,0,0,0|0,0,1]=3 734 B8R0.1 CC#CC(=O)NCCF 1227adeb43ec7455199bd22620e5253c [0,2,0,0,0,0|0,0,2]=4 735 B8R0.1 CC#CC(=O)NCCI dbbc6bd9b3b670571c9a53642d339035 [0,2,0,0,0,0|0,0,2]=4 736 B8R0.1 CC#CC(=O)NCCO f885362aa6b004ac92e1add94f791e9e [0,2,0,0,0,0|0,0,2]=4 737 B8R0.1 CC#CC(=O)NCCS 40eb9ceaf9e9d627793690711560ba71 [0,2,0,0,0,0|0,0,2]=4 738 B8R0.1 CCCC(=O)CNC#N e78fa428bf173d6f49d20b0b4ac2f117 [0,2,0,0,0,0|0,0,1]=3 739 B8R0.1 CCCC(=O)NCC#N 97e0c91f0cf4974f9847be1f27d8b9ac [0,2,0,0,0,0|0,0,1]=3 740 B8R0.1 CCCC(=O)NCCBr e3424ddfe0e4582b4445faadedeca9f3 [0,2,0,0,0,0|0,0,0]=2 741 B8R0.1 CCCC(=O)NCCF abd86ad1a4854f306fa4ec91802cd24f [0,2,0,0,0,0|0,0,0]=2 742 B8R0.1 CCCC(=O)NCCI effb943f4ec1dba1ee2232662d0cb367 [0,2,0,0,0,0|0,0,0]=2 743 B8R0.1 CCCC(=O)NCCO d2bc78e5bd2f73aa8619f010857f1926 [0,2,0,0,0,0|0,0,0]=2 744 B8R0.1 CCCC(=O)NCCS c2ef67720d0b2ef54134f82538ee13fd [0,2,0,0,0,0|0,0,0]=2 745 B8R0.1 CCCC(=S)OCC#N ff06a334ddac1bbecb7d6c22783d4308 [0,2,0,0,0,0|0,1,1]=4 746 B8R0.1 CCCC(=S)OCC=O ee4851bc3a15d19c33e510859df38ec8 [0,2,0,0,0,0|0,1,1]=4 747 B8R0.1 CCCC(=S)OCCF 4a3f66968fafe65a13eab591dccc8c9f [0,2,0,0,0,0|0,1,0]=3 748 B8R0.1 CCCC(=S)OCCS 7161c28940ff0dc6e0b2d32d8bc2d5dc [0,2,0,0,0,0|0,1,0]=3 749 B8R0.1 CCCC(=S)OCOC d7c66aa0be93e71a0e10702c93e66ce1 [0,2,0,0,0,0|0,1,0]=3 750 B8R0.1 CCCC(=S)OCSC aaf32ff7376d2185d5b81bb017266ecd [0,2,0,0,0,0|0,1,0]=3 751 B8R0.1 CCCC(C)COCC 93903632c96b35063d92ad4a88f1870f [0,2,0,0,0,0|1,0,1]=4 752 B8R0.1 CCCC(C)COCF 93c3ddfe52dd775edf5ae50e46d5413c [0,2,0,0,0,0|1,0,1]=4 753 B8R0.1 CCCC(C)NCCBr 753adf372612d932eb167d3c6c6a7373 [0,2,0,0,0,0|1,0,1]=4 754 B8R0.1 CCCC(C)NCCF 561290ca4cbab4d4179520d904990ead [0,2,0,0,0,0|1,0,1]=4 755 B8R0.1 CCCC(C)NCCI 853631fdd24c7675889f7c8342411ed2 [0,2,0,0,0,0|1,0,1]=4 756 B8R0.1 CCCC(C)NCCO d387394dd5b59962f0214322519a89cd [0,2,0,0,0,0|1,0,1]=4 757 B8R0.1 CCCC(C)NCCS ae0edf47df652752132304246cff565d [0,2,0,0,0,0|1,0,1]=4 758 B8R0.1 CCCC(C)NCOC 7593556ba3b3358786240e76b9dc1cde [0,2,0,0,0,0|1,0,1]=4 759 B8R0.1 CCCC(C)NCSC 3493d269ab799371709caa3d578d33ab [0,2,0,0,0,0|1,0,1]=4 760 B8R0.1 CCCC(C)OCCF 51dd4182d40ab8df7fc597096aea8427 [0,2,0,0,0,0|1,0,1]=4 761 B8R0.1 CCCC(C)OCCS 69475e4324fe3c939d55cdf50e8476b5 [0,2,0,0,0,0|1,0,1]=4 762 B8R0.1 CCCC(C)OCOC 7c2918bfa8ffaddb181d24a90d0ac5c3 [0,2,0,0,0,0|1,0,1]=4 763 B8R0.1 CCCC(C)OCSC 75e51c2393446b0133ca8c8523cf3bf1 [0,2,0,0,0,0|1,0,1]=4 764 B8R0.1 CCCC(O)CNCC 832780b22c4621b899b7afcc4f4f0de1 [0,2,0,0,0,0|0,0,2]=4 765 B8R0.1 CCCC(O)CNCF 9e922850e385a2cbcd148cdd0ed96f6f [0,2,0,0,0,0|0,0,2]=4 766 B8R0.1 CCCC(O)CNCO 64eda460853947fa76aaab0ea9fa11c8 [0,2,0,0,0,0|0,0,2]=4 767 B8R0.1 CCCCC(=O)NC#N 2fe7c425eb1622681eebf36d3ea640ff [0,2,0,0,0,0|1,0,1]=4 768 B8R0.1 CCCCC(C)NCC 4583005e506d2176e59cdaa84e6525c6 [0,2,0,0,0,0|1,0,1]=4 769 B8R0.1 CCCCC(C)OCC e43df0ae121ab44cb6194c6546aa1e41 [0,2,0,0,0,0|1,0,1]=4 770 B8R0.1 CCCCN(C)CCC 598958f1bf27154d8760346aca3fc1c7 [0,2,0,0,0,0|2,0,0]=4 771 B8R0.1 CCCCN(C)CCF dea221ed9395f7cb1e71d7be0afd021b [0,2,0,0,0,0|2,0,0]=4 772 B8R0.1 CCCCN(C)CCO d3a1d2ca604b1d792baba16d692e347d [0,2,0,0,0,0|2,0,0]=4 773 B8R0.1 CCCCN(C)CCS 3e265071a664b45e2ee59abc544de5e5 [0,2,0,0,0,0|2,0,0]=4 774 B8R0.1 CCCCN(C)COC 82c59ffeb372941e62ade16842f09aa1 [0,2,0,0,0,0|2,0,0]=4 775 B8R0.1 CCCCN(C)CSC 5fbed4fdfac4006dd6d43bf0d13197ea [0,2,0,0,0,0|2,0,0]=4 776 B8R0.1 CCCC[C@@H](C)NCC c18bfbe49afa779f9ec8f1e0c1e03df7 [0,2,0,0,0,0|1,0,1]=4 777 B8R0.1 CCCC[C@@H](C)OCC d38acbfc54d47c4bbd565f1b434e5e73 [0,2,0,0,0,0|1,0,1]=4 778 B8R0.1 CCCC[C@H](C)OCC f8165a8926a10ebcbdb8675cf31f0cb1 [0,2,0,0,0,0|1,0,1]=4 779 B8R0.1 CCCN(C)CCC#N e21f2e5795e35a80e55b6ba896f984f5 [0,2,0,0,0,0|2,0,0]=4 780 B8R0.1 CCCN(C)CCC=O cd4badc64192ce4c537889fd9678d594 [0,2,0,0,0,0|2,0,0]=4 781 B8R0.1 CCCN(C)CCCF 59925d2d70ed2cd32e04f065de645944 [0,2,0,0,0,0|2,0,0]=4 782 B8R0.1 CCCN(C)CCCO bcaba704baeaba819c24be99d4c792f1 [0,2,0,0,0,0|2,0,0]=4 783 B8R0.1 CCCN(C)CCCS 13f800e972129b543eca8df52c669ca8 [0,2,0,0,0,0|2,0,0]=4 784 B8R0.1 CCCN(C)CCOC 3001c1572568a855669d478bf72bb14a [0,2,0,0,0,0|2,0,0]=4 785 B8R0.1 CCCN(C)CCON ddea99dfcac5cbaa7bc869b004f79f3a [0,2,0,0,0,0|2,0,0]=4 786 B8R0.1 CCCN(C)CCSC 124c992bab27aab465124a43552a6d9d [0,2,0,0,0,0|2,0,0]=4 787 B8R0.1 CCCN(C)COCC cf6f2674ada2fc38b6be0d5d76fba32b [0,2,0,0,0,0|2,0,0]=4 788 B8R0.1 CCCNC(=O)/C=C/Br b1926545c958d5233a97eecf45ef793e [0,2,0,0,0,0|0,0,2]=4 789 B8R0.1 CCCNC(=O)/C=C/Cl 5d162a53ee9ec44c434e097fbf07a78f [0,2,0,0,0,0|0,0,2]=4 790 B8R0.1 CCCNC(=O)/C=C/I 3483980bedd76cbe76739ba0675640bc [0,2,0,0,0,0|0,0,2]=4 791 B8R0.1 CCCNC(=O)/C=C\Br 587063f23ad9d4c3a5d091f654b1750d [0,2,0,0,0,0|0,0,2]=4 792 B8R0.1 CCCNC(=O)/C=C\Cl 80de1f593bb86fc7c7361689ff20ca17 [0,2,0,0,0,0|0,0,2]=4 793 B8R0.1 CCCNC(=O)/C=C\I 30402a319b6c1a883b3206c216549b42 [0,2,0,0,0,0|0,0,2]=4 794 B8R0.1 CCCNC(=O)C#CBr c870aa8bcaa9c74afac7e765262d412d [0,2,0,0,0,0|0,0,2]=4 795 B8R0.1 CCCNC(=O)C=CBr 9a0fc142e13566664539b9eb458de53b [0,2,0,0,0,0|0,0,2]=4 796 B8R0.1 CCCNC(=O)C=CI 68a3e0e9c9707da402b670771198154c [0,2,0,0,0,0|0,0,2]=4 797 B8R0.1 CCCNC(=O)CC#N a35df4e334c2327f92e0bafe31098739 [0,2,0,0,0,0|0,0,1]=3 798 B8R0.1 CCCNC(=O)CC=O c387c4bc3ea86b21200effc59fe151db [0,2,0,0,0,0|0,0,1]=3 799 B8R0.1 CCCNC(=O)CCC 3a4ef615081398a2acfdf5d3349655c4 [0,2,0,0,0,0|0,0,0]=2 800 B8R0.1 CCCNC(=O)CCF 80cac466548133e31f593852e3638107 [0,2,0,0,0,0|0,0,0]=2 801 B8R0.1 CCCNC(=O)CCO 1e17d6cf040450a0042d7883a84b4d20 [0,2,0,0,0,0|0,0,0]=2 802 B8R0.1 CCCNC(=O)CCS 5ca47d6ccf33cee73df146cfd5794783 [0,2,0,0,0,0|0,0,0]=2 803 B8R0.1 CCCNC(=O)COC d992f0c3466a56e61d0974e6b6e8669f [0,2,0,0,0,0|0,0,0]=2 804 B8R0.1 CCCNC(=O)CON 9840c2139f1e78498e25b8fce4d164d2 [0,2,0,0,0,0|1,0,0]=3 805 B8R0.1 CCCNC(=O)CSC 6ae58cb75ea789964eebc3d4df556317 [0,2,0,0,0,0|0,0,0]=2 806 B8R0.1 CCCNC(=O)NC#N 27ed8603a99c17a3d820a7b56b6ed318 [0,2,0,0,0,0|1,0,1]=4 807 B8R0.1 CCCNC(C)CCC d58b8fb4472d4722966db633dc2848a1 [0,2,0,0,0,0|1,0,1]=4 808 B8R0.1 CCCNC(C)CCO 2e0066dec5bfac2fe8aee5a15fdb0084 [0,2,0,0,0,0|1,0,1]=4 809 B8R0.1 CCCNC(C)COC 4346ed93e9ed26ed30cbd2c33a1a3971 [0,2,0,0,0,0|1,0,1]=4 810 B8R0.1 CCCN[C@@H](C)CCC 559d6e0322e30323f5594c28d9f6d2f9 [0,2,0,0,0,0|1,0,1]=4 811 B8R0.1 CCCN[C@@H](C)CCO d83bfeeda889a8c7feae809ec08f9d71 [0,2,0,0,0,0|1,0,1]=4 812 B8R0.1 CCCN[C@@H](C)COC c1bfae4cdff368ae020ea427a86f20a2 [0,2,0,0,0,0|1,0,1]=4 813 B8R0.1 CCCN[C@H](C)CCO 868b607afbbd0b779ae880e9de3082ae [0,2,0,0,0,0|1,0,1]=4 814 B8R0.1 CCCN[C@H](C)COC db62694081776beb55a87c04a01b7e4c [0,2,0,0,0,0|1,0,1]=4 815 B8R0.1 CCCOC(=S)CCC 553859e26557f67ca84075cb05814f3e [0,2,0,0,0,0|0,1,0]=3 816 B8R0.1 CCCOC(C)CCC 5072af5c5b154601df0153ecc4f9a62c [0,2,0,0,0,0|1,0,1]=4 817 B8R0.1 CCCOC(C)COC 7da8295e4d831ee4f9d2cde28bad1a12 [0,2,0,0,0,0|1,0,1]=4 818 B8R0.1 CCCOC(C)CSC 9f9571e90cf786089b434f3ce024d599 [0,2,0,0,0,0|1,0,1]=4 819 B8R0.1 CCCO[C@@H](C)CCC 3768650ef68ec2d5f66e51478eb2c0cf [0,2,0,0,0,0|1,0,1]=4 820 B8R0.1 CCCO[C@@H](C)COC 626e622663639373f117286290b64b6d [0,2,0,0,0,0|1,0,1]=4 821 B8R0.1 CCCO[C@H](C)CCC d9937f3512bcf6b6a2b04993e218c5dc [0,2,0,0,0,0|1,0,1]=4 822 B8R0.1 CCCO[C@H](C)COC 97f2c6bbb0fdd054219bab069984cf44 [0,2,0,0,0,0|1,0,1]=4 823 B8R0.1 CCC[C@@H](C)OCCF 551477ebd941c69308556a318357406d [0,2,0,0,0,0|1,0,1]=4 824 B8R0.1 CCC[C@@H](C)OCCS 32dc180121f7e6b2463f9b82f724d60f [0,2,0,0,0,0|1,0,1]=4 825 B8R0.1 CCC[C@@H](C)OCOC 424856e8f73d9733e5e6cd61105c8f9c [0,2,0,0,0,0|1,0,1]=4 826 B8R0.1 CCC[C@@H](C)OCSC c99c99286eba63cefa83ea33456022c2 [0,2,0,0,0,0|1,0,1]=4 827 B8R0.1 CCC[C@H](C)NCCF ad34b2e1bc15d73c299f2f9233e9fc6d [0,2,0,0,0,0|1,0,1]=4 828 B8R0.1 CCC[C@H](C)NCCO a9ccf92f27c638a9d01093b14de8d08e [0,2,0,0,0,0|1,0,1]=4 829 B8R0.1 CCC[C@H](C)NCCS 4b977739e63bd4bdba50b1434c29865f [0,2,0,0,0,0|1,0,1]=4 830 B8R0.1 CCC[C@H](C)NCOC e6035597a8eb8fe082f6fe480c7fc30b [0,2,0,0,0,0|1,0,1]=4 831 B8R0.1 CCC[C@H](C)NCSC 104ebf702d7962ee0497ce7761710d65 [0,2,0,0,0,0|1,0,1]=4 832 B8R0.1 CCC[C@H](C)OCCF e12d025f332e1847a0a0c8377933b294 [0,2,0,0,0,0|1,0,1]=4 833 B8R0.1 CCC[C@H](C)OCCS 9c981c47f7c3ead27a21a510681a21c3 [0,2,0,0,0,0|1,0,1]=4 834 B8R0.1 CCC[C@H](C)OCOC f3c5c84cdb332795f207cd42cee3605b [0,2,0,0,0,0|1,0,1]=4 835 B8R0.1 CCC[C@H](C)OCSC 32a5d497847cfe259fd9a3968696750a [0,2,0,0,0,0|1,0,1]=4 836 B8R0.1 CCNC(=O)CNC#N 28aad3bf6750798c50b9e71af37b9d22 [0,2,0,0,0,0|1,0,1]=4 837 B8R0.1 CCNC(=O)CNC=O d640e3fac3bdd04f4eea38aa909b37a0 [0,2,0,0,0,0|1,0,1]=4 838 B8R0.1 CCNC(=O)CNCF 00b80b6827b81d8895e54234ac75d43c [0,2,0,0,0,0|1,0,0]=3 839 B8R0.1 CCNC(=O)CNCO ce3cba50f7ed87e7409428e42c23fd71 [0,2,0,0,0,0|1,0,0]=3 840 B8R0.1 CCNC(=O)COCC c84e7c49da6c2baea65be933f5b80bea [0,2,0,0,0,0|0,0,0]=2 841 B8R0.1 CCNC(=O)COCF 07accf9dfadaaccc536f5c34a66ac1b1 [0,2,0,0,0,0|1,0,0]=3 842 B8R0.1 CCNC(C)CCCO 4cb159cc51e237a2b68098cab9f966c9 [0,2,0,0,0,0|1,0,1]=4 843 B8R0.1 CCNCC(=O)NCC 85e3c6c463358c2ceb6c3f3c07ea189c [0,2,0,0,0,0|0,0,0]=2 844 B8R0.1 CCNCC(=O)OCC 13e479e123264c7bc2cd9986b04b4c24 [0,2,0,0,0,0|0,0,0]=2 845 B8R0.1 CCNCC(C)CCO ce19fc97a41079125b3a501e5658b50e [0,2,0,0,0,0|1,0,1]=4 846 B8R0.1 CCNCC(C)OCC eada9db090733897974960683afe5496 [0,2,0,0,0,0|1,0,1]=4 847 B8R0.1 CCNCC(O)COC f6b0536e22df73e563264ad1928c3a48 [0,2,0,0,0,0|0,0,2]=4 848 B8R0.1 CCNC[C@H](O)COC 5c0728270cf850017ded59cb547c9167 [0,2,0,0,0,0|0,0,2]=4 849 B8R0.1 CCN[C@H](C)CCCO b5ffb788d1af92f75fbf496c96240314 [0,2,0,0,0,0|1,0,1]=4 850 B8R0.1 CCOC(=O)CNC#N 5d84038a545807021d0d5d796040f780 [0,2,0,0,0,0|1,0,1]=4 851 B8R0.1 CCOC(=O)CNC=O 9f57910f0884d9a30d5951af969e11f6 [0,2,0,0,0,0|1,0,1]=4 852 B8R0.1 CCOC(=O)CNCF 7d02e761e530b1a2e8b4937d75024162 [0,2,0,0,0,0|1,0,0]=3 853 B8R0.1 CCOC(=O)CNCO be258da79336855a99e7f18427102b1b [0,2,0,0,0,0|1,0,0]=3 854 B8R0.1 CCOC(=O)COCF e0f65d48f1d596b5b0dcd0c878bc5d05 [0,2,0,0,0,0|1,0,0]=3 855 B8R0.1 CCOC(C)CCOC 196511f67d8eda011d6f33c8b16809a7 [0,2,0,0,0,0|1,0,1]=4 856 B8R0.1 CCOC(C)CCSC 324d3536b5929c293af9b175b80533e8 [0,2,0,0,0,0|1,0,1]=4 857 B8R0.1 CCOCC(=O)NC#N b14d7678dab8d31dfd317a29925c01b8 [0,2,0,0,0,0|1,0,1]=4 858 B8R0.1 CCOCC(=O)OCC a71429e2784f27b770f80be9d4ceb826 [0,2,0,0,0,0|0,0,0]=2 859 B8R0.1 CCOCC(C)OCC 20a9fb9f86ef4d51ef11c7f7a467151a [0,2,0,0,0,0|1,0,1]=4 860 B8R0.1 CCOCN(C)CCF 15f09a6694334e8fa617a47fe167018e [0,2,0,0,0,0|2,0,0]=4 861 B8R0.1 CCOCN(C)CCO d229648483b22399699fd2ff299b7b3c [0,2,0,0,0,0|2,0,0]=4 862 B8R0.1 CCSCC(=O)NC#N 0f21ec1e57519d161a741bee2fc49ed9 [0,2,0,0,0,0|1,0,1]=4 863 B8R0.1 CN(CCF)CCCF d6f4e5eae95ae04853089c876cfe8376 [0,2,0,0,0,0|2,0,0]=4 864 B8R0.1 CN(CCF)CCCO 405cb1812406dc732acbd5ca2bf8d85c [0,2,0,0,0,0|2,0,0]=4 865 B8R0.1 CN(CCF)CCCS 1ee1f733e33e2caa9e2de614f767ac2c [0,2,0,0,0,0|2,0,0]=4 866 B8R0.1 CN(CCO)CCCF 65d67af691e399f2e636a5d6ace9b963 [0,2,0,0,0,0|2,0,0]=4 867 B8R0.1 CN(CCO)CCCO 36d713c03dc08766341246f14e07bda2 [0,2,0,0,0,0|2,0,0]=4 868 B8R0.1 CN(CCO)CCCS cd935c5917603f4566a0a99c54ed3ddc [0,2,0,0,0,0|2,0,0]=4 869 B8R0.1 CN(CCS)CCCO 128d6d2fd1d0f5cb95de704956d68fe8 [0,2,0,0,0,0|2,0,0]=4 870 B8R0.1 COCC(=O)CNC#N 3b88c69df65aae2aef2104252f95eee8 [0,2,0,0,0,0|1,0,1]=4 871 B8R0.1 COCC(=O)NCC#N b9b1e25677cd4c9f33e77a62bc136b71 [0,2,0,0,0,0|1,0,1]=4 872 B8R0.1 COCC(=O)NCCBr e1d7efa2beb897f6fe8c723e5fef1d8c [0,2,0,0,0,0|1,0,0]=3 873 B8R0.1 COCC(=O)NCCF 5b27f9df05a07da8459d8e50096ac5ef [0,2,0,0,0,0|1,0,0]=3 874 B8R0.1 COCC(=O)NCCI 555339bd86b0ca69dc4cdec31caa1894 [0,2,0,0,0,0|1,0,0]=3 875 B8R0.1 COCC(=O)NCCO 5ced7d6cbd9eed1c30b901e6485d694c [0,2,0,0,0,0|1,0,0]=3 876 B8R0.1 COCC(=O)NCCS 730709bdb2536a5f7519c33efb71b705 [0,2,0,0,0,0|1,0,0]=3 877 B8R0.1 COCCC(=O)NC#N 0164696a986e1f0378c0b9e07c237c02 [0,2,0,0,0,0|1,0,1]=4 878 B8R0.1 COCCN(C)CCF 134bac4413d89851de3a0eb8339bb0d3 [0,2,0,0,0,0|2,0,0]=4 879 B8R0.1 COCCN(C)CCO 26130ceb4ad7565e446b20c581648752 [0,2,0,0,0,0|2,0,0]=4 880 B8R0.1 COCCN(C)CCS 83f03283cbacd33730b90834828ac225 [0,2,0,0,0,0|2,0,0]=4 881 B8R0.1 COCCN(C)COC 988caaf7b0acbc240227baa170a3504a [0,2,0,0,0,0|2,0,0]=4 882 B8R0.1 COCCN(C)CSC 5f13e0ff3c679461b2b1a419feb6e996 [0,2,0,0,0,0|2,0,0]=4 883 B8R0.1 COCN(C)CCCO 56bf23a0f821c588da38c52571d1a699 [0,2,0,0,0,0|2,0,0]=4 884 B8R0.1 COCN(C)CCSC 602ce5b7bc7a225ea70b75ddd3304e98 [0,2,0,0,0,0|2,0,0]=4 885 B8R0.1 CSCC(=O)NCC#N d732fb262e515ed32de5452f97ee12d8 [0,2,0,0,0,0|1,0,1]=4 886 B8R0.1 CSCC(=O)NCCBr 98705a0f39eb077061bcbd29b0672e6a [0,2,0,0,0,0|1,0,0]=3 887 B8R0.1 CSCC(=O)NCCF dfda28d66fa36cfb5ce50a1350224197 [0,2,0,0,0,0|1,0,0]=3 888 B8R0.1 CSCC(=O)NCCI 7bfc8d164efaef654c34edd5d1d07835 [0,2,0,0,0,0|1,0,0]=3 889 B8R0.1 CSCC(=O)NCCO 8fe8e72aaf0bb9f5644b18e3c790996d [0,2,0,0,0,0|1,0,0]=3 890 B8R0.1 CSCC(=O)NCCS 0c7243c53eb1aa5322c2775032ee2b33 [0,2,0,0,0,0|1,0,0]=3 891 B8R0.1 CSCCC(=O)NC#N aef0d4e74706fd59073e203e77c34320 [0,2,0,0,0,0|1,0,1]=4 892 B8R0.1 CSCCN(C)CCF 009b8e27e8e790d3ca2e81faf9ac0f0f [0,2,0,0,0,0|2,0,0]=4 893 B8R0.1 CSCCN(C)CCO 85eeedbf06a800beafc41e04d578329f [0,2,0,0,0,0|2,0,0]=4 894 B8R0.1 CSCCN(C)CCS 81ba41fb7d6f3f42166f9514690c9e2c [0,2,0,0,0,0|2,0,0]=4 895 B8R0.1 CSCCN(C)CSC 2fe8ec926878f90934ccdb2b3a5d1e07 [0,2,0,0,0,0|2,0,0]=4 896 B8R0.1 CSCN(C)CCCO 040c6dbe636b5c0fe8d86499104f8427 [0,2,0,0,0,0|2,0,0]=4 897 B8R0.1 N#CCC(=O)NCCBr ad62f176467caad7b89cb9f715b01ba4 [0,2,0,0,0,0|1,0,1]=4 898 B8R0.1 N#CCC(=O)NCCF d2c6af9dd4cb0f6e3a3d2d5222fcc74a [0,2,0,0,0,0|1,0,1]=4 899 B8R0.1 N#CCC(=O)NCCI 52006da7cf9f86f57bb751ce4f17b4c1 [0,2,0,0,0,0|1,0,1]=4 900 B8R0.1 N#CCC(=O)NCCO ebc737fc9565f0412dd7bc9620fd665d [0,2,0,0,0,0|1,0,1]=4 901 B8R0.1 N#CCC(=O)NCCS 9a38bc12ba4791c01f29716cb2165a91 [0,2,0,0,0,0|1,0,1]=4 902 B8R0.1 N#CCNC(=O)CCF df94db636624542224dff79afd456c89 [0,2,0,0,0,0|1,0,1]=4 903 B8R0.1 N#CCNC(=O)CCO 4cb7ec4d29a04c5392c09b8643634927 [0,2,0,0,0,0|1,0,1]=4 904 B8R0.1 N#CCNC(=O)CCS 65ac0fd9c89bd91cbedcee8c7da4e74a [0,2,0,0,0,0|1,0,1]=4 905 B8R0.1 N#CNC(=O)CCCF 62bfd5667a86cf008f3e5a7a3dced5f3 [0,2,0,0,0,0|1,0,1]=4 906 B8R0.1 N#CNC(=O)CCCS 97d957bc025416f4428f830074eec472 [0,2,0,0,0,0|1,0,1]=4 907 B8R0.1 NOCC(=O)NCCBr c0babb816ff6ad071d50637a90f5b53a [0,2,0,0,0,0|2,0,0]=4 908 B8R0.1 NOCC(=O)NCCF 9e810ff41c2108c50e8d8b1b8bd5f2d7 [0,2,0,0,0,0|2,0,0]=4 909 B8R0.1 NOCC(=O)NCCI 1fcbed4147de39f8976794c95925d11c [0,2,0,0,0,0|2,0,0]=4 910 B8R0.1 NOCC(=O)NCCO fd618ddcd2c6c81b594a362cc110fd22 [0,2,0,0,0,0|2,0,0]=4 911 B8R0.1 NOCC(=O)NCCS 18d27bf78c6e7759f1c46eb3797eeb7e [0,2,0,0,0,0|2,0,0]=4 912 B8R0.1 O=C(CCF)NCCBr 4e6a83a04fff0ae2002d06f5532a71cf [0,2,0,0,0,0|1,0,0]=3 913 B8R0.1 O=C(CCF)NCCF 3ee47b2b4a969933bf6a2b7769d886d8 [0,2,0,0,0,0|1,0,0]=3 914 B8R0.1 O=C(CCF)NCCI 0514d32be9a459d35ff2d3dd8e59c8c1 [0,2,0,0,0,0|1,0,0]=3 915 B8R0.1 O=C(CCF)NCCO 8a006b90c0f677be977fd587da748001 [0,2,0,0,0,0|1,0,0]=3 916 B8R0.1 O=C(CCF)NCCS cc499bcf14cc4ef20c4a540fd4249535 [0,2,0,0,0,0|1,0,0]=3 917 B8R0.1 O=C(CCO)NCCBr 0598e39f87524871b714a958e56557af [0,2,0,0,0,0|1,0,0]=3 918 B8R0.1 O=C(CCO)NCCF fc3c58338add0c048e7e192017336dc4 [0,2,0,0,0,0|1,0,0]=3 919 B8R0.1 O=C(CCO)NCCI f4b9eac1b1d1ab1205b4f68c01e683b0 [0,2,0,0,0,0|1,0,0]=3 920 B8R0.1 O=C(CCO)NCCO baa85bba8951a71c692dae57f4f0b055 [0,2,0,0,0,0|1,0,0]=3 921 B8R0.1 O=C(CCO)NCCS 67e704856b61f7f4ce061f14d041dc6c [0,2,0,0,0,0|1,0,0]=3 922 B8R0.1 O=C(CCS)NCCBr 0eb47b0aecf2287af30d9b3e94e8bc58 [0,2,0,0,0,0|1,0,0]=3 923 B8R0.1 O=C(CCS)NCCF b7e186cad638003cfed1aa574b20f812 [0,2,0,0,0,0|1,0,0]=3 924 B8R0.1 O=C(CCS)NCCI 56f9d8039c6ce5f07f13c307d4e588bf [0,2,0,0,0,0|1,0,0]=3 925 B8R0.1 O=C(CCS)NCCO 41c5fbd04fe40888bf540f13522d8b85 [0,2,0,0,0,0|1,0,0]=3 926 B8R0.1 O=C(CCS)NCCS a425fac0fa57c463ae17426b0d0c8bcc [0,2,0,0,0,0|1,0,0]=3 927 B8R0.1 O=CCC(=O)NCCBr 8b1b2be7d6ffc84641a1c6691a60af35 [0,2,0,0,0,0|1,0,1]=4 928 B8R0.1 O=CCC(=O)NCCF 4ea801c19e9d5e221b09c0d94e9d22d6 [0,2,0,0,0,0|1,0,1]=4 929 B8R0.1 O=CCC(=O)NCCI 5e46bfbd499e49eb692800cabe7dbb38 [0,2,0,0,0,0|1,0,1]=4 930 B8R0.1 O=CCC(=O)NCCO f600ea136456fb823bf20010f6243059 [0,2,0,0,0,0|1,0,1]=4 931 B8R0.1 O=CCC(=O)NCCS a557fd8735c6b5636e1772043f123e46 [0,2,0,0,0,0|1,0,1]=4 932 B8R0.3 C#CC(=O)N(C)CCC e31f79932e58626d6b59443bb0ca318b [0,2,0,0,0,0|0,0,2]=4 933 B8R0.3 C#CC(C)N(C)CCC 706973cf50d20b9f98e7ade543e91017 [0,2,0,0,0,0|2,0,0]=4 934 B8R0.3 C#CCC(=O)N(C)CC 73ca8c63a4707a0b6119f039b47faca5 [0,2,0,0,0,0|0,0,2]=4 935 B8R0.3 C#CCN(C)C(=O)CC 986515c24c5cba923dd1dc1a9a42737b [0,2,0,0,0,0|0,0,2]=4 936 B8R0.3 C/C=C/C(=O)N(C)CC 010d03e6e98c063c8118cc9246730070 [0,2,0,0,0,0|0,0,2]=4 937 B8R0.3 C=CC(=O)N(C)CCC f05c81ec6e4b8b88c210d66f3d63ec26 [0,2,0,0,0,0|0,0,2]=4 938 B8R0.3 C=CC(C)N(C)CCC dcaf3d979e8229a6a7227fc47437ea40 [0,2,0,0,0,0|2,0,0]=4 939 B8R0.3 C=CCC(=O)N(C)CC f1b04e365d34b887e43935a62308491d [0,2,0,0,0,0|0,0,2]=4 940 B8R0.3 C=CCN(C)C(=O)CC 3bb2f9eb0189cead2c974a4fe74c9568 [0,2,0,0,0,0|0,0,2]=4 941 B8R0.3 CC#CC(=O)N(C)CC ce7ba14c4ba78c903b518b7ba2ff9505 [0,2,0,0,0,0|0,0,2]=4 942 B8R0.3 CCC(=O)C(C)NC#N 6b8a05126f6b8ceb590ab5e12295cf2c [0,2,0,0,0,0|1,0,1]=4 943 B8R0.3 CCC(=O)N(C)CC#N bbd7410fab9138839c6e0ddf06286d7c [0,2,0,0,0,0|1,0,1]=4 944 B8R0.3 CCC(=O)N(C)CCF 318a2530a556961418490c44b6c90fdd [0,2,0,0,0,0|1,0,0]=3 945 B8R0.3 CCC(=O)N(C)CCO e0dd9f4a6beab4473ee465efb09f2b8e [0,2,0,0,0,0|1,0,0]=3 946 B8R0.3 CCC(C)N(C)CCF b62eca3949be87e9f455c6c5d2a1d368 [0,2,0,0,0,0|2,0,0]=4 947 B8R0.3 CCC(C)N(C)CCO ce9dc1d5d90d70d93850fd69ffcd5f10 [0,2,0,0,0,0|2,0,0]=4 948 B8R0.3 CCC(C)N(C)CCS 4bdb870fddc268a2f497a46b052eb447 [0,2,0,0,0,0|2,0,0]=4 949 B8R0.3 CCC(C)N(C)COC fd54180cf301b5af5c09b4bd26add3bd [0,2,0,0,0,0|2,0,0]=4 950 B8R0.3 CCC(C)N(C)CSC c030143eb8397d3f16edf3acc369c78b [0,2,0,0,0,0|2,0,0]=4 951 B8R0.3 CCC(O)C(=O)NC#N 0600031cf5b0901051c25a910b158eca [0,2,0,0,0,0|1,0,1]=4 952 B8R0.3 CCCC(=O)N(C)CC d5f34bd9db3ccc82fc95365990f29579 [0,2,0,0,0,0|0,0,0]=2 953 B8R0.3 CCCC(C)N(C)CC 6499897a93030fa97deb05cc92a0b8e3 [0,2,0,0,0,0|1,0,1]=4 954 B8R0.3 CCCN(C)C(=O)C=O ae9046810fc57b836f1225fb4fa409a0 [0,2,0,0,0,0|1,0,1]=4 955 B8R0.3 CCCN(C)C(=O)CC ad1ab8a0f5c07e6ab73ee22aeb9c71a9 [0,2,0,0,0,0|0,0,0]=2 956 B8R0.3 CCCN(C)C(=O)CF 080c0d4ce746cadf5e3f0d9a56835299 [0,2,0,0,0,0|1,0,0]=3 957 B8R0.3 CCCN(C)C(=O)CO daa5d896fade5a1be51c39257fa3d5b8 [0,2,0,0,0,0|1,0,0]=3 958 B8R0.3 CCCN(C)C(=O)CS bcfb0bbfdb716f32aeb6ae13debe4701 [0,2,0,0,0,0|1,0,0]=3 959 B8R0.3 CCCN(C)C(C)C#N a9e6d245969307b068e5ecb3dd9afce5 [0,2,0,0,0,0|2,0,0]=4 960 B8R0.3 CCCN(C)C(C)C=O e6473a1a6d02a5e82b6c038acd576da0 [0,2,0,0,0,0|2,0,0]=4 961 B8R0.3 CCCN(C)C(C)CC e90ec3dd5d6af029f20e2d820addd400 [0,2,0,0,0,0|1,0,1]=4 962 B8R0.3 CCCN(C)C(C)CO 8beda8059033dea1a0c2a56f23876ffd [0,2,0,0,0,0|2,0,0]=4 963 B8R0.3 CCCN(C)[C@@H](C)CO ea309c3d5effa1e0573b19703dee4a64 [0,2,0,0,0,0|2,0,0]=4 964 B8R0.3 CCCN(C)[C@H](C)C=O 3790552277429781db5f53610a8878f0 [0,2,0,0,0,0|2,0,0]=4 965 B8R0.3 CCCN(C)[C@H](C)CO db553edf061f0eb78c1b59d7ccaebc82 [0,2,0,0,0,0|2,0,0]=4 966 B8R0.3 CCN(C)C(=O)CC#N dcebfd9a9f7d27a407319d1e05af0791 [0,2,0,0,0,0|1,0,1]=4 967 B8R0.3 CCN(C)C(=O)CC=O b54fcccc9e3ee76ebae8e137ce96a008 [0,2,0,0,0,0|1,0,1]=4 968 B8R0.3 CCN(C)C(=O)CCF e5a9ff21e8c2fcaad476896c3478fe71 [0,2,0,0,0,0|1,0,0]=3 969 B8R0.3 CCN(C)C(=O)CCO a768fc1ddb9cd71dd31e098b1227291c [0,2,0,0,0,0|1,0,0]=3 970 B8R0.3 CCN(C)C(=O)CCS 9063f4e5b939dc91c720aeb631377d8b [0,2,0,0,0,0|1,0,0]=3 971 B8R0.3 CCN(C)C(=O)COC bc075abf9590b9fbb9912b8588e5739b [0,2,0,0,0,0|1,0,0]=3 972 B8R0.3 CCN(C)C(=O)CON 6e0d14f683e9faf9643ea856a165130f [0,2,0,0,0,0|2,0,0]=4 973 B8R0.3 CCN(C)C(=O)CSC de841dcb44287d75dce30d4bffb7e292 [0,2,0,0,0,0|1,0,0]=3 974 B8R0.3 CCN(C)C(C)CCO 147ef76c8fa4150e2aaf31d64798013d [0,2,0,0,0,0|2,0,0]=4 975 B8R0.3 CCN(C)C(C)COC 46ed6fe0facd15cfd7b3a6c78dfc34e0 [0,2,0,0,0,0|2,0,0]=4 976 B8R0.3 CCN(C)[C@@H](C)CCO 24ac5e527b3f4820ff3091cd834d29a1 [0,2,0,0,0,0|2,0,0]=4 977 B8R0.3 CCNC(C)C(=O)NC 54efcfcba9f244b93d368cc4afd291fa [0,2,0,0,0,0|1,0,0]=3 978 B8R0.3 CCNC(C)C(C)CC 9ef4d65391d7628df65d08a9e996100f [0,2,0,0,0,0|1,0,1]=4 979 B8R0.3 CCOC(C)C(=O)OC 80e77c6690e50b9ea6c936f76ec2b497 [0,2,0,0,0,0|1,0,0]=3 980 B8R0.3 CCOC(C)C(C)CC bb6404bf405bb18f7200bca5bcafe98a [0,2,0,0,0,0|1,0,1]=4 981 B8R0.3 CCO[C@@H](C)C(=O)OC 0a1ea57ffacb6be3b6716af86dc8a3ee [0,2,0,0,0,0|1,0,0]=3 982 B8R0.3 CCO[C@H](C)C(=O)OC e42a135486ef83da240a803941dd4003 [0,2,0,0,0,0|1,0,0]=3 983 B8R0.3 CC[C@@H](O)C(=O)NC#N de1e0a87f1cf1807d937f8bc595db0ec [0,2,0,0,0,0|1,0,1]=4 984 B8R0.3 CC[C@H](O)C(=O)NC#N 16f8fc2f27602ba26683337bdba418eb [0,2,0,0,0,0|1,0,1]=4 985 B8R0.3 CC[C@H](S)C(=O)NC#N 05b0a612cfa626a0637f72d66ea12862 [0,2,0,0,0,0|1,0,1]=4 986 B8R0.3 CN(CCF)C(=O)CF 35c532d814bbb3a47d3ee2db2b778162 [0,2,0,0,0,0|2,0,0]=4 987 B8R0.3 CN(CCF)C(=O)CO ddf97572daeb555520ada3a08ed124af [0,2,0,0,0,0|2,0,0]=4 988 B8R0.3 CN(CCF)C(=O)CS cb4353eb02a664ba7768514381ab8f5f [0,2,0,0,0,0|2,0,0]=4 989 B8R0.3 CN(CCO)C(=O)CF 8eee296041fdc56c535d63fb7b27b7a2 [0,2,0,0,0,0|2,0,0]=4 990 B8R0.3 CN(CCO)C(=O)CO 8de638bdca0f8ac1cf08b4f0e65806cd [0,2,0,0,0,0|2,0,0]=4 991 B8R0.3 CN(CCO)C(=O)CS 797e71b888991b0f90a9d8c6273c3ef5 [0,2,0,0,0,0|2,0,0]=4 992 B8R0.3 CNC(=O)C(C)NCF 36961f48791e8b3196a594acce9c8e8a [0,2,0,0,0,0|2,0,0]=4 993 B8R0.3 CNC(=O)C(C)NCO a34e41a62dab697e3cedeec3c087b7b0 [0,2,0,0,0,0|2,0,0]=4 994 B8R0.3 COC(=O)C(C)OCF 225188b3064670e98f4e80d2140895bc [0,2,0,0,0,0|2,0,0]=4 995 B8R0.3 COC(=O)[C@@H](C)OCF 91f7505b58320e2d5e72e03fb5b0d0c5 [0,2,0,0,0,0|2,0,0]=4 996 B8R0.3 COC(=O)[C@H](C)OCF 1dbcfe62c201ad25840f7e5329cbdc78 [0,2,0,0,0,0|2,0,0]=4 997 B8R0.6 C#CC(=O)NCCCC 7b05ebf03d7d7168df7348c28a985d62 [0,2,0,0,0,0|0,0,2]=4 998 B8R0.6 C#CC(=O)NCCCCl 1e6f7ab06ab7dcf88ea4205ff8340824 [0,2,0,0,0,0|0,0,2]=4 999 B8R0.6 C#CC(=O)NCCCO 12d57d1037b70231cb0862460a64755d [0,2,0,0,0,0|0,0,2]=4 1000 B8R0.6 C#CC(=O)NCCOC 27d5f534cf46c1b30aac020f37738689 [0,2,0,0,0,0|0,0,2]=4 1001 B8R0.6 C#CC(=O)NCCSC 1d2889159a53b2ae0146f8d2c63c8c49 [0,2,0,0,0,0|0,0,2]=4 1002 B8R0.6 C#CCCCN(C)CC d07e2f10df165bd21e746a327d29556f [0,2,0,0,0,0|2,0,0]=4 1003 B8R0.6 C#CCCNC(=O)CC 675df9b37ab5c9ee6d5c9db4e0b3cee9 [0,2,0,0,0,0|0,0,1]=3 1004 B8R0.6 C#CCCNC(=O)CF f661d89f3d3636e8d1212d00c0cb7691 [0,2,0,0,0,0|1,0,1]=4 1005 B8R0.6 C#CCCNC(=O)CO 245d05e33dd6d7c5b17cadbb8fcf8809 [0,2,0,0,0,0|1,0,1]=4 1006 B8R0.6 C#CCCNC(=O)CS b02d4aacbc2726a1dcd91cf310ea6a30 [0,2,0,0,0,0|1,0,1]=4 1007 B8R0.6 C#CCNCC(=C)CC 883f577c86eca143c9a4a3f7b68c8c9d [0,2,0,0,0,0|1,0,1]=4 1008 B8R0.6 C#CCNCC(=O)CC c306a58106d871d66f9632f16da5a734 [0,2,0,0,0,0|0,0,1]=3 1009 B8R0.6 C#CCNCC(=O)CO a3c792cf03c227602ef2fbb618cf5767 [0,2,0,0,0,0|1,0,1]=4 1010 B8R0.6 C#CCNCC(=O)NC 0734edd1a455cb52847005383d65287a [0,2,0,0,0,0|1,0,1]=4 1011 B8R0.6 C#CCNCC(=O)OC 45a330447218442f782052439de91cbb [0,2,0,0,0,0|1,0,1]=4 1012 B8R0.6 C#CCOCC(=C)CC 8dcf5da4a7bcb5361796a0c436d6302d [0,2,0,0,0,0|1,0,1]=4 1013 B8R0.6 C#CCOCC(=O)CC 432ed08c7ed6528d6b4d9248e66c13d7 [0,2,0,0,0,0|0,0,1]=3 1014 B8R0.6 C#CCOCC(=O)NC c431f788de734fb576e66eb9c43d15bd [0,2,0,0,0,0|1,0,1]=4 1015 B8R0.6 C#CCOCC(=O)OC 1936252f7aa08c2478ab6a51c2564247 [0,2,0,0,0,0|1,0,1]=4 1016 B8R0.6 C=C(CC)CNCC#N 1fceed0a14b80281e38af76a85441f6a [0,2,0,0,0,0|1,0,1]=4 1017 B8R0.6 C=C(CC)CNCCBr 2997f31300e075e12280de78a538d6f2 [0,2,0,0,0,0|1,0,0]=3 1018 B8R0.6 C=C(CC)CNCCC 13f11be9634d172790672a2fd9a9840c [0,2,0,0,0,0|1,0,0]=3 1019 B8R0.6 C=C(CC)CNCCF 85aeaea14bf77498afd0be50514993fb [0,2,0,0,0,0|1,0,0]=3 1020 B8R0.6 C=C(CC)CNCCI 9c0b35da1e0c58b009e99741b9bb42bf [0,2,0,0,0,0|1,0,0]=3 1021 B8R0.6 C=C(CC)CNCCO 223a30784a1107a501d92d7e0122084b [0,2,0,0,0,0|1,0,0]=3 1022 B8R0.6 C=C(CC)CNCCS 1b35fc01c4a35914bb8ff69eeb12966e [0,2,0,0,0,0|1,0,0]=3 1023 B8R0.6 C=C(CC)COCC#N e8c99af9d025b410c3c6f961054d8c2c [0,2,0,0,0,0|1,0,1]=4 1024 B8R0.6 C=C(CC)COCCC 9a03753bc1b5bbc7ba706f1688ccd4c0 [0,2,0,0,0,0|1,0,0]=3 1025 B8R0.6 C=C(CC)COCCF e29bcc08014545601ec41df77fd3afb1 [0,2,0,0,0,0|1,0,0]=3 1026 B8R0.6 C=C(CC)COCCS 1954896189fc03c4d7a15c9e17b08731 [0,2,0,0,0,0|1,0,0]=3 1027 B8R0.6 C=C(CC)COCOC 8620d2b3e026d934a9f25c9b8e5eed2b [0,2,0,0,0,0|1,0,0]=3 1028 B8R0.6 C=C(CNCCBr)OC efbac263e7650d3962d08edf3ce114db [0,2,0,0,0,0|2,0,0]=4 1029 B8R0.6 C=C(CNCCC)OC 087b8e9db7c5cf69f544a95d2e04b5df [0,2,0,0,0,0|2,0,0]=4 1030 B8R0.6 C=C(CNCCF)OC 0e8256fb644c0f85910115699008ab8e [0,2,0,0,0,0|2,0,0]=4 1031 B8R0.6 C=C(CNCCI)OC fcef31f506379ae7bbc30bf7d4c63099 [0,2,0,0,0,0|2,0,0]=4 1032 B8R0.6 C=C(CNCCO)OC 134961a9d4e5df4956eb4f36508e1326 [0,2,0,0,0,0|2,0,0]=4 1033 B8R0.6 C=C(CNCCS)OC ce06596f455c7bf3f5895fe9ae52a28f [0,2,0,0,0,0|2,0,0]=4 1034 B8R0.6 C=C(CO)CNCCBr 1538cd8f5a19aefe9ac0222cecb7abd4 [0,2,0,0,0,0|2,0,0]=4 1035 B8R0.6 C=C(CO)CNCCC 1a3d72efe9d3ce84e285b2c8b91ed59f [0,2,0,0,0,0|2,0,0]=4 1036 B8R0.6 C=C(CO)CNCCF 3eb09a81d0db8d32f14af9b7972e103d [0,2,0,0,0,0|2,0,0]=4 1037 B8R0.6 C=C(CO)CNCCI 796bcf6c376951ccd776953135c6e059 [0,2,0,0,0,0|2,0,0]=4 1038 B8R0.6 C=C(CO)CNCCO 894d7668b7763d0cb8a4050ef9b33650 [0,2,0,0,0,0|2,0,0]=4 1039 B8R0.6 C=C(CO)CNCCS dfc962103906ef519e3299dc9c138cef [0,2,0,0,0,0|2,0,0]=4 1040 B8R0.6 C=C(COCCC)OC 35a576a479e84b27dbf4c71b4925086f [0,2,0,0,0,0|2,0,0]=4 1041 B8R0.6 C=C(COCCF)OC 781881c77dd820871f857506616f3c75 [0,2,0,0,0,0|2,0,0]=4 1042 B8R0.6 C=C(COCCS)OC 4d7d697d0d7ec1ce88163ba6265f360d [0,2,0,0,0,0|2,0,0]=4 1043 B8R0.6 C=C(COCOC)OC ecada7a2d0836d223f9478db3a9a4d4b [0,2,0,0,0,0|2,0,0]=4 1044 B8R0.6 C=CC(=O)NCCCC 4c95ec79288c2f88fcb23d3a93f15b5c [0,2,0,0,0,0|0,0,2]=4 1045 B8R0.6 C=CC(=O)NCCCCl b3fefab619db0213f8f1d61d24e52747 [0,2,0,0,0,0|0,0,2]=4 1046 B8R0.6 C=CC(=O)NCCCO 971fc82f543bd7f497b8eaa8021aa4fb [0,2,0,0,0,0|0,0,2]=4 1047 B8R0.6 C=CC(=O)NCCOC b4d5b95024e0e2b99e47a72a56678c9c [0,2,0,0,0,0|0,0,2]=4 1048 B8R0.6 C=CC(=O)NCCSC a0da03e1803175b8dbc6aea3d0fc86fe [0,2,0,0,0,0|0,0,2]=4 1049 B8R0.6 C=CC(=O)NCOCC a3acdb74bd061db7f0f50fdf176f3404 [0,2,0,0,0,0|0,0,2]=4 1050 B8R0.6 C=CCCCN(C)CC 1bec5e770716bf844a25a95ad899a7c4 [0,2,0,0,0,0|2,0,0]=4 1051 B8R0.6 C=CCCNC(=O)CC ff184ef1399f6dc8c7e919b7f0c5c0dc [0,2,0,0,0,0|0,0,1]=3 1052 B8R0.6 C=CCCNC(=O)CF e595841bb3a8b037270fdd22525fb536 [0,2,0,0,0,0|1,0,1]=4 1053 B8R0.6 C=CCCNC(=O)CO 98f6aad136129263a9e12af8510e3e51 [0,2,0,0,0,0|1,0,1]=4 1054 B8R0.6 C=CCCNC(=O)CS 50f27b0b579982ff12be8d4c6808e465 [0,2,0,0,0,0|1,0,1]=4 1055 B8R0.6 C=CCNCC(=O)NC f548b9ed621af83174e69d5d65b71e11 [0,2,0,0,0,0|1,0,1]=4 1056 B8R0.6 C=CCNCC(=O)OC 149a449e2131ace3a8ad23121b53b8be [0,2,0,0,0,0|1,0,1]=4 1057 B8R0.6 C=CCOCC(=O)CC 048d3235ebc96f1d1022e6a0b9b0b262 [0,2,0,0,0,0|0,0,1]=3 1058 B8R0.6 C=CCOCC(=O)NC 78ae20439406612f9980a44f6c28e411 [0,2,0,0,0,0|1,0,1]=4 1059 B8R0.6 C=CCOCC(=O)OC 4af7941697fe7abf28d3bb985f3618ec [0,2,0,0,0,0|1,0,1]=4 1060 B8R0.6 CC#CCNC(=O)CC 6d9ddda364502c2ffe7bd0b913f40e69 [0,2,0,0,0,0|0,0,1]=3 1061 B8R0.6 CC#CCNC(=O)CO 285f913d5587688230d414cb78c6b0e0 [0,2,0,0,0,0|1,0,1]=4 1062 B8R0.6 CC/C=C/CN(C)CC bc9391756a9e8870e2f8e1cea97c64ab [0,2,0,0,0,0|2,0,0]=4 1063 B8R0.6 CC=CCNC(=O)CC 0567aadeecba276bde20c091c56d95d3 [0,2,0,0,0,0|0,0,1]=3 1064 B8R0.6 CC=CCNC(=O)CF 0d5f7fd26f945e36e8c6eecf363d8b30 [0,2,0,0,0,0|1,0,1]=4 1065 B8R0.6 CC=CCNC(=O)CO 89f535fd64f7fddf0a20907685f7be1f [0,2,0,0,0,0|1,0,1]=4 1066 B8R0.6 CC=CCNC(=O)CS a2418ca7c15d5fb8667c73be3fb859b5 [0,2,0,0,0,0|1,0,1]=4 1067 B8R0.6 CCC(=O)CNCC#N cd2d4ac86eb31d1927746a139e109e79 [0,2,0,0,0,0|0,0,1]=3 1068 B8R0.6 CCC(=O)CNCCBr 4ae86c97534187fa67e366dfd1eebd3b [0,2,0,0,0,0|0,0,0]=2 1069 B8R0.6 CCC(=O)CNCCF 0bc469d08994cf5b5fbc36250b4ccf28 [0,2,0,0,0,0|0,0,0]=2 1070 B8R0.6 CCC(=O)CNCCI 652e280753f4ad7ee550469669c66e91 [0,2,0,0,0,0|0,0,0]=2 1071 B8R0.6 CCC(=O)CNCCO c42e5d5f257b37e8ba7acbbae4993f31 [0,2,0,0,0,0|0,0,0]=2 1072 B8R0.6 CCC(=O)CNCCS 5d6e1d449d9df5ddcd81a9e54a1f9bcc [0,2,0,0,0,0|0,0,0]=2 1073 B8R0.6 CCC(=O)COCC#N df5b26610d1a9f1f635c4ac5e628d5dd [0,2,0,0,0,0|0,0,1]=3 1074 B8R0.6 CCC(=O)COCC=O 7cd085a6fb80112ec425ed1d474b4c25 [0,2,0,0,0,0|0,0,1]=3 1075 B8R0.6 CCC(=O)COCCF 42452841604a6e08503574a608b88150 [0,2,0,0,0,0|0,0,0]=2 1076 B8R0.6 CCC(=O)COCCS 361d7f9395122f7ce5b0a13a0b0a8b7e [0,2,0,0,0,0|0,0,0]=2 1077 B8R0.6 CCC(=O)COCOC 2080604d4fba0b9d8e850f3f84775a84 [0,2,0,0,0,0|0,0,0]=2 1078 B8R0.6 CCC(=O)COCSC 20ce94165e7ab9ceae1e7c23a6d6840a [0,2,0,0,0,0|0,0,0]=2 1079 B8R0.6 CCC(=O)NCCC#N 48cc6a86c0c6f5553ba199e61ccae9bf [0,2,0,0,0,0|0,0,1]=3 1080 B8R0.6 CCC(=O)NCCCCl 8c01153ec31ae9cc62389708147e768e [0,2,0,0,0,0|0,0,0]=2 1081 B8R0.6 CCC(=O)NCCCO f98fa75986b7788f9e80577d0f4b70ab [0,2,0,0,0,0|0,0,0]=2 1082 B8R0.6 CCC(=O)NCCOC 23e877e020a2c5b2736fc6a95b7c4f02 [0,2,0,0,0,0|0,0,0]=2 1083 B8R0.6 CCC(=O)NCCON 5aa4ed8a34147e98db8513bba6021eb1 [0,2,0,0,0,0|1,0,0]=3 1084 B8R0.6 CCC(=O)NCCSC c0f9bf4f85b22a82daaa8b7807daec1c [0,2,0,0,0,0|0,0,0]=2 1085 B8R0.6 CCC(=O)OCNC#N fd730aec60d7749f463ba490eda97d3f [0,2,0,0,0,0|1,0,1]=4 1086 B8R0.6 CCC(C)CCNCF f015aff687b1ff0add996f7f0d7f62f2 [0,2,0,0,0,0|1,0,1]=4 1087 B8R0.6 CCC(C)CCNCO a717183e2753a65ce41087de67df43e3 [0,2,0,0,0,0|1,0,1]=4 1088 B8R0.6 CCC(C)CCOCF ad49fb93dbc6e5096875ca8b33e35d2e [0,2,0,0,0,0|1,0,1]=4 1089 B8R0.6 CCC(C)CNCCBr f2c1acb694015090e62b525b7fcc63c1 [0,2,0,0,0,0|1,0,1]=4 1090 B8R0.6 CCC(C)CNCCF 2769db0f6fb5ed4083dc6fe23af3689f [0,2,0,0,0,0|1,0,1]=4 1091 B8R0.6 CCC(C)CNCCI 3d06760a9b56f4c07583e19b707193ff [0,2,0,0,0,0|1,0,1]=4 1092 B8R0.6 CCC(C)CNCCO 155e71acafbdad94431c08477c016c1f [0,2,0,0,0,0|1,0,1]=4 1093 B8R0.6 CCC(C)CNCCS 5c126473eb834dd2e643033d1f0f9ac2 [0,2,0,0,0,0|1,0,1]=4 1094 B8R0.6 CCC(C)CNCOC 13c5f2ed1d7a15909177c430e4e9ec33 [0,2,0,0,0,0|1,0,1]=4 1095 B8R0.6 CCC(C)CNCSC 6f4b9794ed5c454ab126ae4d0e73a10c [0,2,0,0,0,0|1,0,1]=4 1096 B8R0.6 CCC(C)COCCF 234df3c7bd373782f0b57a992ab93926 [0,2,0,0,0,0|1,0,1]=4 1097 B8R0.6 CCC(C)COCCS 16a35ab92232b38df6f41f25daef241c [0,2,0,0,0,0|1,0,1]=4 1098 B8R0.6 CCC(C)COCOC 6dd199421c9efff2fe4c863bf565046e [0,2,0,0,0,0|1,0,1]=4 1099 B8R0.6 CCC(C)COCSC c71a7ed276355c4fd851325151b38886 [0,2,0,0,0,0|1,0,1]=4 1100 B8R0.6 CCC(C)NCCCCl 3c30fde6c5168ee70cde18df169dc1ce [0,2,0,0,0,0|1,0,1]=4 1101 B8R0.6 CCC(C)NCCCF 67c9382accd96be051c233c106bd6818 [0,2,0,0,0,0|1,0,1]=4 1102 B8R0.6 CCC(C)NCCCO 3a0518777cbee3c7e45bb22e20c87d57 [0,2,0,0,0,0|1,0,1]=4 1103 B8R0.6 CCC(C)NCCCS 305cc88eaf0bb6e07e1ce30e503bc156 [0,2,0,0,0,0|1,0,1]=4 1104 B8R0.6 CCC(C)NCCOC c25488696c4e2089a7e730cde3ffad4c [0,2,0,0,0,0|1,0,1]=4 1105 B8R0.6 CCC(C)NCCSC a7b869a85f7710a25c36dcb603db041a [0,2,0,0,0,0|1,0,1]=4 1106 B8R0.6 CCC(C)OCCCF 7608266ccc7b050cb1109bc78c6b6506 [0,2,0,0,0,0|1,0,1]=4 1107 B8R0.6 CCC(C)OCCCS 59569899c7c7ea5a22586613c30dc74b [0,2,0,0,0,0|1,0,1]=4 1108 B8R0.6 CCC(C)OCCOC 0f412b4c400bcc343476480e66445e27 [0,2,0,0,0,0|1,0,1]=4 1109 B8R0.6 CCC(C)OCCSC f2031df256af2f97a18e4ed202bceae8 [0,2,0,0,0,0|1,0,1]=4 1110 B8R0.6 CCC(O)CNCCBr e2edc0ed761b04f9e42e0bfe3130b7c4 [0,2,0,0,0,0|0,0,2]=4 1111 B8R0.6 CCC(O)CNCCF 7c3f9931d25397f538ac2b825e8e2390 [0,2,0,0,0,0|0,0,2]=4 1112 B8R0.6 CCC(O)CNCCI ec21990b8ca8b131d3bfcc4fdea9ff92 [0,2,0,0,0,0|0,0,2]=4 1113 B8R0.6 CCC(O)CNCCO 0f04ff5d22921fddd4b4780d1da4ee6b [0,2,0,0,0,0|0,0,2]=4 1114 B8R0.6 CCC(O)CNCCS af4d3531d9811cf0462def51ad90232b [0,2,0,0,0,0|0,0,2]=4 1115 B8R0.6 CCC(O)CNCOC 7e726222b7d1cf65b1b34e06014a8122 [0,2,0,0,0,0|0,0,2]=4 1116 B8R0.6 CCC(O)CNCSC 90eb85890f9346ff85a79d6fda8b686c [0,2,0,0,0,0|0,0,2]=4 1117 B8R0.6 CCC(S)CCOCF fd9f97763905898c36d44cc90e7d0d91 [0,2,0,0,0,0|0,1,1]=4 1118 B8R0.6 CCCCCN(C)CC 9518c2300d9243488291f90365ee6acc [0,2,0,0,0,0|2,0,0]=4 1119 B8R0.6 CCCCNC(=O)C=O f208026ec74ccdc3b90201942951f82d [0,2,0,0,0,0|1,0,1]=4 1120 B8R0.6 CCCCNC(=O)CC 285e0c69f0d3b13983c95eed26c8d721 [0,2,0,0,0,0|0,0,0]=2 1121 B8R0.6 CCCCNC(=O)CF ccc4967a8e0a27400c7d0139924f7409 [0,2,0,0,0,0|1,0,0]=3 1122 B8R0.6 CCCCNC(=O)CO a7ebdf854bf2900347fbb690e8e35978 [0,2,0,0,0,0|1,0,0]=3 1123 B8R0.6 CCCCNC(=O)CS c89622d02eae8eb9fb1a47fc8bb6fb10 [0,2,0,0,0,0|1,0,0]=3 1124 B8R0.6 CCCCNC(C)CC 2d727d0865e21d5f41a267ce6ca08059 [0,2,0,0,0,0|1,0,1]=4 1125 B8R0.6 CCCCN[C@@H](C)CC a2ad9889b2a85548549a6f2a7991a4fa [0,2,0,0,0,0|1,0,1]=4 1126 B8R0.6 CCCCN[C@H](C)CC 3ba343d5b09052d6e4ca4f315fa7a56a [0,2,0,0,0,0|1,0,1]=4 1127 B8R0.6 CCCCOC(C)CC 7b743840237d8f1167e2a19145e2bb11 [0,2,0,0,0,0|1,0,1]=4 1128 B8R0.6 CCCCO[C@@H](C)CC 0568b6feb97809cefc1cbb08ceebedee [0,2,0,0,0,0|1,0,1]=4 1129 B8R0.6 CCCCO[C@H](C)CC 62d88e9696eb4ecbfe2b32e610c029fe [0,2,0,0,0,0|1,0,1]=4 1130 B8R0.6 CCCNCC(=O)CC 5f434fb49a11666bfc9ba500f0cbcfca [0,2,0,0,0,0|0,0,0]=2 1131 B8R0.6 CCCNCC(=O)CO c0d2ea34a02dfba5aebbad6447271711 [0,2,0,0,0,0|1,0,0]=3 1132 B8R0.6 CCCNCC(=O)NC eb0d012f1c9ad7dec4f4287f037196b3 [0,2,0,0,0,0|1,0,0]=3 1133 B8R0.6 CCCNCC(=O)NO ef6f70702891ae45e4d4bb0573b2f089 [0,2,0,0,0,0|2,0,0]=4 1134 B8R0.6 CCCNCC(=O)OC 3b0745436e6aac5047a752faa3629f9d [0,2,0,0,0,0|1,0,0]=3 1135 B8R0.6 CCCNCC(C)CC dfac60b2da2755308d3835afbc0d45f5 [0,2,0,0,0,0|1,0,1]=4 1136 B8R0.6 CCCNCC(O)CC 418992374fd97112480430826829281d [0,2,0,0,0,0|0,0,2]=4 1137 B8R0.6 CCCNC[C@@H](C)CC 73078e899264ad747d5de555aa4e0e85 [0,2,0,0,0,0|1,0,1]=4 1138 B8R0.6 CCCNC[C@H](C)CC eb45f8e833f0797e2ccdb45de94e8f7b [0,2,0,0,0,0|1,0,1]=4 1139 B8R0.6 CCCNC[C@H](O)CC 9211d5b7ca8f98bcbe3545d0e681e4b6 [0,2,0,0,0,0|0,0,2]=4 1140 B8R0.6 CCCOCC(=O)CC 3f397a74b90866b03f1163a524097d68 [0,2,0,0,0,0|0,0,0]=2 1141 B8R0.6 CCCOCC(=O)NC 58f4813a2cc9a1be45793f06ebe468ea [0,2,0,0,0,0|1,0,0]=3 1142 B8R0.6 CCCOCC(=O)OC c6e77fb768013ea608698b73991c1be0 [0,2,0,0,0,0|1,0,0]=3 1143 B8R0.6 CCCOCC(C)CC 8336a8fc5b3ea2d1a4239fcc430df35e [0,2,0,0,0,0|1,0,1]=4 1144 B8R0.6 CCCOC[C@@H](C)CC c84fe828e09e77472347432e2d809559 [0,2,0,0,0,0|1,0,1]=4 1145 B8R0.6 CCCOC[C@H](C)CC a570cde5a141abc9ae194e132ed8fa20 [0,2,0,0,0,0|1,0,1]=4 1146 B8R0.6 CCN(C)CCCC#N eb2e9a0dc19f85240e99c0db3e4231dd [0,2,0,0,0,0|2,0,0]=4 1147 B8R0.6 CCN(C)CCCC=O 3dbfe5dc5050d94978ae64e6b9604998 [0,2,0,0,0,0|2,0,0]=4 1148 B8R0.6 CCN(C)CCCCF 9cba963fe29e0e981772352c51d7f232 [0,2,0,0,0,0|2,0,0]=4 1149 B8R0.6 CCN(C)CCCCO ef06c44e12b4087385bee7efb58bc669 [0,2,0,0,0,0|2,0,0]=4 1150 B8R0.6 CCN(C)CCCOC 9daef8ee27bac836bae693fac9c07495 [0,2,0,0,0,0|2,0,0]=4 1151 B8R0.6 CCN(C)CCCSC 730187a2113fbfde3873dca10ec6b3c0 [0,2,0,0,0,0|2,0,0]=4 1152 B8R0.6 CCNCCC(=O)NC 1e9b17ee02ba0e5b6aaaa347b3dcbe57 [0,2,0,0,0,0|1,0,0]=3 1153 B8R0.6 CCNCCC(=O)NO 160d8ac572661099c06b72037ca2e0ea [0,2,0,0,0,0|2,0,0]=4 1154 B8R0.6 CCNCCC(=O)OC bbd99f235af5ec44deb263c1fbced8c5 [0,2,0,0,0,0|1,0,0]=3 1155 B8R0.6 CCNCCC(C)CC 7d7a35762e8ac86a31a49df307629678 [0,2,0,0,0,0|1,0,1]=4 1156 B8R0.6 CCOCCC(=O)NC 04f56cfd8d6885a7e2cb20782e900533 [0,2,0,0,0,0|1,0,0]=3 1157 B8R0.6 CCOCCC(=O)OC 6c8ac8346f4b448f7b384f7ba30dc419 [0,2,0,0,0,0|1,0,0]=3 1158 B8R0.6 CCOCCC(C)CC 0554257e939379702c3853cde29331cf [0,2,0,0,0,0|1,0,1]=4 1159 B8R0.6 CCOCCC(S)CC b96bbf1eb0d6bf468c99e0b8751c21b4 [0,2,0,0,0,0|0,1,1]=4 1160 B8R0.6 CCOCCN(C)CC 5ffc8bba3835a9b9f54e3085f5b172e3 [0,2,0,0,0,0|2,0,0]=4 1161 B8R0.6 CCOCC[C@@H](C)CC 6ed2f49f8ab9032ae166b1c906dbc07b [0,2,0,0,0,0|1,0,1]=4 1162 B8R0.6 CCOCNC(C)CC a50cfb6bab39a8e8ca1df13c044b9618 [0,2,0,0,0,0|1,0,1]=4 1163 B8R0.6 CCOCN[C@@H](C)CC eafd6067d8849e68d1c8e6372c09bb92 [0,2,0,0,0,0|1,0,1]=4 1164 B8R0.6 CCOCN[C@H](C)CC 7124a0d463babe6fa7c8959fa3126e15 [0,2,0,0,0,0|1,0,1]=4 1165 B8R0.6 CCSCCN(C)CC 077f8ad0cd3fd5bb632eef062cc525ef [0,2,0,0,0,0|2,0,0]=4 1166 B8R0.6 CC[C@@H](C)CNCCBr 97d367e508fd39dc3ddcec44a8683cec [0,2,0,0,0,0|1,0,1]=4 1167 B8R0.6 CC[C@@H](C)CNCCF 371b9b1c5529111d353d598e0b5660cb [0,2,0,0,0,0|1,0,1]=4 1168 B8R0.6 CC[C@@H](C)CNCCI 32d54f8cdc3ec06753f18e3bb05477b7 [0,2,0,0,0,0|1,0,1]=4 1169 B8R0.6 CC[C@@H](C)CNCCO e1fd496afac14166a64ee9248481c552 [0,2,0,0,0,0|1,0,1]=4 1170 B8R0.6 CC[C@@H](C)CNCCS e87b39ea520a94f7427ff9e1f94a277c [0,2,0,0,0,0|1,0,1]=4 1171 B8R0.6 CC[C@@H](C)COCCF e20d781119f6b53ffb68ed6751ccaab2 [0,2,0,0,0,0|1,0,1]=4 1172 B8R0.6 CC[C@@H](C)COCCS 234dff13be40377c551514da0380e41f [0,2,0,0,0,0|1,0,1]=4 1173 B8R0.6 CC[C@@H](C)COCOC a052b0577e11ad1f5f6decbf2a414fe8 [0,2,0,0,0,0|1,0,1]=4 1174 B8R0.6 CC[C@@H](C)COCSC 8b471433ffcca29c79070d25016db951 [0,2,0,0,0,0|1,0,1]=4 1175 B8R0.6 CC[C@@H](C)NCCCF 5505371a202bfecabfd929226673cd4e [0,2,0,0,0,0|1,0,1]=4 1176 B8R0.6 CC[C@@H](C)NCCCO dc42ae2f8c45e28af7ed7e47c2ed7508 [0,2,0,0,0,0|1,0,1]=4 1177 B8R0.6 CC[C@@H](C)NCCCS d018b350a4f6c69980561293a6f52a5a [0,2,0,0,0,0|1,0,1]=4 1178 B8R0.6 CC[C@@H](C)NCCOC 9bc6267f1aec0efa010d02896e34635b [0,2,0,0,0,0|1,0,1]=4 1179 B8R0.6 CC[C@@H](C)NCCSC 3870552ed0d765a76f3d579fe3568814 [0,2,0,0,0,0|1,0,1]=4 1180 B8R0.6 CC[C@@H](C)OCCCF 7b91ef4d02ffce6366f05b07d4bc01d9 [0,2,0,0,0,0|1,0,1]=4 1181 B8R0.6 CC[C@@H](C)OCCCS 6c6c2f22fccb8037a5b6c2c37163f959 [0,2,0,0,0,0|1,0,1]=4 1182 B8R0.6 CC[C@@H](C)OCCOC db30ac2bff0c750a2289ad4cf8a04d34 [0,2,0,0,0,0|1,0,1]=4 1183 B8R0.6 CC[C@@H](C)OCCSC ce99c06b76dfa3d0696884b1a7785ccb [0,2,0,0,0,0|1,0,1]=4 1184 B8R0.6 CC[C@@H](O)CNCCF ab2179a61a0061db8ccb5d6628318056 [0,2,0,0,0,0|0,0,2]=4 1185 B8R0.6 CC[C@@H](O)CNCCO 2d13f38d004c7cf2314b4c12b78a382f [0,2,0,0,0,0|0,0,2]=4 1186 B8R0.6 CC[C@@H](O)CNCCS f07a3a4faf31bc76369ee3588298a97a [0,2,0,0,0,0|0,0,2]=4 1187 B8R0.6 CC[C@@H](O)CNCOC c15579c32ff0b418e45b4ce562e1544d [0,2,0,0,0,0|0,0,2]=4 1188 B8R0.6 CC[C@@H](O)CNCSC 602f6216f9b7c4d64254ea6d16f3608f [0,2,0,0,0,0|0,0,2]=4 1189 B8R0.6 CC[C@H](C)CCOCF 4b30d5d94bbbb4fdbcf22cabd2f557ea [0,2,0,0,0,0|1,0,1]=4 1190 B8R0.6 CC[C@H](C)CNCCBr 2e85ca9af829ee3543f995580cf76d82 [0,2,0,0,0,0|1,0,1]=4 1191 B8R0.6 CC[C@H](C)CNCCF fd752c7a6560f165a21d0e39ed53ebde [0,2,0,0,0,0|1,0,1]=4 1192 B8R0.6 CC[C@H](C)CNCCI 26f262acafd0f04ce8a19af0b38e24de [0,2,0,0,0,0|1,0,1]=4 1193 B8R0.6 CC[C@H](C)CNCCO b6e69a08d3d39a8bf31c308cc288716e [0,2,0,0,0,0|1,0,1]=4 1194 B8R0.6 CC[C@H](C)CNCCS 8becd07c6bd7a230f4fc120a932c3696 [0,2,0,0,0,0|1,0,1]=4 1195 B8R0.6 CC[C@H](C)CNCOC 8d958d2c5c153e54d7b348639f09f01f [0,2,0,0,0,0|1,0,1]=4 1196 B8R0.6 CC[C@H](C)CNCSC 09c62bc5d5574c3389dd8bafebc19969 [0,2,0,0,0,0|1,0,1]=4 1197 B8R0.6 CC[C@H](C)COCCF a3b7b17681d654662c51b9200aeead3e [0,2,0,0,0,0|1,0,1]=4 1198 B8R0.6 CC[C@H](C)COCCS 6e8b2990a3d1b06c800b4386782cc666 [0,2,0,0,0,0|1,0,1]=4 1199 B8R0.6 CC[C@H](C)COCOC c9deb84f6c5c3c42953d4555c52f366b [0,2,0,0,0,0|1,0,1]=4 1200 B8R0.6 CC[C@H](C)COCSC 8b7f4fdb54794462883a4b1b9a971b1c [0,2,0,0,0,0|1,0,1]=4 1201 B8R0.6 CC[C@H](C)NCCCF d08d092d569ce6563951c753af4fb97c [0,2,0,0,0,0|1,0,1]=4 1202 B8R0.6 CC[C@H](C)NCCCO ecbac2a864467c7a08e0fe04708373c7 [0,2,0,0,0,0|1,0,1]=4 1203 B8R0.6 CC[C@H](C)NCCCS cdf23c371c67ce79e2901b4af058d9c9 [0,2,0,0,0,0|1,0,1]=4 1204 B8R0.6 CC[C@H](C)NCCOC 38a5269e53cebe3176cb690b2be4e7fa [0,2,0,0,0,0|1,0,1]=4 1205 B8R0.6 CC[C@H](C)NCCSC b6fc5b7faab69eb04934aa5da5f5a009 [0,2,0,0,0,0|1,0,1]=4 1206 B8R0.6 CC[C@H](C)OCCCF b238d2d8b5858677f211108a6f007a3e [0,2,0,0,0,0|1,0,1]=4 1207 B8R0.6 CC[C@H](C)OCCCS a5391396126af079b7e941809a4b6adf [0,2,0,0,0,0|1,0,1]=4 1208 B8R0.6 CC[C@H](C)OCCOC fe75e9412a4cbec1e3be8b753803fef8 [0,2,0,0,0,0|1,0,1]=4 1209 B8R0.6 CC[C@H](C)OCCSC 859d8c0e08c17053da54ea6974440015 [0,2,0,0,0,0|1,0,1]=4 1210 B8R0.6 CNC(=O)CCNC#N 9df6bde8ff5527a9a9b73672aa2859de [0,2,0,0,0,0|1,0,1]=4 1211 B8R0.6 CNC(=O)CCNC=O 0287357d6b05e381fe3090944ec763f1 [0,2,0,0,0,0|1,0,1]=4 1212 B8R0.6 CNC(=O)CCNCF 7d032297ec7b15962e82d70691941148 [0,2,0,0,0,0|1,0,0]=3 1213 B8R0.6 CNC(=O)CCNCO f9748f0c4978ae72b7a558591315c7a3 [0,2,0,0,0,0|1,0,0]=3 1214 B8R0.6 CNC(=O)CCOCF d44958e5865e9e15b8b4578e30ceba1f [0,2,0,0,0,0|1,0,0]=3 1215 B8R0.6 CNC(=O)CNCC#N 995edbbfaf01ad1a0a32b6c67bcaab1a [0,2,0,0,0,0|1,0,1]=4 1216 B8R0.6 CNC(=O)CNCC=O cfe6c3d1fbc6a8a471727a0cb22b0fb6 [0,2,0,0,0,0|1,0,1]=4 1217 B8R0.6 CNC(=O)CNCCBr 6c7bbb2b8e2277851a9c4b1ee98b855e [0,2,0,0,0,0|1,0,0]=3 1218 B8R0.6 CNC(=O)CNCCF ad7e29831d5186eb0f908b77a11c392c [0,2,0,0,0,0|1,0,0]=3 1219 B8R0.6 CNC(=O)CNCCI e2ceae3c2127a1926854bc9548bd60de [0,2,0,0,0,0|1,0,0]=3 1220 B8R0.6 CNC(=O)CNCCO 6524c53498939c1e86b45867695a7210 [0,2,0,0,0,0|1,0,0]=3 1221 B8R0.6 CNC(=O)CNCCS 910fb23341c3da7d5e154bf7558a8aca [0,2,0,0,0,0|1,0,0]=3 1222 B8R0.6 CNC(=O)CNCOC 8847ec992234bab2b496b10120a2af91 [0,2,0,0,0,0|1,0,0]=3 1223 B8R0.6 CNC(=O)CNCSC 885b3d7715d4a99b7fd1330a008578d3 [0,2,0,0,0,0|1,0,0]=3 1224 B8R0.6 CNC(=O)COCC#N b0d1e0c2d2fe987e58b15aa862461a14 [0,2,0,0,0,0|1,0,1]=4 1225 B8R0.6 CNC(=O)COCC=O 8efd894a0631a7157c9af1a4a1868776 [0,2,0,0,0,0|1,0,1]=4 1226 B8R0.6 CNC(=O)COCCF 12ab537cbcf65659b34d887d9c7fb928 [0,2,0,0,0,0|1,0,0]=3 1227 B8R0.6 CNC(=O)COCCS 63270616340bb3c6f39f4a96b70e09a6 [0,2,0,0,0,0|1,0,0]=3 1228 B8R0.6 CNC(=O)COCOC 3537c715a815bdbf6b14bfada111b9bd [0,2,0,0,0,0|1,0,0]=3 1229 B8R0.6 CNC(=O)COCSC 241621ed8c34a22b0f5a33905a2ce887 [0,2,0,0,0,0|1,0,0]=3 1230 B8R0.6 COC(=O)CCNC#N 7a530d6d679d08354249cd6e728a86d9 [0,2,0,0,0,0|1,0,1]=4 1231 B8R0.6 COC(=O)CCNC=O 8ac47f4f93ba11ad1bac38fab4d03870 [0,2,0,0,0,0|1,0,1]=4 1232 B8R0.6 COC(=O)CCNCF c9ea88c8e4da792c48ff261f6679c953 [0,2,0,0,0,0|1,0,0]=3 1233 B8R0.6 COC(=O)CCNCO 9bc4822c35c94c877fc0ddc05b282774 [0,2,0,0,0,0|1,0,0]=3 1234 B8R0.6 COC(=O)CCOCF 2f015a84e5a71939cec0c0c38276031f [0,2,0,0,0,0|1,0,0]=3 1235 B8R0.6 COC(=O)CNCC#N e54efd0e7cdfa4eb3c060e8dafdb53cb [0,2,0,0,0,0|1,0,1]=4 1236 B8R0.6 COC(=O)CNCC=O 1fc8d9a11636943df274e536a047e50f [0,2,0,0,0,0|1,0,1]=4 1237 B8R0.6 COC(=O)CNCCBr e28aeca94e61f0de9c0ea2f9b9e87e88 [0,2,0,0,0,0|1,0,0]=3 1238 B8R0.6 COC(=O)CNCCF d4a8c2b68347ac06f3cf07a0af263386 [0,2,0,0,0,0|1,0,0]=3 1239 B8R0.6 COC(=O)CNCCI 45efb0e66cb53512c5450123a0571534 [0,2,0,0,0,0|1,0,0]=3 1240 B8R0.6 COC(=O)CNCCO 9abf03e13c5594ade083b34dd22b9514 [0,2,0,0,0,0|1,0,0]=3 1241 B8R0.6 COC(=O)CNCCS dafa382862b39c74b9bcdca9e45699c9 [0,2,0,0,0,0|1,0,0]=3 1242 B8R0.6 COC(=O)CNCSC 8f9e6be1c8a25920663107a786d297b6 [0,2,0,0,0,0|1,0,0]=3 1243 B8R0.6 COC(=O)COCC#N d961317c976447afdfd8be4bef3f1d28 [0,2,0,0,0,0|1,0,1]=4 1244 B8R0.6 COC(=O)COCC=O 0afb003629944418146881e5868bab6a [0,2,0,0,0,0|1,0,1]=4 1245 B8R0.6 COC(=O)COCCF 5fd538a27028a3025713a820ebe3ece9 [0,2,0,0,0,0|1,0,0]=3 1246 B8R0.6 COC(=O)COCCS 8cf490d3a85a4d72de5bf7120c96cf93 [0,2,0,0,0,0|1,0,0]=3 1247 B8R0.6 COC(=O)COCSC 0a7a5ae46e24085ed1063ee9467aa6ec [0,2,0,0,0,0|1,0,0]=3 1248 B8R0.6 COCCNC(=O)C=O 479a8f4f41f775ca2b6ce8e0cf56b6b2 [0,2,0,0,0,0|1,0,1]=4 1249 B8R0.6 COCCNC(=O)CF a94db18f72aef2ec4c716239c23c2008 [0,2,0,0,0,0|1,0,0]=3 1250 B8R0.6 COCCNC(=O)CO d671289b16ab36037d0c8d78118b8d68 [0,2,0,0,0,0|1,0,0]=3 1251 B8R0.6 COCCNC(=O)CS 4b3174b27751971a4c745429c4f67196 [0,2,0,0,0,0|1,0,0]=3 1252 B8R0.6 COCNCC(=O)NO 6370b599efa65c671e4aeafd65f9dc2d [0,2,0,0,0,0|2,0,0]=4 1253 B8R0.6 COCNCC(=O)OC 418d993c7f5c594cafa954c9550f79e1 [0,2,0,0,0,0|1,0,0]=3 1254 B8R0.6 COCOCC(=O)OC 2b399bb8cae6f66d03fa8086bd2ee628 [0,2,0,0,0,0|1,0,0]=3 1255 B8R0.6 CSCCNC(=O)C=O 7c8e4143d4355f24a51fc16bfc32d9a1 [0,2,0,0,0,0|1,0,1]=4 1256 B8R0.6 CSCCNC(=O)CF 57944584a9e694467df2be000c951ad6 [0,2,0,0,0,0|1,0,0]=3 1257 B8R0.6 CSCCNC(=O)CO 65e8216c2feaa293039f65fdae32ef6d [0,2,0,0,0,0|1,0,0]=3 1258 B8R0.6 CSCCNC(=O)CS 2af34aeed751cd9e812792b0dc7e1060 [0,2,0,0,0,0|1,0,0]=3 1259 B8R0.6 CSCNCC(=O)NO 9162eae199ecb4fcb04238ef65fba3a9 [0,2,0,0,0,0|2,0,0]=4 1260 B8R0.6 N#CCCNC(=O)CF 2643834fc249ed8abee54c3d144bbf1a [0,2,0,0,0,0|1,0,1]=4 1261 B8R0.6 N#CCCNC(=O)CO 87c406c5bc0dc45a014108f83918aa54 [0,2,0,0,0,0|1,0,1]=4 1262 B8R0.6 N#CCCNC(=O)CS 55e53c6938d3487fe14e760cf3e6c811 [0,2,0,0,0,0|1,0,1]=4 1263 B8R0.6 N#CCNCC(=O)CO 5e8f28f2fb25f63df04e6bffce39c5fd [0,2,0,0,0,0|1,0,1]=4 1264 B8R0.6 NOCCNC(=O)CF 46907fa58646111f9869cb76f3fa548d [0,2,0,0,0,0|2,0,0]=4 1265 B8R0.6 NOCCNC(=O)CO d33eb512bcee6c5a14c6336e1dded456 [0,2,0,0,0,0|2,0,0]=4 1266 B8R0.6 NOCCNC(=O)CS 0e95ecc1ba2742311363fa4125fb38fb [0,2,0,0,0,0|2,0,0]=4 1267 B8R0.6 O=C(CCNCF)NO aaad06265f693e1393c4e11198291b97 [0,2,0,0,0,0|2,0,0]=4 1268 B8R0.6 O=C(CCNCO)NO a2ec66bacb8f2a5bbd11eb6132728c80 [0,2,0,0,0,0|2,0,0]=4 1269 B8R0.6 O=C(CF)NCCCCl 934b8e6ee889c80727ea8b7e3cae7f71 [0,2,0,0,0,0|1,0,0]=3 1270 B8R0.6 O=C(CF)NCCCO f98476c767e724b095b3ceb9c47c191c [0,2,0,0,0,0|1,0,0]=3 1271 B8R0.6 O=C(CNCCF)NO 4ede23953c58be1266bfab49008bd398 [0,2,0,0,0,0|2,0,0]=4 1272 B8R0.6 O=C(CNCCO)NO 9399a3f3247500214a3724c003b791f0 [0,2,0,0,0,0|2,0,0]=4 1273 B8R0.6 O=C(CNCCS)NO 6bd3c1ae8f710265188a27a831a6425d [0,2,0,0,0,0|2,0,0]=4 1274 B8R0.6 O=C(CO)CNCCBr 4b4dd4df91e92b925ca40ac918c073a9 [0,2,0,0,0,0|1,0,0]=3 1275 B8R0.6 O=C(CO)CNCCF 9f05edaf4811ba7f9ac498eb6a37ffc4 [0,2,0,0,0,0|1,0,0]=3 1276 B8R0.6 O=C(CO)CNCCI fad7dbe7caa4eb2201e5d92c6c999ddf [0,2,0,0,0,0|1,0,0]=3 1277 B8R0.6 O=C(CO)CNCCO 8473c1767740ea9d135f46111299d63c [0,2,0,0,0,0|1,0,0]=3 1278 B8R0.6 O=C(CO)CNCCS 0b181a826e47050c4e6ba69a8d17fa11 [0,2,0,0,0,0|1,0,0]=3 1279 B8R0.6 O=C(CO)NCCCCl 0c789d035d9d5ee643962906d4106d8a [0,2,0,0,0,0|1,0,0]=3 1280 B8R0.6 O=C(CO)NCCCO 8d20a4d16a68281342a6c9aa794f8168 [0,2,0,0,0,0|1,0,0]=3 1281 B8R0.6 O=C(CS)NCCCCl 17654daec75e68e56a406f3209f982cd [0,2,0,0,0,0|1,0,0]=3 1282 B8R0.6 O=C(CS)NCCCO 9609fec7c0df8b51e8b529e1db0af996 [0,2,0,0,0,0|1,0,0]=3 1283 B8R0.6 O=CC(=O)NCCCCl 64f1b2357217366e1bf6fcb0b40fa18e [0,2,0,0,0,0|1,0,1]=4 1284 B8R0.6 O=CC(=O)NCCCO c7baf2e22cfdb49043ef0f7982d363e4 [0,2,0,0,0,0|1,0,1]=4 1285 B8R0.8 C#CCNC(=O)C(C)F 3bd6b3d008f74a7b92576fa8d3ee07f0 [0,2,0,0,0,0|0,0,2]=4 1286 B8R0.8 C#CCNC(=O)C(C)S 463f09ba8cd194865aee9042dbab29f6 [0,2,0,0,0,0|0,0,2]=4 1287 B8R0.8 C#CCNC(=O)[C@@H](C)F 6870a795dfc6747a5a33c9070084e8b8 [0,2,0,0,0,0|0,0,2]=4 1288 B8R0.8 C#CCNC(=O)[C@H](C)F 5009ea4b6fd85bf1f1d131d8b9bd14f1 [0,2,0,0,0,0|0,0,2]=4 1289 B8R0.8 C=C(Br)C(=O)NCCC 2837c9555b8dd6316a0bf9942b0335eb [0,2,0,0,0,0|0,0,2]=4 1290 B8R0.8 C=C(C)C(=O)NCCBr 61120e26dbeb4e895f737bdf6d4436bb [0,2,0,0,0,0|1,0,1]=4 1291 B8R0.8 C=C(C)C(=O)NCCC 2afd5e95dd9734696b78b1287c8e40c3 [0,2,0,0,0,0|0,0,1]=3 1292 B8R0.8 C=C(C)C(=O)NCCF 72013eef2585a0c39d2ebbaa6d0c72b9 [0,2,0,0,0,0|1,0,1]=4 1293 B8R0.8 C=C(C)C(=O)NCCI cb5688c5d662b39b7123ac0fec17c67d [0,2,0,0,0,0|1,0,1]=4 1294 B8R0.8 C=C(C)C(=O)NCCO 5937f095d3991cd8f739a66f2a9c04e9 [0,2,0,0,0,0|1,0,1]=4 1295 B8R0.8 C=C(C)C(=O)NCCS 338ac740b4761d63bc015d9cb77d6c81 [0,2,0,0,0,0|1,0,1]=4 1296 B8R0.8 C=C(Cl)C(=O)NCCC 7fabd2186cb29ffd4c2fa87ca91a4c93 [0,2,0,0,0,0|0,0,2]=4 1297 B8R0.8 C=C(F)C(=O)NCCC 94823a38af8f5e8e7e73928fc821ff79 [0,2,0,0,0,0|0,0,2]=4 1298 B8R0.8 CC(=O)C(=O)NCCBr b951238298d8a5693ac2dc119d2a6125 [0,2,0,0,0,0|1,0,1]=4 1299 B8R0.8 CC(=O)C(=O)NCCF f10a316fe81eca6c402987edef00d0b4 [0,2,0,0,0,0|1,0,1]=4 1300 B8R0.8 CC(=O)C(=O)NCCI 49a7fa58657568758ac0aac23ff45607 [0,2,0,0,0,0|1,0,1]=4 1301 B8R0.8 CC(=O)C(=O)NCCO 68aa5fa37dd1955ac40b92420671c9c7 [0,2,0,0,0,0|1,0,1]=4 1302 B8R0.8 CC(=O)C(=O)NCCS 0e86c38b29bd2555c9be005ee65dd41e [0,2,0,0,0,0|1,0,1]=4 1303 B8R0.8 CC(C)C(=O)CNC#N ef59c2180ae4e0bce40d72d9fbfec0a9 [0,2,0,0,0,0|1,0,1]=4 1304 B8R0.8 CC(C)N(C)CCCF ac962aa1938f95211934be0d36bb25ad [0,2,0,0,0,0|2,0,0]=4 1305 B8R0.8 CC(C)N(C)CCCO e3fdd0b9c377308db32c72e64584dc65 [0,2,0,0,0,0|2,0,0]=4 1306 B8R0.8 CC(C)N(C)CCCS 51225fb71f2f0c7ba47598917825b16c [0,2,0,0,0,0|2,0,0]=4 1307 B8R0.8 CC(F)C(=O)NCCI 8a0369cfed1018ee828f00a2e04759cb [0,2,0,0,0,0|1,0,0]=3 1308 B8R0.8 CC(F)C(=O)NCCO 5714b08de3ce4f90a90b82e533206732 [0,2,0,0,0,0|1,0,0]=3 1309 B8R0.8 CC(F)C(=O)NCCS b39d80e8f07ef9221c0aa27f4f78917f [0,2,0,0,0,0|1,0,0]=3 1310 B8R0.8 CC(O)C(=O)NCCF 91832489eb3405f9b8e768fbbfba918a [0,2,0,0,0,0|1,0,0]=3 1311 B8R0.8 CC(O)C(=O)NCCI 5facf5561b562fe9df389faa15b577b9 [0,2,0,0,0,0|1,0,0]=3 1312 B8R0.8 CC(O)C(=O)NCCO 6eae43744294511500b3285e9523f49e [0,2,0,0,0,0|1,0,0]=3 1313 B8R0.8 CC(O)C(=O)NCCS e3260ab4fe247ca165e429cfa29782cf [0,2,0,0,0,0|1,0,0]=3 1314 B8R0.8 CC(S)C(=O)NCCBr 126071a5e51b1b4d749efb8373eb23f1 [0,2,0,0,0,0|1,0,0]=3 1315 B8R0.8 CC(S)C(=O)NCCF bd1e9d5683d56052e1e5cebd3f28f61a [0,2,0,0,0,0|1,0,0]=3 1316 B8R0.8 CC(S)C(=O)NCCI d038059eeddb4ba2e800fd8c5ef18be5 [0,2,0,0,0,0|1,0,0]=3 1317 B8R0.8 CC(S)C(=O)NCCO 3004d33b884c289d9839660aa24797db [0,2,0,0,0,0|1,0,0]=3 1318 B8R0.8 CC(S)C(=O)NCCS 94de661ebd08e98861fe24c1031e17a2 [0,2,0,0,0,0|1,0,0]=3 1319 B8R0.8 CCCCN(C)C(C)C 4a3f335e6c2bdd887eef651ff194ba1b [0,2,0,0,0,0|2,0,0]=4 1320 B8R0.8 CCCNC(=O)C(=O)C 6616f52ba2db0bc51edea61ef0a86e36 [0,2,0,0,0,0|0,0,1]=3 1321 B8R0.8 CCCNC(=O)C(=O)N 13b9d7246a4f43d25f7b6094605e09c1 [0,2,0,0,0,0|1,0,1]=4 1322 B8R0.8 CCCNC(=O)C(C)F 26c3e292e8bf81a2774c215b87fe205c [0,2,0,0,0,0|0,0,0]=2 1323 B8R0.8 CCCNC(=O)C(C)O 1c4275cc840c120b08a43a51d620d9a2 [0,2,0,0,0,0|0,0,0]=2 1324 B8R0.8 CCCNC(=O)C(C)S 14ef60dcd7bf53e38f1b48b3ac0916eb [0,2,0,0,0,0|0,0,0]=2 1325 B8R0.8 CCCNC(=O)C(F)F 071dc3f73dcbda1779f15b4fb1ae3271 [0,2,0,0,0,0|1,0,0]=3 1326 B8R0.8 CCCNC(=O)C(O)O 1935daac569a1d73c1bfec746173b734 [0,2,0,0,0,0|1,0,0]=3 1327 B8R0.8 CCCNC(=O)[C@@H](C)F 56745f27d02daa9bdc007207f8e02ad7 [0,2,0,0,0,0|0,0,0]=2 1328 B8R0.8 CCCNC(=O)[C@@H](C)O dd45fdcbcb7fa52143ea0a380ce96207 [0,2,0,0,0,0|0,0,0]=2 1329 B8R0.8 CCCNC(=O)[C@H](C)F a5efcba7d8423bf0c2ba50ff959f1165 [0,2,0,0,0,0|0,0,0]=2 1330 B8R0.8 CCCNC(=O)[C@H](C)O b394796d74a22374522cf1e72768ff60 [0,2,0,0,0,0|0,0,0]=2 1331 B8R0.8 CCCNC(C)C(C)C 83fa3f7bca0f40e346b81c4ebe9a6195 [0,2,0,0,0,0|1,0,1]=4 1332 B8R0.8 CCCNC(C)C(C)O d6d39af3e50c17151ef5fe5638b0cdf5 [0,2,0,0,0,0|1,0,1]=4 1333 B8R0.8 CCCN[C@@H](C)C(C)C 5a80b176866eb6d633457f0bc9e03270 [0,2,0,0,0,0|1,0,1]=4 1334 B8R0.8 CCCN[C@H](C)C(C)C 51af879c22cb35c22f0cd191096adc82 [0,2,0,0,0,0|1,0,1]=4 1335 B8R0.8 CCCOC(C)C(C)C 86f84b43e39046a302b7ae55be48399d [0,2,0,0,0,0|1,0,1]=4 1336 B8R0.8 CCCOC(C)C(C)S 2259d80f2d369dc01415bcec83767bc2 [0,2,0,0,0,0|1,0,1]=4 1337 B8R0.8 CCCO[C@@H](C)C(C)C 2f41c5c2bb860ee77833a11f23aa4350 [0,2,0,0,0,0|1,0,1]=4 1338 B8R0.8 CCCO[C@H](C)C(C)C 90a86ce0fea165a8278a7b9623fa00c4 [0,2,0,0,0,0|1,0,1]=4 1339 B8R0.8 CCNCC(=O)N(C)C cbb9e14980a25920980b7a9bd2e1ff0d [0,2,0,0,0,0|1,0,0]=3 1340 B8R0.8 CCNCC(O)C(C)C f8af42d48f65ab067207d55022c8343a [0,2,0,0,0,0|0,0,2]=4 1341 B8R0.8 CCOCC(=O)N(C)C d0c210c00ef540f269d37621e03eeac7 [0,2,0,0,0,0|1,0,0]=3 1342 B8R0.8 CCOCC(C)C(C)C cc9eb3a68371ce091c3a8ee0b2e15210 [0,2,0,0,0,0|1,0,1]=4 1343 B8R0.8 CN(C)C(=O)CNCF 995a01d774effc285f46d6754b581835 [0,2,0,0,0,0|2,0,0]=4 1344 B8R0.8 CN(C)C(=O)CNCO 96d5a62ee0387bff5870c231652b10bc [0,2,0,0,0,0|2,0,0]=4 1345 B8R0.8 CN(C)C(=O)COCF 2eb473ab3b971690a1d108e40a5614a8 [0,2,0,0,0,0|2,0,0]=4 1346 B8R0.8 COCCN(C)C(C)C 0679adae730b00ff4d5c9af3a927053f [0,2,0,0,0,0|2,0,0]=4 1347 B8R0.8 CSCCN(C)C(C)C 8ad12d4699cfc51ee74e0cbfb73cd06c [0,2,0,0,0,0|2,0,0]=4 1348 B8R0.8 C[C@@H](F)C(=O)NCCI 3800b05361fad7ddfa1629fce9d20fa0 [0,2,0,0,0,0|1,0,0]=3 1349 B8R0.8 C[C@@H](F)C(=O)NCCO d7174fc5c801463ae00a56232eff941a [0,2,0,0,0,0|1,0,0]=3 1350 B8R0.8 C[C@@H](F)C(=O)NCCS 749fd7706d0ec6e0daade6c7e1cd3708 [0,2,0,0,0,0|1,0,0]=3 1351 B8R0.8 C[C@@H](O)C(=O)NCCF a16414928601b2d6fce8684097146547 [0,2,0,0,0,0|1,0,0]=3 1352 B8R0.8 C[C@@H](O)C(=O)NCCI 12bd14996ece1fc55d11b04df696dca9 [0,2,0,0,0,0|1,0,0]=3 1353 B8R0.8 C[C@@H](O)C(=O)NCCO 35de042b0d140c54bda91feb1cdb127d [0,2,0,0,0,0|1,0,0]=3 1354 B8R0.8 C[C@@H](O)C(=O)NCCS 4ea55b84babe82864696fb723221b8ee [0,2,0,0,0,0|1,0,0]=3 1355 B8R0.8 C[C@H](F)C(=O)NCCI 5f656c51ae2dfaf00b4ef9a34c71ecd6 [0,2,0,0,0,0|1,0,0]=3 1356 B8R0.8 C[C@H](F)C(=O)NCCO 3757477e5dbeaeb7bd7368631f26cff2 [0,2,0,0,0,0|1,0,0]=3 1357 B8R0.8 C[C@H](F)C(=O)NCCS 768c95e6a0f1ac131a654b3bd54857ca [0,2,0,0,0,0|1,0,0]=3 1358 B8R0.8 C[C@H](O)C(=O)NCCF 9cb153874861efa121a2a3efd64f7b30 [0,2,0,0,0,0|1,0,0]=3 1359 B8R0.8 C[C@H](O)C(=O)NCCI fb8bee75ecdef23926c8dd96e5a8446c [0,2,0,0,0,0|1,0,0]=3 1360 B8R0.8 C[C@H](O)C(=O)NCCO a8a620bab8ff63cc8d6c82762d26d446 [0,2,0,0,0,0|1,0,0]=3 1361 B8R0.8 C[C@H](O)C(=O)NCCS 473cfe5bd499406c2c4ec28ce5acf099 [0,2,0,0,0,0|1,0,0]=3 1362 B8R0.8 O=C(NCCBr)C(F)F ff9f837f83676e6e519206328d3862d1 [0,2,0,0,0,0|2,0,0]=4 1363 B8R0.8 O=C(NCCBr)C(O)O 73e8ae7fdf2a88b7b30084be9bc85132 [0,2,0,0,0,0|2,0,0]=4 1364 B8R0.8 O=C(NCCF)C(F)F e1dcbc3162ad69d1b3fe1f582125b4e9 [0,2,0,0,0,0|2,0,0]=4 1365 B8R0.8 O=C(NCCF)C(O)O 89e071c32fd10ed34517a44e130ca45c [0,2,0,0,0,0|2,0,0]=4 1366 B8R0.8 O=C(NCCI)C(F)F c160d9ba6976df8ea765f151f4eadc2e [0,2,0,0,0,0|2,0,0]=4 1367 B8R0.8 O=C(NCCI)C(O)O fc84fbc71836adb80db7b674e8b28a10 [0,2,0,0,0,0|2,0,0]=4 1368 B8R0.8 O=C(NCCO)C(F)F 92d20ef55af2732384d70ce223367ad5 [0,2,0,0,0,0|2,0,0]=4 1369 B8R0.8 O=C(NCCO)C(O)O 98affbb0c0ffe6bee8332b346954c773 [0,2,0,0,0,0|2,0,0]=4 1370 B8R0.8 O=C(NCCS)C(F)F 132bc5b3ebf4157b66fd24b615b8dc0c [0,2,0,0,0,0|2,0,0]=4 1371 B8R0.8 O=C(NCCS)C(O)O 4438ec682b3eb2e23847b4b4cbb5ce72 [0,2,0,0,0,0|2,0,0]=4 1372 B8R0.9 C#CC(=O)NCC(C)C 1b59405d1466ebf3ed688b4fa128ca83 [0,2,0,0,0,0|0,0,2]=4 1373 B8R0.9 C#CC(=O)NCC(C)O d06b1fbbe3bccdb17bbcfe3d455fa3bd [0,2,0,0,0,0|0,0,2]=4 1374 B8R0.9 C#CC(=O)NC[C@@H](C)O 10b3294b5638bea9282cda41b0b922a3 [0,2,0,0,0,0|0,0,2]=4 1375 B8R0.9 C#CC(=O)NC[C@H](C)O 8c9f626c9458795b5c2c126773a4669e [0,2,0,0,0,0|0,0,2]=4 1376 B8R0.9 C=C(Br)CNC(=O)CC c87421a176840d2907d7ee2f29f8c8b6 [0,2,0,0,0,0|0,0,2]=4 1377 B8R0.9 C=C(C)CCN(C)CC 975bc598c990d4455049b666e0eec143 [0,2,0,0,0,0|2,0,0]=4 1378 B8R0.9 C=C(C)CNC(=O)CC 32c4b91879f81cdaadb4286b48c67a5d [0,2,0,0,0,0|0,0,1]=3 1379 B8R0.9 C=C(C)CNC(=O)CF 9e174f36563c098f37022cb2648c32e5 [0,2,0,0,0,0|1,0,1]=4 1380 B8R0.9 C=C(C)CNC(=O)CO ea98526bca8d7363ad41fae75f4ac9a5 [0,2,0,0,0,0|1,0,1]=4 1381 B8R0.9 C=C(C)CNC(=O)CS 497b396057e3c61f5cc6dfafc46145da [0,2,0,0,0,0|1,0,1]=4 1382 B8R0.9 C=C(CC)COC(C)C 158b3c8f8440057d90f95fd6ad44dfdf [0,2,0,0,0,0|1,0,0]=3 1383 B8R0.9 C=C(COC(C)C)OC 96f850636a0fcded9cc7f40aac2f05a4 [0,2,0,0,0,0|2,0,0]=4 1384 B8R0.9 C=CC(=O)NCC(C)C 9fff6936d747446fa6c6ac1bd8338bdd [0,2,0,0,0,0|0,0,2]=4 1385 B8R0.9 C=CC(=O)NCC(C)O fa01455d59425b08f532ebd991dbb1af [0,2,0,0,0,0|0,0,2]=4 1386 B8R0.9 C=CC(=O)NC[C@@H](C)O 60f11a39a2f100903af1f56f3c922ad0 [0,2,0,0,0,0|0,0,2]=4 1387 B8R0.9 C=CC(=O)NC[C@H](C)O c21baab8154cbdc7ba440bfa062d6fdc [0,2,0,0,0,0|0,0,2]=4 1388 B8R0.9 CC(=O)CNC(=O)CF 51fe56aa9d240d573ecbdb68032eba65 [0,2,0,0,0,0|1,0,1]=4 1389 B8R0.9 CC(=O)CNC(=O)CO d375a24b35361625580ca34c6266f702 [0,2,0,0,0,0|1,0,1]=4 1390 B8R0.9 CC(=O)CNC(=O)CS 5d679f8f3bae9d6c5d53fb6156c809ab [0,2,0,0,0,0|1,0,1]=4 1391 B8R0.9 CC(C)CNC(=O)C=O b40cc57029845c8997b7aa8efc245b60 [0,2,0,0,0,0|1,0,1]=4 1392 B8R0.9 CC(C)CNC(=O)CF 9eb01591588fc3f21824d07c6994c4ce [0,2,0,0,0,0|1,0,0]=3 1393 B8R0.9 CC(C)CNC(=O)CO 748dd4a1556e9d036080c13c38338fdb [0,2,0,0,0,0|1,0,0]=3 1394 B8R0.9 CC(C)CNC(=O)CS 24a37322ef0bc9a4c645dfd16fd4ed0f [0,2,0,0,0,0|1,0,0]=3 1395 B8R0.9 CC(C)NCC(=O)NO d714842a0c42249cabffc4dfd5ab50bd [0,2,0,0,0,0|2,0,0]=4 1396 B8R0.9 CC(O)CNC(=O)C=O a19c80ebbd3c5b0340f36c5c68b9e508 [0,2,0,0,0,0|1,0,1]=4 1397 B8R0.9 CC(O)CNC(=O)CF d59c5e79c77aa7d822e3ecb11dcaef82 [0,2,0,0,0,0|1,0,0]=3 1398 B8R0.9 CC(O)CNC(=O)CO 9be864f31d0f9194e8eb36240c465097 [0,2,0,0,0,0|1,0,0]=3 1399 B8R0.9 CC(O)CNC(=O)CS dbff926c910e39aef95fc4a90e7f24a8 [0,2,0,0,0,0|1,0,0]=3 1400 B8R0.9 CCC(=O)COC(C)C 5c8d297b0416149f24332452b8f0f1e3 [0,2,0,0,0,0|0,0,0]=2 1401 B8R0.9 CCC(=O)NCC(=O)C 5911502c3a8395822fc4c0959647e135 [0,2,0,0,0,0|0,0,1]=3 1402 B8R0.9 CCC(=O)NCC(=O)N 07cfd3edf39ace2eb27c9b7f36ff92b5 [0,2,0,0,0,0|1,0,1]=4 1403 B8R0.9 CCC(=O)NCC(C)C 80d4e4c057e6f7b9eae8a2bfacaea014 [0,2,0,0,0,0|0,0,0]=2 1404 B8R0.9 CCC(=O)NCC(C)O a0cefa62fd20423cdc1bf66278a42129 [0,2,0,0,0,0|0,0,0]=2 1405 B8R0.9 CCC(=O)NCC(F)F 4cc4f3b720e259ef94d2e9ddeae5379b [0,2,0,0,0,0|1,0,0]=3 1406 B8R0.9 CCC(=O)NC[C@@H](C)O a391cc3778995f10350211a29d249a09 [0,2,0,0,0,0|0,0,0]=2 1407 B8R0.9 CCC(=O)NC[C@H](C)O 700448fc71267e87914b635955ddeec8 [0,2,0,0,0,0|0,0,0]=2 1408 B8R0.9 CCC(C)CNC(C)C 9b22fec9421f72c4c7069f08eeceb961 [0,2,0,0,0,0|1,0,1]=4 1409 B8R0.9 CCC(C)COC(C)C 89140aa94488bac2672b51951396900c [0,2,0,0,0,0|1,0,1]=4 1410 B8R0.9 CCC(C)NCC(C)C 0af4d6f3dad4a1fd6ba7feec2c98edc9 [0,2,0,0,0,0|1,0,1]=4 1411 B8R0.9 CCC(C)NCC(C)O 04be39588a5f09c70c74f1ca60cd63ac [0,2,0,0,0,0|1,0,1]=4 1412 B8R0.9 CCC(C)NC[C@@H](C)O 6e798d5c3d31a8f8773bcdb1d14bb58f [0,2,0,0,0,0|1,0,1]=4 1413 B8R0.9 CCC(C)NC[C@H](C)O b6ed82170374565ef8a62802ade9580c [0,2,0,0,0,0|1,0,1]=4 1414 B8R0.9 CCC(C)OCC(C)C 94adce536ef43774d73b8b91df56b54a [0,2,0,0,0,0|1,0,1]=4 1415 B8R0.9 CCC(C)OCC(C)F 86be792ac47322b60f5884dee7e7f674 [0,2,0,0,0,0|1,0,1]=4 1416 B8R0.9 CCC(C)OCC(C)S 5ab58589f526e3be72d839617a185ef8 [0,2,0,0,0,0|1,0,1]=4 1417 B8R0.9 CCC(C)OC[C@@H](C)F 500b158e44a340e901d363fe297442a0 [0,2,0,0,0,0|1,0,1]=4 1418 B8R0.9 CCC(C)OC[C@H](C)F dabe59364c55cabe8959691cbb4cbce5 [0,2,0,0,0,0|1,0,1]=4 1419 B8R0.9 CCC(O)CNC(C)C 71d0e78d5d3d6ddfb7afb7fb5ab010cd [0,2,0,0,0,0|0,0,2]=4 1420 B8R0.9 CCN(C)CCC(=O)C 704b8017c1fe42d466a2c16771fe60b9 [0,2,0,0,0,0|2,0,0]=4 1421 B8R0.9 CCN(C)CCC(C)C cccf47d146781af2a5619f47aba63cf9 [0,2,0,0,0,0|2,0,0]=4 1422 B8R0.9 CCN(C)CCC(C)O 4308bf1a991d7ca66cadc45942e7cdad [0,2,0,0,0,0|2,0,0]=4 1423 B8R0.9 CCN(C)CCC(F)F 1180b48c06e38786510f153c8f242071 [0,2,0,0,0,0|2,0,0]=4 1424 B8R0.9 CCN(C)CCN(C)C b473aa09615eac94019e89a56cdbc6a6 [0,2,0,0,0,0|2,0,0]=4 1425 B8R0.9 CCN(C)CCS(=O)C 181957332795259e7c2d453ef9f3db35 [0,2,0,0,0,0|2,0,0]=4 1426 B8R0.9 CCN(C)COC(C)C c76477936d8325c56039131b6365e961 [0,2,0,0,0,0|2,0,0]=4 1427 B8R0.9 CC[C@@H](C)COC(C)C dc0c1657b56896a2f1684dba0e5f4146 [0,2,0,0,0,0|1,0,1]=4 1428 B8R0.9 CC[C@@H](C)NCC(C)C a85721f9bf2f20f81d144de1a37e6fff [0,2,0,0,0,0|1,0,1]=4 1429 B8R0.9 CC[C@@H](C)NCC(C)O 2677141b66bad4e2c96cd57b714806ea [0,2,0,0,0,0|1,0,1]=4 1430 B8R0.9 CC[C@@H](C)NC[C@@H](C)O 259bc8325537e1de1a944df75fdf21f1 [0,2,0,0,0,0|1,0,1]=4 1431 B8R0.9 CC[C@@H](C)NC[C@H](C)O 939311d357bc0680fabba2ce4e70d859 [0,2,0,0,0,0|1,0,1]=4 1432 B8R0.9 CC[C@@H](C)OCC(C)C 555334e47789bc366cc5b9b7c24f502e [0,2,0,0,0,0|1,0,1]=4 1433 B8R0.9 CC[C@@H](O)CNC(C)C 0b13dd23b5427cc29a52929b73be7d43 [0,2,0,0,0,0|0,0,2]=4 1434 B8R0.9 CC[C@H](C)CNC(C)C 51bac89f8a94c583d3620c5691a65724 [0,2,0,0,0,0|1,0,1]=4 1435 B8R0.9 CC[C@H](C)COC(C)C 4c1bf27a91b2a1be4e163836e33843e7 [0,2,0,0,0,0|1,0,1]=4 1436 B8R0.9 CC[C@H](C)NCC(C)C 3e34629dbba78b6d192ded3bac89ba6f [0,2,0,0,0,0|1,0,1]=4 1437 B8R0.9 CC[C@H](C)NCC(C)O 99099c99fd14ec2545d713f92de4a778 [0,2,0,0,0,0|1,0,1]=4 1438 B8R0.9 CC[C@H](C)NC[C@@H](C)O 12a96eae09dd452a73c94b544346a630 [0,2,0,0,0,0|1,0,1]=4 1439 B8R0.9 CC[C@H](C)NC[C@H](C)O 4c33e4d27654f70efbcc25d8010eeae9 [0,2,0,0,0,0|1,0,1]=4 1440 B8R0.9 CC[C@H](C)OCC(C)C 5cf0f20f2e3b8b673a5127012ceee597 [0,2,0,0,0,0|1,0,1]=4 1441 B8R0.9 CNC(=O)CNC(=O)C c907d9576897cc728ca9c254cf3b05e9 [0,2,0,0,0,0|1,0,1]=4 1442 B8R0.9 CNC(=O)CNC(C)C 566e2c52ea2eed119c48dda13ee7cd22 [0,2,0,0,0,0|1,0,0]=3 1443 B8R0.9 CNC(=O)COC(C)C ac98fb8d262335081328b24dd3b587d1 [0,2,0,0,0,0|1,0,0]=3 1444 B8R0.9 COC(=O)CNC(=O)C b0f97d8003dd4b6278e13b9959e4a2e1 [0,2,0,0,0,0|1,0,1]=4 1445 B8R0.9 COC(=O)CNC(C)C c3733748a55be9c482138184ed5baa45 [0,2,0,0,0,0|1,0,0]=3 1446 B8R0.9 COC(=O)COC(C)C 532fce5a880346bf56d52549b85157a8 [0,2,0,0,0,0|1,0,0]=3 1447 B8R0.9 C[C@@H](O)CNC(=O)C=O 2603ee2d0f069eae7661384f7ee697eb [0,2,0,0,0,0|1,0,1]=4 1448 B8R0.9 C[C@@H](O)CNC(=O)CF 6a61f49e9c0d24ab6d4f46deb1461e7d [0,2,0,0,0,0|1,0,0]=3 1449 B8R0.9 C[C@@H](O)CNC(=O)CO 9634e7d0b81aeff4d0ebcb0b1d05ff89 [0,2,0,0,0,0|1,0,0]=3 1450 B8R0.9 C[C@@H](O)CNC(=O)CS 74f2114c184fa00cea5ec42867e295a6 [0,2,0,0,0,0|1,0,0]=3 1451 B8R0.9 C[C@H](O)CNC(=O)C=O 93688556993d21a2fc23a4f3acf54052 [0,2,0,0,0,0|1,0,1]=4 1452 B8R0.9 C[C@H](O)CNC(=O)CF de054442a5e1e940c151636e21f7cde2 [0,2,0,0,0,0|1,0,0]=3 1453 B8R0.9 C[C@H](O)CNC(=O)CO a9cb6b1498a706bccaa6d180a5a461c7 [0,2,0,0,0,0|1,0,0]=3 1454 B8R0.9 C[C@H](O)CNC(=O)CS a2cc47a92507f6d2ddfbe5205109d70d [0,2,0,0,0,0|1,0,0]=3 1455 B8R0.9 O=C(CF)NCC(F)F 6df71b4d47ba0ff822850b62dc2b163e [0,2,0,0,0,0|2,0,0]=4 1456 B8R0.9 O=C(CO)NCC(F)F 7faddb9a1bd570be447e69247bbc7e41 [0,2,0,0,0,0|2,0,0]=4 1457 B8R0.9 O=C(CS)NCC(F)F 555b08482ad3b066c244e7c150a80270 [0,2,0,0,0,0|2,0,0]=4 1458 B8R0.11 C#CC(CC)OCCC ab15fd59c98d539d7d07649312c6ebc3 [0,2,0,0,0,0|1,0,1]=4 1459 B8R0.11 C=CC(CC)OCCC 105fea4587e7e9d452a89f90aa2748e8 [0,2,0,0,0,0|1,0,1]=4 1460 B8R0.11 CCC(C=O)NCCBr b2bce0ce1b9ab602a40f18f0015518c7 [0,2,0,0,0,0|1,0,1]=4 1461 B8R0.11 CCC(C=O)NCCF 38437253c46eaa94c039d42d662294ca [0,2,0,0,0,0|1,0,1]=4 1462 B8R0.11 CCC(C=O)NCCI b275adc10c65353a9f2e2d29c810ac5c [0,2,0,0,0,0|1,0,1]=4 1463 B8R0.11 CCC(C=O)NCCO 0ef6baa986478af3845ad64b43273775 [0,2,0,0,0,0|1,0,1]=4 1464 B8R0.11 CCC(C=O)NCCS 659251275749d198cbef7b75a8f4d945 [0,2,0,0,0,0|1,0,1]=4 1465 B8R0.11 CCC(C=O)OCCF 6589c03588b79ef923770a2e5281e8cd [0,2,0,0,0,0|1,0,1]=4 1466 B8R0.11 CCC(C=O)OCCS ea764c2bc2338bce8bffce9cca976a1a [0,2,0,0,0,0|1,0,1]=4 1467 B8R0.11 CCC(C=O)OCOC fda93f4e64fa70de9b1ea0e38d5ee013 [0,2,0,0,0,0|1,0,1]=4 1468 B8R0.11 CCCCN(C=O)CC cdc74e35a30bfd5fd030759b798d1154 [0,2,0,0,0,0|1,0,0]=3 1469 B8R0.11 CCCCN(CC)CC 799082ccac5d401a30542c693df9a037 [0,2,0,0,0,0|2,0,0]=4 1470 B8R0.11 CCCCN(CC)CF 191f83d5d3d3672b3280b00206bb418d [0,2,0,0,0,0|2,0,0]=4 1471 B8R0.11 CCCCN(CC)CO 357cfc04e742bfe2a111c827fc08c91d [0,2,0,0,0,0|1,0,1]=4 1472 B8R0.11 CCCNC(C=O)CC 8b5e0e2daf5f0f35115de8e725402fa5 [0,2,0,0,0,0|0,0,1]=3 1473 B8R0.11 CCCNC(CC)CC 9be5d4abc1b4d0703a44bd9539e556bb [0,2,0,0,0,0|1,0,1]=4 1474 B8R0.11 CCCNC(CC)CO 18fc997e699e711c2231a1e18c184815 [0,2,0,0,0,0|0,0,2]=4 1475 B8R0.11 CCCN[C@@H](CC)CO f14436f2737b9dbc3051d6d9b364b94f [0,2,0,0,0,0|0,0,2]=4 1476 B8R0.11 CCCN[C@H](CC)CO 81a649534946bc6ce248c71efca3ef7e [0,2,0,0,0,0|0,0,2]=4 1477 B8R0.11 CCCOC(C#N)CC 481f0b269a40a36b271d480e84368d21 [0,2,0,0,0,0|1,0,1]=4 1478 B8R0.11 CCCOC(C=O)CC 5c5bd3caba387b7aed9948606b55ead9 [0,2,0,0,0,0|0,0,1]=3 1479 B8R0.11 CCCOC(CC)CC 148ca867dd0504225a42b1f7b68138cf [0,2,0,0,0,0|1,0,1]=4 1480 B8R0.11 CCN(C=O)CCC#N dcf0169ebeb3abd59e6492b9aebf58af [0,2,0,0,0,0|1,0,1]=4 1481 B8R0.11 CCN(C=O)CCCO 1400c17018da6a8c616cf48985189e21 [0,2,0,0,0,0|1,0,0]=3 1482 B8R0.11 CCN(C=O)CCOC 57d3ddcf433d03a3e450ecf7301ce02d [0,2,0,0,0,0|1,0,0]=3 1483 B8R0.11 CCN(CC)CCCO 42a98906d6288c2f3b8e1f496b44c79c [0,2,0,0,0,0|2,0,0]=4 1484 B8R0.11 CCN(CC)CCOC ae4008bf0407ab1f05d88905baf7b1ed [0,2,0,0,0,0|2,0,0]=4 1485 B8R0.11 CCN(CF)CCCO c21bda18136a85af5aca8b69c4fd8697 [0,2,0,0,0,0|2,0,0]=4 1486 B8R0.11 CCN(CF)CCOC 3b8af6fdb1fc6a09fa4664545f76d14d [0,2,0,0,0,0|2,0,0]=4 1487 B8R0.11 CCN(CO)CCCO d64066af2c2ce0c75da14a6fbb0a40e0 [0,2,0,0,0,0|1,0,1]=4 1488 B8R0.11 CCN(CO)CCOC 21368dea798e2d58da0fd51deda6c863 [0,2,0,0,0,0|1,0,1]=4 1489 B8R0.11 CCNCC(CC)CC 7ee65109c8a4fd66c56190cfa2902964 [0,2,0,0,0,0|1,0,1]=4 1490 B8R0.11 CCNCC(CC)CO af6af2e10d8202238ef5944a294c025c [0,2,0,0,0,0|0,0,2]=4 1491 B8R0.11 CCOCC(CC)CC 83daf4230606b22b742ade2847e6710e [0,2,0,0,0,0|1,0,1]=4 1492 B8R0.11 CCOCC(CC)OC 77f87423c25a9b6cc7e7d85adf6c40fb [0,2,0,0,0,0|0,0,2]=4 1493 B8R0.11 CCOCN(CC)CC ab9602442f23061068d423f412d505c7 [0,2,0,0,0,0|2,0,0]=4 1494 B8R0.25 CCCNC(C)(C)CC a05a333718f9a19d6720e7defdfcbf9d [0,2,0,0,0,0|1,0,1]=4 1495 B8R0.25 CCNCC(C)(C)CC 39ca8cf4f83df1b994d28985cb5193c6 [0,2,0,0,0,0|1,0,1]=4 1496 B8R0.25 CCNCC(C)(O)CC 05a77a31f97cf4dd6fcb6c8791dfcc13 [0,2,0,0,0,0|0,0,2]=4 1497 B8R0.25 CCOCC(F)(F)CC 43bec2dddd24509f8f0c539b2354fc24 [0,2,0,0,0,0|1,0,1]=4 1498 B8R0.14 CCCN(C)C(C)(C)C 66f8ccf8a58bf94e8f0f053cd30c7fbc [0,2,0,0,0,0|2,0,0]=4 1499 B8R0.15 C/C=C(\OCC)/C(=O)O ed3460e0bbe0f0b117145ec3b6c6a2c3 [0,2,0,0,0,0|1,0,1]=4 1500 B8R0.15 CC(C)N(C=O)CCO 1344fe535ad12ab3e47a62841ebe0545 [0,2,0,0,0,0|2,0,0]=4 1501 B8R0.15 CCCN(C=O)C(C)C 9cecb4b84cf566581125ea24b6665c66 [0,2,0,0,0,0|1,0,0]=3 1502 B8R0.15 CCCN(CC)C(=O)C aaa318fb9f18848accdb9fbfd1cf28a8 [0,2,0,0,0,0|1,0,0]=3 1503 B8R0.15 CCCN(CC)C(C)C 1c89cff2caba49a0d6b54ccb28d3894d [0,2,0,0,0,0|2,0,0]=4 1504 B8R0.15 CCCN(CF)C(C)C d6c3e1b08d6e507345090c4a48044c63 [0,2,0,0,0,0|2,0,0]=4 1505 B8R0.15 CCCN(CO)C(C)C 9a6ca5d22a743648e8e0f87c1f823109 [0,2,0,0,0,0|1,0,1]=4 1506 B8R0.15 CCN(CCCl)C(=O)C 10dbbc5db7469d566a3048f4a18456a3 [0,2,0,0,0,0|2,0,0]=4 1507 B8R0.15 CCN(CCO)C(=O)C 7d70110607468d775832ae23e9934092 [0,2,0,0,0,0|2,0,0]=4 1508 B8R0.15 CCNC(CC)C(=O)N 4d4bbfd758d3d1406449d11a7d12f485 [0,2,0,0,0,0|1,0,1]=4 1509 B8R0.15 CCNC(CC)C(=O)O 811bed40f759e9415b190b45b938f031 [0,2,0,0,0,0|1,0,1]=4 1510 B8R0.15 CCN[C@@H](CC)C(=O)N 2ecd0466ce0392cdd810df37e1818d79 [0,2,0,0,0,0|1,0,1]=4 1511 B8R0.15 CCN[C@@H](CC)C(=O)O ad39164e8fc918d5e58308b586171474 [0,2,0,0,0,0|1,0,1]=4 1512 B8R0.15 CCN[C@H](CC)C(=O)O f7f7d1d8bf30d5fe2da91fe96021fe3c [0,2,0,0,0,0|1,0,1]=4 1513 B8R0.15 CCOC(CC)C(=O)N cc881244ff63cfdfd012c91254de1749 [0,2,0,0,0,0|1,0,1]=4 1514 B8R0.15 CCOC(CC)C(=O)O 382aa920ebdd6f2bbe768902640ad9e2 [0,2,0,0,0,0|1,0,1]=4 1515 B8R0.15 CCO[C@@H](CC)C(=O)O 94f5195873e16b29cb1b8369b5daad14 [0,2,0,0,0,0|1,0,1]=4 1516 B8R0.15 CCO[C@H](CC)C(=O)O b8c9ca25086a8c61d2a1f7aecbcec13d [0,2,0,0,0,0|1,0,1]=4 1517 B8R0.22 C#CC(CCC)OCC f22d8bf31fea2adfe9fa207ed6558425 [0,2,0,0,0,0|1,0,1]=4 1518 B8R0.22 C#CCN(CC)CCC 1a04b40b7302ff7cded4ea13f07ce72c [0,2,0,0,0,0|2,0,0]=4 1519 B8R0.22 C=CC(CCC)OCC 83f7ef8d30a51e1e5c4db64e2faf14e7 [0,2,0,0,0,0|1,0,1]=4 1520 B8R0.22 C=CCN(C=O)CCC 8915f0bd4ca3257466688dc7b8e97b40 [0,2,0,0,0,0|1,0,1]=4 1521 B8R0.22 C=CCN(CC)CCC 7aebbfb3f75baa8bbab14ad7e2fc6fe2 [0,2,0,0,0,0|2,0,0]=4 1522 B8R0.22 CCC(COC)NC=O 53905710bc62d6f533f443331f56e2bc [0,2,0,0,0,0|1,0,1]=4 1523 B8R0.22 CCCC(C#N)OCC a338cf0a28ea8309ca076bf548560d98 [0,2,0,0,0,0|1,0,1]=4 1524 B8R0.22 CCCC(CC)NC#N 02d99bdf5a76ac9c852f51329e019127 [0,2,0,0,0,0|1,0,1]=4 1525 B8R0.22 CCCC(CC)OCC 2f33f90cfe6f34bcef6403a269e3e2c2 [0,2,0,0,0,0|0,0,2]=4 1526 B8R0.22 CCCC(CC)OCF ce7c200aebd362fbdb26e3cffa550e7b [0,2,0,0,0,0|0,0,2]=4 1527 B8R0.22 CCCC(CO)NC=O 41f5afc0296d6847bc820d8afc2b5787 [0,2,0,0,0,0|1,0,1]=4 1528 B8R0.22 CCCC(CO)NCC b8c7f0be112f24c01dd7f8415b0a6e3f [0,2,0,0,0,0|0,0,2]=4 1529 B8R0.22 CCCN(C=O)CCC b8d16e0fe5e219991097fa7af52168fc [0,2,0,0,0,0|1,0,0]=3 1530 B8R0.22 CCCN(C=O)CCO 05c7e3c748b410d220017381f77da8d3 [0,2,0,0,0,0|1,0,0]=3 1531 B8R0.22 CCCN(CC)CC#N c29099232086d81ad2f07c596422bfd1 [0,2,0,0,0,0|2,0,0]=4 1532 B8R0.22 CCCN(CC)CC=O 10f91472c4600bbc31b6ae1008baca40 [0,2,0,0,0,0|1,0,0]=3 1533 B8R0.22 CCCN(CC)CCC fbdeabbee1b9c3e90ce0dba0622f60e1 [0,2,0,0,0,0|2,0,0]=4 1534 B8R0.22 CCCN(CC)CCCl e10d54888c8be58f6c48a2109cd3c712 [0,2,0,0,0,0|2,0,0]=4 1535 B8R0.22 CCCN(CC)CCF 2df08daadfb37609698739d31facd805 [0,2,0,0,0,0|2,0,0]=4 1536 B8R0.22 CCCN(CC)CCO e12c7b9084df978bc76507edd9bb317c [0,2,0,0,0,0|1,0,1]=4 1537 B8R0.22 CCCN(CC)CCS d13e9cb0503ea391c9c728c78375cf51 [0,2,0,0,0,0|1,1,0]=4 1538 B8R0.22 CCCN(CC)COC 15ff08b061f9fd92278440622f990e67 [0,2,0,0,0,0|1,0,1]=4 1539 B8R0.22 CCCN(CC)CSC a60d359435bfdd67a351c0f62c52b47e [0,2,0,0,0,0|1,1,0]=4 1540 B8R0.22 CCCN(CF)CCC 13308840e37fb0db9101f8040f290680 [0,2,0,0,0,0|2,0,0]=4 1541 B8R0.22 CCCN(CF)CCO 947883a1ea303d435cd0024eececcb8b [0,2,0,0,0,0|2,0,0]=4 1542 B8R0.22 CCCN(CO)CCC 8895812a51d2f9ffd61abab1a697cc71 [0,2,0,0,0,0|1,0,1]=4 1543 B8R0.22 CCCN(CO)CCO a9884a3b6c19ddd60ead7c1eabb3daee [0,2,0,0,0,0|1,0,1]=4 1544 B8R0.22 CCC[C@@H](CC)OCC b58a52b0075a76b2b518807461776ed4 [0,2,0,0,0,0|0,0,2]=4 1545 B8R0.22 CCC[C@@H](CC)OCF 7aa5f0ec7ab4c268dbb1cc54d34ff94b [0,2,0,0,0,0|0,0,2]=4 1546 B8R0.22 CCC[C@@H](CO)NC=O 3c94a70b3970ecaf12f548b2138bdede [0,2,0,0,0,0|1,0,1]=4 1547 B8R0.22 CCC[C@@H](CO)NCC 56ab3d096c6223ec587ad816d0445356 [0,2,0,0,0,0|0,0,2]=4 1548 B8R0.22 CCC[C@H](CO)NC=O 930af0e5fd8674584b8a8514e2d4657f [0,2,0,0,0,0|1,0,1]=4 1549 B8R0.22 CCC[C@H](CO)NCC 9c47d0227f2e89819e7d2ecbd9f9d4a0 [0,2,0,0,0,0|0,0,2]=4 1550 B8R0.22 CCN(CC=O)CCCl 4ed90969909b022e2ac83da8060f9efc [0,2,0,0,0,0|2,0,0]=4 1551 B8R0.22 CCN(CC=O)CCO 97dbc0347b45240747141aa67b4d0675 [0,2,0,0,0,0|2,0,0]=4 1552 B8R0.22 O=CN(CCCl)CCCl 054ac3afb7fe32e280913aeabd7450cf [0,2,0,0,0,0|2,0,0]=4 1553 B8R0.22 O=CN(CCO)CCO c0fe14cb4fe87b0f51f8507a4f962117 [0,2,0,0,0,0|2,0,0]=4 1554 B8R0.13 CCN(C)C(C)(C)CC cfde114a717d88596eaccdbb8e831ec9 [0,2,0,0,0,0|2,0,0]=4 1555 B8R0.20 CCC(C#N)N(C)CC 036ba5b1dcc7792f571015181196687c [0,2,0,0,0,0|2,0,0]=4 1556 B8R0.20 CCC(C=O)N(C)CC 6cd7fea7d913ebc4dd115f632f3cdadb [0,2,0,0,0,0|1,0,1]=4 1557 B8R0.20 CCC(CC)N(C)CC 30a960df758b7999bb0774dfe5031cc7 [0,2,0,0,0,0|2,0,0]=4 1558 B8R0.20 CCC(CO)N(C)CC 968123e9756e6c80ad15043b5c89d160 [0,2,0,0,0,0|2,0,0]=4 1559 B8R0.20 CCN(C=O)C(C)CO 2b7554c35b7ee11c88f30889764dd701 [0,2,0,0,0,0|2,0,0]=4 1560 B6R1.6 CCN1CCC1 23b7abd822d5f351048cbd744915c161 [1,0,0,1,0,0|1,0,0]=3 1561 B6R1.6 FCN1CCC1 be36fe433e3b5fde99e14f4c177c697e [1,0,0,1,0,0|2,0,0]=4 1562 B6R1.6 OCN1CCC1 f3cac714768fc30717bf6da5686dc581 [1,0,0,1,0,0|2,0,0]=4 1563 B8R1.1 CC1CCN(C1)C=O 802232b85eec3baa7ee60be5f84b67b5 [0,1,0,1,0,0|1,0,0]=3 1564 B8R1.1 CC1CCN(C1)CF da0970cce8482326171d63e42120fe9a [0,1,0,1,0,0|2,0,0]=4 1565 B8R1.1 CC1CCN(C1)CO 35ec454f519cadc0e2b5b2b07f513132 [0,1,0,1,0,0|1,0,1]=4 1566 B8R1.1 CCN1CCC(C1)C c5b0c6261615cc6c7323d9c48f305770 [0,1,0,1,0,0|1,0,1]=4 1567 B8R1.1 CCN1CCC(C1)F 8d301cd853ecef6fb4279b0612590591 [0,1,0,1,0,0|1,0,1]=4 1568 B8R1.1 CCN1CCC(C1)O 1fbe07547593a6faa177084d503fc6f1 [0,1,0,1,0,0|0,0,2]=4 1569 B8R1.1 CCN1CCN(C1)C aae264a06453d9ff404065937fbf2180 [0,1,0,1,0,0|2,0,0]=4 1570 B8R1.1 CCN1CC[C@@H](C1)F 45d2c8580b418f04d6df20f8ae6a7937 [0,1,0,1,0,0|1,0,1]=4 1571 B8R1.1 CCN1CC[C@@H](C1)O 70cbbe96f459a233588b5761b6688faa [0,1,0,1,0,0|0,0,2]=4 1572 B8R1.1 CCN1CC[C@H](C1)F 4c21ca896f7eba6f6ebed5cb028fb6fe [0,1,0,1,0,0|1,0,1]=4 1573 B8R1.1 CCN1CC[C@H](C1)O 8caeefff584b981372b55b1e6e9f82dc [0,1,0,1,0,0|0,0,2]=4 1574 B8R1.1 CCN1CNC(=O)C1 58009d6dfded7497e427ac45a5ff5413 [0,1,0,1,0,0|1,0,0]=3 1575 B8R1.1 CN1CCN(C1)C=O 8b7db25ff5974733ece4d3fc3a4817d7 [0,1,0,1,0,0|2,0,0]=4 1576 B8R1.1 O=C1CN(CN1)CF f13f56dc757cd85272f424d9ac53fbce [0,1,0,1,0,0|2,0,0]=4 1577 B8R1.1 O=C1CN(CN1)CO e561a9f6a1ffe109b2b8eed70763223f [0,1,0,1,0,0|2,0,0]=4 1578 B8R1.1 O=CN1CCC(C1)F 96284cdc191c7cba11f6a402b8eb117c [0,1,0,1,0,0|2,0,0]=4 1579 B8R1.1 O=CN1CCC(C1)O 36bb47eb3389f04fbd153dabfa4995ad [0,1,0,1,0,0|2,0,0]=4 1580 B8R1.1 O=CN1CC[C@@H](C1)F 008cec7e125285aba69bdec89e8d8fbf [0,1,0,1,0,0|2,0,0]=4 1581 B8R1.1 O=CN1CC[C@@H](C1)O 75171cfcb992bb0c611e45c07ca0c61c [0,1,0,1,0,0|2,0,0]=4 1582 B8R1.1 O=CN1CC[C@H](C1)F 27a4a903f78fd10dcf90e00458f77a70 [0,1,0,1,0,0|2,0,0]=4 1583 B8R1.1 O=CN1CC[C@H](C1)O 4d35040bdf5a1607b14717edf31c1dc0 [0,1,0,1,0,0|2,0,0]=4 1584 B8R1.34 CC(C)CN1CCC1 5cd648faa02f9a3a3e7088ca07d904cb [0,1,0,1,0,0|2,0,0]=4 1585 B8R1.34 CC(O)CN1CCC1 c968b76b6db8bde6dbcca9aa6b0299d6 [0,1,0,1,0,0|2,0,0]=4 1586 B8R1.34 C[C@@H](O)CN1CCC1 b5f2cf9878abeb4a8a834874c79174e7 [0,1,0,1,0,0|2,0,0]=4 1587 B8R1.34 C[C@H](O)CN1CCC1 199f11a3ece69c3aaaa8b0f1f376d79b [0,1,0,1,0,0|2,0,0]=4 1588 B8R1.40 C#CC(=O)NC1CC1 da5e3817a968937fe8ebc526d822a2bb [0,1,0,1,0,0|0,0,2]=4 1589 B8R1.40 C=CC(=O)NC1CC1 ae1867ae5f1dd1acb685caa201da262d [0,1,0,1,0,0|0,0,2]=4 1590 B8R1.40 CCC(=O)NC1CC1 bc1edd04b4e58cbfa3a5f5c726ebfe6b [0,1,0,1,0,0|0,0,0]=2 1591 B8R1.40 CCC(C)NC1CC1 94875b9551eba0e9bd26195acf68922b [0,1,0,1,0,0|1,0,1]=4 1592 B8R1.40 CCC(C)OC1CC1 68ed2fdfe0b177445d70e3d5225b65a4 [0,1,0,1,0,0|1,0,1]=4 1593 B8R1.40 CCN(C)CC1CC1 54cb31e95fbf3de98bdb1be424bfef82 [0,1,0,1,0,0|2,0,0]=4 1594 B8R1.40 CC[C@@H](C)NC1CC1 410d7c870d4447260edc03bb5a83de89 [0,1,0,1,0,0|1,0,1]=4 1595 B8R1.40 CC[C@@H](C)OC1CC1 c589c35c96af6e1ebe99b6ae61ff931b [0,1,0,1,0,0|1,0,1]=4 1596 B8R1.40 CC[C@H](C)NC1CC1 ebb7f6954df91dc6276951b58ca4e4c7 [0,1,0,1,0,0|1,0,1]=4 1597 B8R1.40 CC[C@H](C)OC1CC1 382e57974f1b3878c3e0abed45ea3f80 [0,1,0,1,0,0|1,0,1]=4 1598 B8R1.40 O=C(CF)NC1CC1 9ccf83dad7006c7283aead2cfdfd9cfa [0,1,0,1,0,0|1,0,0]=3 1599 B8R1.40 O=C(CO)NC1CC1 bb096758b55cfb0505bd2d10961bc923 [0,1,0,1,0,0|1,0,0]=3 1600 B8R1.40 O=C(CS)NC1CC1 47ed3dec057db245af795d634c1f00f4 [0,1,0,1,0,0|1,0,0]=3 1601 B8R1.40 O=CC(=O)NC1CC1 288abfcb7bdb635fa8f12884916c723b [0,1,0,1,0,0|1,0,1]=4 1602 B8R1.53 CCN1CC(C1)(C)C 769cc4143e2b2ac2202c3fe193b14ac3 [0,1,0,1,0,0|2,0,0]=4 1603 B8R1.53 CCN1CC(C1)(C)O 61cbf2748eb0f902c8f332d7ca75d4ca [0,1,0,1,0,0|2,0,0]=4 1604 B8R1.2 CCN1CCCOC1 53af203468797a49275022682d8f1a11 [0,1,0,1,0,0|1,0,1]=4 1605 B8R1.2 CCN1CCCSC1 94ac8411443cb0a4aa7db7b3767bc109 [0,1,0,1,0,0|1,1,0]=4 1606 B8R1.2 CCN1CCOCC1 fb923a7109dd2702dd7751939694bf0a [0,1,0,1,0,0|2,0,0]=4 1607 B8R1.2 CCN1CCSCC1 1b9658d9d2dd04d5c3441497757b0605 [0,1,0,1,0,0|2,0,0]=4 1608 B8R1.2 O=CN1CCCOC1 f5641b081c81baeb630a926cccc2dad9 [0,1,0,1,0,0|2,0,0]=4 1609 B8R1.2 O=CN1CCCSC1 02efafcaba189386286d3d47585eb111 [0,1,0,1,0,0|2,0,0]=4 1610 B8R1.2 O=CN1CCOCC1 477872453b181b061009dc05da1525e4 [0,1,0,1,0,0|2,0,0]=4 1611 B8R1.2 O=CN1CCSCC1 ef4056096863dc4bdb0fd1df8e6f14a0 [0,1,0,1,0,0|2,0,0]=4 1612 B8R1.9 CCCNC1CC1C 0a698bf1fb13624ef2e48e54bc092aff [0,1,0,1,0,0|1,0,1]=4 1613 B8R1.9 CCOCC1CC1C a1ad259ec9fec6cbcfa8781679544c1d [0,1,0,1,0,0|1,0,1]=4 1614 B8R1.9 CCOC[C@@H]1C[C@@H]1C 4ce6bf2d2de734fe8f28315de3f63974 [0,1,0,1,0,0|1,0,1]=4 1615 B8R1.9 CCOC[C@@H]1C[C@H]1C f1e8faba0bc503df2acdbd86da05c1cd [0,1,0,1,0,0|1,0,1]=4 1616 B8R1.9 CCOC[C@H]1C[C@@H]1C d0e5d8760a155c6ca9b44bd743e35a53 [0,1,0,1,0,0|1,0,1]=4 1617 B8R1.10 CCCCN1CCC1 7fbca42388bc0dd3c1b836c8bc1c15ea [0,1,0,1,0,0|2,0,0]=4 1618 B8R1.10 CCCNC1CCC1 0d5b8030ddd2a1e07521f601d888db58 [0,1,0,1,0,0|1,0,1]=4 1619 B8R1.10 CCCOC1CCC1 56704029ca064ce456cbec81788df6b2 [0,1,0,1,0,0|1,0,1]=4 1620 B8R1.10 CCNCC1CCC1 51789aa8cde681373936f52aa711708a [0,1,0,1,0,0|1,0,1]=4 1621 B8R1.10 CCNCC1CCO1 adc8bc943b2800391aa94f7416a09286 [0,1,0,1,0,0|0,0,2]=4 1622 B8R1.10 CCNC[C@@H]1CCO1 9aba48d1f47470a09a7d35987a5e8ef0 [0,1,0,1,0,0|0,0,2]=4 1623 B8R1.10 CCNC[C@H]1CCO1 31fbc41ff0d13846dbeceac9b5a26021 [0,1,0,1,0,0|0,0,2]=4 1624 B8R1.10 CCOCC1CCC1 d50b1f59edc7cd2c85ebc568d9e5d0da [0,1,0,1,0,0|1,0,1]=4 1625 B8R1.10 CCOCC1CCO1 46f20f884871fb02e5439ea768f341df [0,1,0,1,0,0|0,0,2]=4 1626 B8R1.10 CCOCN1CCC1 7f8bcaafce643ae0c473400a947eab9d [0,1,0,1,0,0|2,0,0]=4 1627 B8R1.10 CCOC[C@@H]1CCO1 8e7e4c4711f67b56ad5c5f6f6bf92524 [0,1,0,1,0,0|0,0,2]=4 1628 B8R1.10 CCOC[C@H]1CCO1 4172e43302b2071a73023d12b6c9bf61 [0,1,0,1,0,0|0,0,2]=4 1629 B8R1.10 COCCN1CCC1 e94ebefbab355261b351bf6278fb2861 [0,1,0,1,0,0|2,0,0]=4 1630 B8R1.10 CSCCN1CCC1 9792545c82f20ff9437db0c960cae46b [0,1,0,1,0,0|2,0,0]=4 1631 B8R1.10 FCCCN1CCC1 ce9883ed98348c3043ca281e3aae0921 [0,1,0,1,0,0|2,0,0]=4 1632 B8R1.10 OCCCN1CCC1 9c6f6bdabd0b2602126e7a24b406e0df [0,1,0,1,0,0|2,0,0]=4 1633 B8R1.10 SCCCN1CCC1 9eb969adee9e410d06ebfdbf71b456b3 [0,1,0,1,0,0|2,0,0]=4 1634 B8R1.13 CCNC1CCC1F 1ca365aa3a03dba2f96f4cadc68f780e [0,1,0,1,0,0|1,0,1]=4 1635 B8R1.13 CCNC1CCC1O fb70cd93332b5942b9400efe3b54dca5 [0,1,0,1,0,0|0,0,2]=4 1636 B8R1.13 CCN[C@@H]1CC[C@@H]1O a44a1131ac7553e4f969af4276e28d55 [0,1,0,1,0,0|0,0,2]=4 1637 B8R1.13 CCN[C@@H]1CC[C@H]1C b2a7a1306f6d284a439c237328784f14 [0,1,0,1,0,0|1,0,1]=4 1638 B8R1.13 CCN[C@@H]1CC[C@H]1O 4f0278655b9d968ff2d102bbaed0b37a [0,1,0,1,0,0|0,0,2]=4 1639 B8R1.13 CCN[C@H]1CC[C@@H]1O 3bed658078592c5d2659e64ff05d8887 [0,1,0,1,0,0|0,0,2]=4 1640 B8R1.13 CCN[C@H]1CC[C@H]1C afc3ebb3c9df554bbf3e4778dd720d68 [0,1,0,1,0,0|1,0,1]=4 1641 B8R1.13 CCN[C@H]1CC[C@H]1O 89451e4a9e80a1548ed036e94f478963 [0,1,0,1,0,0|0,0,2]=4 1642 B8R1.13 CCN[C@H]1CNC1=O f3f57bd052f649487c4a2d7e92b0d01a [0,1,0,1,0,0|1,0,0]=3 1643 B8R1.13 CCOC1CCC1=O 3dbc6f04881f51171a4de09e2024a401 [0,1,0,1,0,0|0,0,0]=2 1644 B8R1.13 N#CNC1CCC1=O 6fef62f5b6597e2c0a9f8080852ec84e [0,1,0,1,0,0|1,0,1]=4 1645 B8R1.13 O=C1CCC1OCF acbe5648e5fa1bf2d12fcf8dac78f593 [0,1,0,1,0,0|1,0,0]=3 1646 B8R1.13 O=C1NC[C@@H]1NCF 0d76b77004abe2bde2fffde83ac370da [0,1,0,1,0,0|2,0,0]=4 1647 B8R1.13 O=C1NC[C@@H]1NCO 13e7ef24d5bda6a447193e9ab8c1b3ed [0,1,0,1,0,0|2,0,0]=4 1648 B8R1.38 C#CC(=O)N1CCC1 ee88789ac1776648008850b2a3fc2fcb [0,1,0,1,0,0|0,0,2]=4 1649 B8R1.38 C=CC(=O)N1CCC1 d0139f7b17a74aad2f7c1656c4595cf8 [0,1,0,1,0,0|0,0,2]=4 1650 B8R1.38 CCC(=O)N1CCC1 d52503cf4cfc194127f664b5bcf57565 [0,1,0,1,0,0|0,0,0]=2 1651 B8R1.38 CCC(C)N1CCC1 873a1405e2e4da9ba44f1206f60c75eb [0,1,0,1,0,0|1,0,1]=4 1652 B8R1.38 CCN(C)C1CCC1 f4c71fad86f93d124aa033d80b305738 [0,1,0,1,0,0|2,0,0]=4 1653 B8R1.38 CCN(C)C1COC1 da9a6247ddb5760e53780832feb6c9df [0,1,0,1,0,0|2,0,0]=4 1654 B8R1.38 O=C(CF)N1CCC1 e1631cac567168a725b0163e106fbfc3 [0,1,0,1,0,0|1,0,0]=3 1655 B8R1.38 O=C(CO)N1CCC1 14506b695520a8256189bb97564c8706 [0,1,0,1,0,0|1,0,0]=3 1656 B8R1.38 O=C(CS)N1CCC1 483ef26b984ed24bd38f07147cc524a3 [0,1,0,1,0,0|1,0,0]=3 1657 B8R1.38 O=CC(=O)N1CCC1 3cd44a972429668a2e301e83de6705a9 [0,1,0,1,0,0|1,0,1]=4 1658 B8R1.41 CCCNC1(CC1)C bc8a7f6a518459411dffbe8949d7bcc9 [0,1,0,1,0,0|1,0,1]=4 1659 B8R1.41 CCNCC1(CC1)F d52b114fe7c16011a259855edea8aafc [0,1,0,1,0,0|1,0,1]=4 1660 B8R1.41 CCNCC1(CC1)O 73d481860929ec0f2bc61c4a786c0e18 [0,1,0,1,0,0|0,0,2]=4 1661 B8R1.41 CCOCC1(CC1)Br 5d31f412dfbbc10f66018c71cb2c84a3 [0,1,0,1,0,0|1,0,1]=4 1662 B8R1.41 CCOCC1(CC1)C 3e780dfeae3f9f184d94175ac6be0170 [0,1,0,1,0,0|1,0,1]=4 1663 B8R1.41 CCOCC1(CC1)Cl 684ad0a3cf745701f14beaae4fc37834 [0,1,0,1,0,0|1,0,1]=4 1664 B8R1.41 CCOCC1(CC1)F 9b4f12ddd3b826e3b62ea7597cf1376d [0,1,0,1,0,0|1,0,1]=4 1665 B8R1.47 CCC1CN(C1)CC 27929d598393fc53e615f7cb52a3273d [0,1,0,1,0,0|1,0,1]=4 1666 B8R1.47 CCN1CC(C1)CF 9d3fb4ccc9d38eee5544f4d35fcd82f6 [0,1,0,1,0,0|2,0,0]=4 1667 B8R1.47 CCN1CC(C1)CO 56dc2e706ae8aa4ebe5fced484d83567 [0,1,0,1,0,0|2,0,0]=4 1668 B8R1.47 CCN1CC(C1)OC c8d6a3d95b85a0be9074dc6d9bfa1ff3 [0,1,0,1,0,0|2,0,0]=4 1669 B8R1.47 CCN1CC(C1)SC 8746f03668c7e744efe9613af29b4486 [0,1,0,1,0,0|2,0,0]=4 1670 B8R1.27 CCCN1CC1(C)C 4e35148f04535705cb58387d435756a0 [0,1,0,1,0,0|2,0,0]=4 1671 B8R1.37 CCCN(C)C1CC1 a74d24dd9139700310f848728ff8f1ee [0,1,0,1,0,0|2,0,0]=4 1672 B8R1.37 CCN[C@@H](C)C1CC1 85a51bcbc9c68e01caf4bec9670fa8b0 [0,1,0,1,0,0|1,0,1]=4 1673 B8R1.37 CCN[C@H](C)C1CC1 dec2ed19b3db3f3a8d17077be18767e3 [0,1,0,1,0,0|1,0,1]=4 1674 B8R1.37 CCOC(C)C1CC1 526fc3f0c823fc41b9199d1aa6541386 [0,1,0,1,0,0|1,0,1]=4 1675 B8R1.37 CCO[C@@H](C)C1CC1 b9ad01da095d4dd4d383aa1d3c7eee6a [0,1,0,1,0,0|1,0,1]=4 1676 B8R1.37 CCO[C@H](C)C1CC1 9827b3948c8d24070570177d9e2b7efe [0,1,0,1,0,0|1,0,1]=4 1677 B8R1.37 CN(CCF)C1CC1 8e1a9aa788951abb1c8a01406d05e024 [0,1,0,1,0,0|2,0,0]=4 1678 B8R1.37 CN(CCO)C1CC1 80457e02321af0fbdb8d8ff6f9046346 [0,1,0,1,0,0|2,0,0]=4 1679 B8R1.37 CN(CCS)C1CC1 340ce15502d8807341f9362fff7ceb48 [0,1,0,1,0,0|2,0,0]=4 1680 B8R1.37 COCN(C)C1CC1 6dd9bf20afcc76b2166e7bbf95e1166b [0,1,0,1,0,0|2,0,0]=4 1681 B8R1.37 CSCN(C)C1CC1 4f2494c6a82611f9a13be950f026ca56 [0,1,0,1,0,0|2,0,0]=4 1682 B8R1.54 CC(C)N(C)C1CC1 6bdc36d34089e7a7b3c393f04fb73c58 [0,1,0,1,0,0|2,0,0]=4 1683 B8R1.6 CCCN1CC(C1)F a784fd033c1a2e6388f75c1ee38e00f2 [0,1,0,1,0,0|2,0,0]=4 1684 B8R1.6 CCCN1CC(C1)O 6960d1c76fc6bee2104d2cc7da6d53cb [0,1,0,1,0,0|2,0,0]=4 1685 B8R1.6 CCOC1CC(C1)C 67b3f93a8ec637ab1677a5244b5d5ac6 [0,1,0,1,0,0|1,0,1]=4 1686 B8R1.8 CCCN1CCSC1 4eb37c52d022d9b252d68ff1a2c12b91 [0,1,0,1,0,0|1,1,0]=4 1687 B8R1.8 CCNC1CCCC1 abbec96cb7bed76391f8cd34a2b780b6 [0,1,0,1,0,0|1,0,1]=4 1688 B8R1.8 CCOC1CCCC1 ce4ece9e93729f2dc32c7121b6646f41 [0,1,0,1,0,0|1,0,1]=4 1689 B8R1.8 CCOC1CCCO1 ace7c24bdcea053e870832c56c8928c4 [0,1,0,1,0,0|0,0,2]=4 1690 B8R1.11 CC1CCCN1C=O 3ea4d1e6647fbd09960c2c26417f1af4 [0,1,0,1,0,0|1,0,0]=3 1691 B8R1.11 CC1CCCN1CF fe20c957914c646b3b4006d1b063b75a [0,1,0,1,0,0|2,0,0]=4 1692 B8R1.11 CC1CCCN1CO 54974954fab0e072c3e5d67d217551d6 [0,1,0,1,0,0|1,0,1]=4 1693 B8R1.11 CC1SCCN1C=O a4140bf0d296ba848f3453d4bea5de05 [0,1,0,1,0,0|2,0,0]=4 1694 B8R1.11 CCN1CCCC1C 74d058d7956efbc8ae4ef590fc86d9c6 [0,1,0,1,0,0|1,0,1]=4 1695 B8R1.11 CCN1CCCC1O 146566e537ef7a9790c7ffe7385bae77 [0,1,0,1,0,0|0,0,2]=4 1696 B8R1.11 CCN1CCC[C@@H]1C 5bf7e722ced97ef7aec7490b4d0dc25a [0,1,0,1,0,0|1,0,1]=4 1697 B8R1.11 CCN1CCC[C@H]1C e74b9532535bc2eef7ae4850e9df5331 [0,1,0,1,0,0|1,0,1]=4 1698 B8R1.11 C[C@@H]1CCCN1C=O 5b11f1ed15ba14e3311dd9d4b620d01b [0,1,0,1,0,0|1,0,0]=3 1699 B8R1.11 C[C@@H]1CCCN1CF e9b99bb24d3baf133d2b2e0829d1f9dd [0,1,0,1,0,0|2,0,0]=4 1700 B8R1.11 C[C@@H]1CCCN1CO 4fcb8232d21346615f4cbb83427dc320 [0,1,0,1,0,0|1,0,1]=4 1701 B8R1.11 C[C@H]1CCCN1C=O 47ce3e99eee2f4d382d5e118e22fa773 [0,1,0,1,0,0|1,0,0]=3 1702 B8R1.11 C[C@H]1CCCN1CF dcda868098b241037a860e32aa3597cd [0,1,0,1,0,0|2,0,0]=4 1703 B8R1.11 C[C@H]1CCCN1CO 2f61618a874473c8038742f46c63e99b [0,1,0,1,0,0|1,0,1]=4 1704 B8R1.11 O=CN1CCCC1O a26ec465eebf98c295c9d7f5c4bb6e0a [0,1,0,1,0,0|2,0,0]=4 1705 B8R1.16 CCN1C(CC1C)C caa7a426b0056f3ed9602d58e88e5fb3 [0,1,0,1,0,0|1,0,1]=4 1706 B8R1.16 CCN1[C@@H](C[C@@H]1C)C 6b71c5fa41e862407d367f59c872d6c8 [0,1,0,1,0,0|1,0,1]=4 1707 B8R1.16 CCN1[C@@H](C[C@H]1C)C 31a518c2fb234fcc99ff5852357987ca [0,1,0,1,0,0|1,0,1]=4 1708 B8R1.16 CCN1[C@H](C[C@@H]1C)C eafd91ee0f290812abdc6fa4506793fa [0,1,0,1,0,0|1,0,1]=4 1709 B8R1.66 CCNC1(CCC1)C 1f8051d2bf871e5f84e9fcb0672c3f92 [0,1,0,1,0,0|1,0,1]=4 1710 B8R1.12 CCC1CCN1C=O 4d6ef5a44aefaf3ec9d57c4c6afb459e [0,1,0,1,0,0|1,0,0]=3 1711 B8R1.12 CCC1CCN1CC 821fbbe29ed1b9d1547efa94187e7e9f [0,1,0,1,0,0|2,0,0]=4 1712 B8R1.12 CCC1CCN1CF 2af23cf7c66aae8dbbf135025a194011 [0,1,0,1,0,0|2,0,0]=4 1713 B8R1.12 CCC1CCN1CO caf0ac1fced23c53f6877050d9fa7187 [0,1,0,1,0,0|1,0,1]=4 1714 B8R1.12 O=CN1CCC1CO edd971460a08454ceeb6be017da9f618 [0,1,0,1,0,0|2,0,0]=4 1715 B8R1.12 O=CN1CC[C@@H]1CO ce19f0bce3454d05cb7c121458132ef7 [0,1,0,1,0,0|2,0,0]=4 1716 B8R1.12 O=CN1CC[C@H]1CO e22630134adf9d5eaa8ff5bdd2c4924a [0,1,0,1,0,0|2,0,0]=4 1717 B8R1.33 CCN(C=O)C1CC1 01cfb1cb1bee8be07aafce80b6f4fac9 [0,1,0,1,0,0|1,0,0]=3 1718 B8R1.33 CCN(CC)C1CC1 02958adcff0a7d194ef323330d43edec [0,1,0,1,0,0|2,0,0]=4 1719 B8R1.33 CCN(CF)C1CC1 c22625f7484d23ec00a610d0c7c7894f [0,1,0,1,0,0|2,0,0]=4 1720 B8R1.33 CCN(CO)C1CC1 f84b0e969411df23ddfa09dc1cc6fa33 [0,1,0,1,0,0|1,0,1]=4 1721 B8R2.1 C1CN(C1)C2CC2 2b7226a815b2746e13976fa6395733ff [0,0,0,2,0,0|2,0,0]=4