0 B8R0.11 C#CC(CC)OCCC ab15fd59c98d539d7d07649312c6ebc3 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.11 C#CCNC(C=O)CC 48c244ba863c9b3f1f19111b4f9518db [0,0,0,0,0,0|1,0,3]=4 2 B8R0.11 C#CCOC(C=O)CC c8032fd9a325a5a526f29f5a872941b0 [0,0,0,0,0,0|1,0,3]=4 3 B8R0.11 C=CC(CC)OCCC 105fea4587e7e9d452a89f90aa2748e8 [0,0,0,0,0,0|2,0,1]=3 4 B8R0.11 C=CC(CC)OCCF 111d3d9408db9e7004d21878ee3769fd [0,0,0,0,0,0|3,0,1]=4 5 B8R0.11 C=CC(CC)OCCS 609e6a905685795ee0729035c337410f [0,0,0,0,0,0|3,0,1]=4 6 B8R0.11 C=CC(CC)OCOC 2705b37ec86e92e63729e769ccc0ecb9 [0,0,0,0,0,0|3,0,1]=4 7 B8R0.11 C=CC(CC)OCSC 8ad41cd97e56cb5ea78fa59e1c98869b [0,0,0,0,0,0|3,0,1]=4 8 B8R0.11 C=C[C@@H](CO)NCCC dbf80c876fbb8dcf06535205d9e2b255 [0,0,0,0,0,0|3,0,1]=4 9 B8R0.11 CCC(C=O)NCC#N ef76e6e875b2b11a4475b7834774c0a5 [0,0,0,0,0,0|2,0,2]=4 10 B8R0.11 CCC(C=O)NCCBr b2bce0ce1b9ab602a40f18f0015518c7 [0,0,0,0,0,0|2,0,1]=3 11 B8R0.11 CCC(C=O)NCCF 38437253c46eaa94c039d42d662294ca [0,0,0,0,0,0|2,0,1]=3 12 B8R0.11 CCC(C=O)NCCI b275adc10c65353a9f2e2d29c810ac5c [0,0,0,0,0,0|2,0,1]=3 13 B8R0.11 CCC(C=O)NCCO 0ef6baa986478af3845ad64b43273775 [0,0,0,0,0,0|2,0,1]=3 14 B8R0.11 CCC(C=O)NCCS 659251275749d198cbef7b75a8f4d945 [0,0,0,0,0,0|2,0,1]=3 15 B8R0.11 CCC(C=O)OCC#N 462c2640b08076ad787b1fa11f5b059d [0,0,0,0,0,0|2,0,2]=4 16 B8R0.11 CCC(C=O)OCCF 6589c03588b79ef923770a2e5281e8cd [0,0,0,0,0,0|2,0,1]=3 17 B8R0.11 CCC(C=O)OCCS ea764c2bc2338bce8bffce9cca976a1a [0,0,0,0,0,0|2,0,1]=3 18 B8R0.11 CCC(C=O)OCOC fda93f4e64fa70de9b1ea0e38d5ee013 [0,0,0,0,0,0|2,0,1]=3 19 B8R0.11 CCCCN(C=O)CC cdc74e35a30bfd5fd030759b798d1154 [0,0,0,0,0,0|1,0,1]=2 20 B8R0.11 CCCCN(CC)CC 799082ccac5d401a30542c693df9a037 [0,0,0,0,0,0|2,0,2]=4 21 B8R0.11 CCCCN(CC)CF 191f83d5d3d3672b3280b00206bb418d [0,0,0,0,0,0|2,0,2]=4 22 B8R0.11 CCCCN(CC)CO 357cfc04e742bfe2a111c827fc08c91d [0,0,0,0,0,0|1,0,3]=4 23 B8R0.11 CCCNC(C#N)C=O bb6eeeeb0f4e88a5ae86d21120ed4af3 [0,0,0,0,0,0|2,0,2]=4 24 B8R0.11 CCCNC(C=O)C=O 61c64ea3c5c386d29c1c97169c33ddfe [0,0,0,0,0,0|2,0,2]=4 25 B8R0.11 CCCNC(C=O)CC 8b5e0e2daf5f0f35115de8e725402fa5 [0,0,0,0,0,0|1,0,1]=2 26 B8R0.11 CCCNC(CC)CC 9be5d4abc1b4d0703a44bd9539e556bb [0,0,0,0,0,0|2,0,2]=4 27 B8R0.11 CCCNC(CC)CO 18fc997e699e711c2231a1e18c184815 [0,0,0,0,0,0|1,0,3]=4 28 B8R0.11 CCCN[C@@H](CC)CO f14436f2737b9dbc3051d6d9b364b94f [0,0,0,0,0,0|1,0,3]=4 29 B8R0.11 CCCN[C@H](CC)CO 81a649534946bc6ce248c71efca3ef7e [0,0,0,0,0,0|1,0,3]=4 30 B8R0.11 CCCOC(C#N)CC 481f0b269a40a36b271d480e84368d21 [0,0,0,0,0,0|2,0,2]=4 31 B8R0.11 CCCOC(C=O)C=O 07af7786a553a96d7cd2f6465c693e9f [0,0,0,0,0,0|2,0,2]=4 32 B8R0.11 CCCOC(C=O)CC 5c5bd3caba387b7aed9948606b55ead9 [0,0,0,0,0,0|1,0,1]=2 33 B8R0.11 CCCOC(CC)CC 148ca867dd0504225a42b1f7b68138cf [0,0,0,0,0,0|2,0,2]=4 34 B8R0.11 CCN(C=O)CCC#N dcf0169ebeb3abd59e6492b9aebf58af [0,0,0,0,0,0|2,0,2]=4 35 B8R0.11 CCN(C=O)CCCO 1400c17018da6a8c616cf48985189e21 [0,0,0,0,0,0|2,0,1]=3 36 B8R0.11 CCN(C=O)CCOC 57d3ddcf433d03a3e450ecf7301ce02d [0,0,0,0,0,0|2,0,1]=3 37 B7R0.3 C#CC(=O)NCCC cae95b1c8d30c3884ac9714e15062442 [1,0,0,0,0,0|1,0,2]=4 38 B7R0.3 C#CCNC(=O)CC ef394171f7ba9dfda173330f309f7a5d [1,0,0,0,0,0|1,0,2]=4 39 B7R0.3 C=C(C=O)OCCC 04efcca188a8b47a61c5130fe82b341f [1,0,0,0,0,0|1,0,1]=3 40 B7R0.3 C=C(C=O)OCCF f36f281a47e9b29afb82a09d8a3f6a4b [1,0,0,0,0,0|2,0,1]=4 41 B7R0.3 C=C(C=O)OCCS 77fec4c96c514d23c04a525ff34b91e2 [1,0,0,0,0,0|2,0,1]=4 42 B7R0.3 C=C(C=O)OCOC fd2d010df8589efa2d493b57390022d2 [1,0,0,0,0,0|2,0,1]=4 43 B7R0.3 C=C(C=O)OCSC c329dc66e0c8ef5c815429253c081723 [1,0,0,0,0,0|2,0,1]=4 44 B7R0.3 C=CC(=O)NCCC cbaf2af1e216a93f8d9916d9e14e472f [1,0,0,0,0,0|1,0,2]=4 45 B7R0.3 C=CC(C)NCCC ce56ff835d97c72d3c77b342679142d9 [1,0,0,0,0,0|2,0,1]=4 46 B7R0.3 C=CC(C)OCCC 8464afc7aadbd92a9fa5abdf7f0413c4 [1,0,0,0,0,0|2,0,1]=4 47 B7R0.3 C=C[C@H](C)OCCC a65433c10fca3bf1d0678a7bf1f757da [1,0,0,0,0,0|2,0,1]=4 48 B7R0.3 CC(C=O)NCCBr e62dcd68debd83fbc562e7642602b43a [1,0,0,0,0,0|2,0,1]=4 49 B7R0.3 CC(C=O)NCCF 3f043d9316d202555af83ac46b0372cc [1,0,0,0,0,0|2,0,1]=4 50 B7R0.3 CC(C=O)NCCI 0d60b9f4140097c5e41c90179bcb853b [1,0,0,0,0,0|2,0,1]=4 51 B7R0.3 CC(C=O)NCCO 96981c8499c542f7fb2722dd0795dded [1,0,0,0,0,0|2,0,1]=4 52 B7R0.3 CC(C=O)NCCS 2cf826365eb6ff97374090530c3ccaf5 [1,0,0,0,0,0|2,0,1]=4 53 B7R0.3 CC(C=O)OCCF 9676f45a56098fb26857cb4b8fa0bcb0 [1,0,0,0,0,0|2,0,1]=4 54 B7R0.3 CC(C=O)OCCS 707059ad8fea5768d8b6a96e20ccb88c [1,0,0,0,0,0|2,0,1]=4 55 B7R0.3 CCC(=O)COCF 0dfc429bc09e415d47df418ebade007a [1,0,0,0,0,0|2,0,1]=4 56 B7R0.3 CCC(=O)NCC#N 8ad58c7a251d01ba78f75279da47aa27 [1,0,0,0,0,0|2,0,1]=4 57 B7R0.3 CCC(=O)NCCBr 622c7e0d01006938ab3182a350e1ebd0 [1,0,0,0,0,0|2,0,0]=3 58 B7R0.3 CCC(=O)NCCF 64c5d06137bf344ab2d9ef1c9d4f8989 [1,0,0,0,0,0|2,0,0]=3 59 B7R0.3 CCC(=O)NCCI a607114f95a86326e4b8a49fc0dc2b27 [1,0,0,0,0,0|2,0,0]=3 60 B7R0.3 CCC(=O)NCCO 7cd694fbe0a0792079b1131d041f8e7c [1,0,0,0,0,0|2,0,0]=3 61 B7R0.3 CCC(=O)NCCS 2d1553f99b093c5be0d2a8ed841e36c7 [1,0,0,0,0,0|2,0,0]=3 62 B7R0.3 CCCCN(C)C=O 9e1fd6b74517af7f400dd8faea413d3e [1,0,0,0,0,0|1,0,1]=3 63 B7R0.3 CCCCN(C)CC 89876d3ca82726715f2f995cd8bda708 [1,0,0,0,0,0|1,0,2]=4 64 B7R0.3 CCCNC(=O)C=O d7ca29ecc0d8770667a3b66f38c8ad0e [1,0,0,0,0,0|2,0,0]=3 65 B7R0.3 CCCNC(=O)CC d52888c93ed9aa6cfb5138e6aae16063 [1,0,0,0,0,0|1,0,0]=2 66 B7R0.3 CCCNC(=O)CF 67a342107ae82918e7753da6150a6f54 [1,0,0,0,0,0|2,0,0]=3 67 B7R0.3 CCCNC(=O)CO 695700e0c0155474a56ee68a189e270e [1,0,0,0,0,0|2,0,0]=3 68 B7R0.3 CCCNC(=O)CS 91632e7a8866d5c8829272afb3b260d7 [1,0,0,0,0,0|2,0,0]=3 69 B7R0.3 CCCNC(C)C=O 7e933d948c2e669e598ddc3c695365b5 [1,0,0,0,0,0|1,0,1]=3 70 B7R0.3 CCCNC(C)CC 943eb030d61b8e5bd9a7ef7a782a9e18 [1,0,0,0,0,0|1,0,2]=4 71 B7R0.3 CCCN[C@@H](C)CC 9b5d6f86dd01bda6e2759939f83bc7a8 [1,0,0,0,0,0|1,0,2]=4 72 B7R0.3 CCCN[C@H](C)C=O 7a63958ebc59429c5dcc5f06d2683ced [1,0,0,0,0,0|1,0,1]=3 73 B7R0.3 CCCN[C@H](C)CC 1516fdad8637f0b3c763f64cc7a7beb7 [1,0,0,0,0,0|1,0,2]=4 74 B7R0.3 CCCOC(C)C=O 64f7abc1e62101b123e23f4c74164a7e [1,0,0,0,0,0|1,0,1]=3 75 B7R0.3 CCCOC(C)CC 98a624a488dc392a35e8b0b44aac3f30 [1,0,0,0,0,0|1,0,2]=4 76 B7R0.3 CCCO[C@@H](C)CC af9e77ade15ce19a7659cd0cba0e805a [1,0,0,0,0,0|1,0,2]=4 77 B7R0.3 CCCO[C@H](C)C=O 08508c09bba0136bf81083f7b07956d8 [1,0,0,0,0,0|1,0,1]=3 78 B7R0.3 CCCO[C@H](C)CC aceb38a7b284bb9c5e1ae0a6fb45caa0 [1,0,0,0,0,0|1,0,2]=4 79 B7R0.3 CCNCC(=O)NC 6e0bba6a22fc3bc37e6c3e6f60c6e36a [1,0,0,0,0,0|2,0,1]=4 80 B7R0.3 CCNCC(=O)OC b1dca081e4a690ea6b077cbe8021ba9d [1,0,0,0,0,0|2,0,1]=4 81 B7R0.3 CCOC/C(=C/I)/C 92df24ec990a3895db2ac49e1b5a7038 [1,0,0,0,0,0|2,0,1]=4 82 B7R0.3 CCOCC(=CI)C fb53346fffa55ab558f152fe4ff2ec43 [1,0,0,0,0,0|2,0,1]=4 83 B7R0.3 CCOCC(=O)CC 13cc2d887732afb318f359551753b6fc [1,0,0,0,0,0|1,0,1]=3 84 B7R0.3 CCOCC(=O)NC c799fcda6efa9f3f97fe8695cdef5794 [1,0,0,0,0,0|2,0,1]=4 85 B7R0.3 CCOCC(=O)OC b7ea85ad64af7662897e0490968d63a7 [1,0,0,0,0,0|2,0,1]=4 86 B7R0.3 CN(C=O)CCCO d9d91dbce26e2eec91c5287e49989c6b [1,0,0,0,0,0|2,0,1]=4 87 B7R0.3 COCCN(C)C=O 31e1cd7ac14afa72fee2870fbd09d003 [1,0,0,0,0,0|2,0,1]=4 88 B7R0.3 COCOC(C)C=O 3707afff98f056c5534ccbc658911b1f [1,0,0,0,0,0|2,0,1]=4 89 B7R0.3 COCO[C@H](C)C=O 34de2462dae77151365395b9e28ef026 [1,0,0,0,0,0|2,0,1]=4 90 B7R0.3 CSCCN(C)C=O a6a4e8ea5b94212ce62d31147e5f4a78 [1,0,0,0,0,0|2,0,1]=4 91 B7R0.3 CSCOC(C)C=O f3e4026b3b027885c21fad548f08eb1c [1,0,0,0,0,0|2,0,1]=4 92 B7R0.3 C[C@H](C=O)NCCBr 1c88aafc7cf0e6ecf5a695c971d96c26 [1,0,0,0,0,0|2,0,1]=4 93 B7R0.3 C[C@H](C=O)NCCF 312336c63755d0cb499e935eb3842567 [1,0,0,0,0,0|2,0,1]=4 94 B7R0.3 C[C@H](C=O)NCCI 365ac184287fbb3cff12bb64cb86f31d [1,0,0,0,0,0|2,0,1]=4 95 B7R0.3 C[C@H](C=O)NCCO c2af2d81a42c507f9635465d1a70fd23 [1,0,0,0,0,0|2,0,1]=4 96 B7R0.3 C[C@H](C=O)NCCS e667bec1b7d47f2ddf6d0ff1e8c85311 [1,0,0,0,0,0|2,0,1]=4 97 B7R0.3 C[C@H](C=O)OCCF a0a5cbe08a1078c6900a6f0acbda2a8d [1,0,0,0,0,0|2,0,1]=4 98 B7R0.3 C[C@H](C=O)OCCS 15879fc18488d12b970460b0830cdd69 [1,0,0,0,0,0|2,0,1]=4 99 B7R0.3 O=C(CF)NCCBr 673baad86e5eefbb1b8c6ebb8cd73ae0 [1,0,0,0,0,0|3,0,0]=4 100 B7R0.3 O=C(CF)NCCF 67f25bcd080b5d85cd6525c56f31ea47 [1,0,0,0,0,0|3,0,0]=4 101 B7R0.3 O=C(CF)NCCI 1267d8b8b0da94faf267955e2b6d3339 [1,0,0,0,0,0|3,0,0]=4 102 B7R0.3 O=C(CF)NCCO 249c36c08dc5400834b319c39099c4e4 [1,0,0,0,0,0|3,0,0]=4 103 B7R0.3 O=C(CF)NCCS 6fbf26912db8657dfac73b7a38962924 [1,0,0,0,0,0|3,0,0]=4 104 B7R0.3 O=C(CO)NCCBr 0d2e958569fc4d07a30343b37bac9c1d [1,0,0,0,0,0|3,0,0]=4 105 B7R0.3 O=C(CO)NCCF b7f1aa95ae5b9ced38af3286ec11730a [1,0,0,0,0,0|3,0,0]=4 106 B7R0.3 O=C(CO)NCCI 800c7155616705269676d2b386ed78aa [1,0,0,0,0,0|3,0,0]=4 107 B7R0.3 O=C(CO)NCCO 50003864fda33c69c3e5fa91ade641a0 [1,0,0,0,0,0|3,0,0]=4 108 B7R0.3 O=C(CO)NCCS 26e52ec354a3b7189e72bcae6a8d0219 [1,0,0,0,0,0|3,0,0]=4 109 B7R0.3 O=C(CS)NCCBr 4b08241ea1d7b8a0c4334c82506d75b0 [1,0,0,0,0,0|3,0,0]=4 110 B7R0.3 O=C(CS)NCCF d3c5664c15544d35b4683a8663e5b57d [1,0,0,0,0,0|3,0,0]=4 111 B7R0.3 O=C(CS)NCCI 95020692b0f8665c0c31cb074bf3f310 [1,0,0,0,0,0|3,0,0]=4 112 B7R0.3 O=C(CS)NCCO 1770b4a33c0d2574e46d3e387e79cf7a [1,0,0,0,0,0|3,0,0]=4 113 B7R0.3 O=C(CS)NCCS a9285f587f9c002b8ab7f77509aee977 [1,0,0,0,0,0|3,0,0]=4 114 B7R0.3 O=CC(=O)NCCBr 2e764955e5b027229dc47aa131dbf662 [1,0,0,0,0,0|3,0,0]=4 115 B7R0.3 O=CC(=O)NCCF fc9621fe97219629ab963b2546f4b25a [1,0,0,0,0,0|3,0,0]=4 116 B7R0.3 O=CC(=O)NCCI e0a4f5a8499d8d769053243c1c1c0e74 [1,0,0,0,0,0|3,0,0]=4 117 B7R0.3 O=CC(=O)NCCO 0f54c9d799f4c0c4875a4c5afe26d691 [1,0,0,0,0,0|3,0,0]=4 118 B7R0.3 O=CC(=O)NCCS 8f21f47feaeb7f9710321d6778c69f89 [1,0,0,0,0,0|3,0,0]=4 119 B7R0.12 C=CC(CC)OCC 3384f4e6ac585bde2972dae19026fd2c [1,0,0,0,0,0|2,0,1]=4 120 B7R0.12 CCCN(C=O)CC c9c4d92e42201b75307332d9c7692aa9 [1,0,0,0,0,0|1,0,0]=2 121 B7R0.12 CCCN(CC)CC cee9a7f56e1e423b5ee592f89dcd5a79 [1,0,0,0,0,0|2,0,1]=4 122 B7R0.12 CCCN(CC)CF bb959a7f19e3a674eec89c0630b059f9 [1,0,0,0,0,0|2,0,1]=4 123 B7R0.12 CCCN(CC)CO 0db6153d76ded508e5655e9e69753d11 [1,0,0,0,0,0|1,0,2]=4 124 B7R0.12 CCN(C=O)CC#N 5144a4fd650d7585538e4f3d90f2669b [1,0,0,0,0,0|2,0,1]=4 125 B7R0.12 CCN(C=O)CCCl 03512ce3018e8845973ab6d439faef81 [1,0,0,0,0,0|2,0,0]=3 126 B7R0.12 CCN(C=O)CCO f06d113e63228ddd0fbad99b8e842127 [1,0,0,0,0,0|2,0,0]=3 127 B7R0.12 O=CN(CO)CCO 04adc48d7b0506cc852e54ed640113a1 [1,0,0,0,0,0|3,0,0]=4 128 B9R0.13 C/C=C(\OCCC)/C(=O)O 805835d2fd7a7175bc2df69132bafc8c [0,1,0,0,0,0|1,0,1]=3 129 B9R0.13 C/C=C(\OCCF)/C(=O)O 4c391258a63af4912dc1a19cc30f3f17 [0,1,0,0,0,0|2,0,1]=4 130 B9R0.13 C/C=C(\OCCS)/C(=O)O dc4d3470500c2b5f90dbe050d8f95d15 [0,1,0,0,0,0|2,0,1]=4 131 B9R0.13 C/C=C(\OCOC)/C(=O)O ecdcb7748e59f7015e37a61c03c6e3e7 [0,1,0,0,0,0|2,0,1]=4 132 B9R0.13 C/C=C(\OCSC)/C(=O)O 9c894bfd9598c733e4f3bb22ad8e947c [0,1,0,0,0,0|2,0,1]=4 133 B9R0.13 C=CC(OCCC)C(C)C 9b2e15e68db48850b7bd508e59ff4bf0 [0,1,0,0,0,0|2,0,1]=4 134 B9R0.13 CC(C)C(C=O)NCCBr 7e946451d9fc0e449c015b67eaa85fbd [0,1,0,0,0,0|2,0,1]=4 135 B9R0.13 CC(C)C(C=O)NCCF afddf3fbc5b06db2d72b322904984f3f [0,1,0,0,0,0|2,0,1]=4 136 B9R0.13 CC(C)C(C=O)NCCI dd7de1309df27a6d6c8a5fa812d8b7be [0,1,0,0,0,0|2,0,1]=4 137 B9R0.13 CC(C)C(C=O)NCCO 1c333b95f683622529f7b56c4760fb06 [0,1,0,0,0,0|2,0,1]=4 138 B9R0.13 CC(C)C(C=O)NCCS 849a7af9a176d598e11969ee94b207b2 [0,1,0,0,0,0|2,0,1]=4 139 B9R0.13 CC(C)C(C=O)OCCF 201dfe0c5cdb3ffa1ea725e5c3452e52 [0,1,0,0,0,0|2,0,1]=4 140 B9R0.13 CC(C)C(C=O)OCCS 91b80725008b1c8d183a083ca2808ac0 [0,1,0,0,0,0|2,0,1]=4 141 B9R0.13 CC(C)N(C=O)CCCO 27062baf6d763893265c959953cb8392 [0,1,0,0,0,0|2,0,1]=4 142 B9R0.13 CCC(NCCBr)C(=O)N 9d98281ceda880e1dcaeab24f6bc75e1 [0,1,0,0,0,0|2,0,1]=4 143 B9R0.13 CCC(NCCBr)C(=O)O 60b3a5cec1771b7f3abdb67726cb92d4 [0,1,0,0,0,0|2,0,1]=4 144 B9R0.13 CCC(NCCF)C(=O)N 9d7980189f37d456ed15f61f4ee67347 [0,1,0,0,0,0|2,0,1]=4 145 B9R0.13 CCC(NCCF)C(=O)O f00d042b671287c74e43c494b5cb091f [0,1,0,0,0,0|2,0,1]=4 146 B9R0.13 CCC(NCCI)C(=O)N c0115b77b4f46b846461f6bc6a2a5ec5 [0,1,0,0,0,0|2,0,1]=4 147 B9R0.13 CCC(NCCI)C(=O)O e2ba567d8906f9f386d4d3c7d9da02d9 [0,1,0,0,0,0|2,0,1]=4 148 B9R0.13 CCC(NCCO)C(=O)N 2489f70578494e60c9c27d8e919c4b89 [0,1,0,0,0,0|2,0,1]=4 149 B9R0.13 CCC(NCCO)C(=O)O 1243b32011dafc3df4fb73416c3d434f [0,1,0,0,0,0|2,0,1]=4 150 B9R0.13 CCC(NCCS)C(=O)N 18eca7cc918b80b5ea16493698ca11a4 [0,1,0,0,0,0|2,0,1]=4 151 B9R0.13 CCC(NCCS)C(=O)O cf45ba956b95450629f68d6bc51c2075 [0,1,0,0,0,0|2,0,1]=4 152 B9R0.13 CCC(NCOC)C(=O)N 8f4286d06e0c4bfcd3da0489a315619c [0,1,0,0,0,0|2,0,1]=4 153 B9R0.13 CCC(NCOC)C(=O)O 29bdf399d9540f3750b5dbde7f57f2de [0,1,0,0,0,0|2,0,1]=4 154 B9R0.13 CCC(NCSC)C(=O)N 6d3a975d8c330495737ae1e2b78ace1f [0,1,0,0,0,0|2,0,1]=4 155 B9R0.13 CCC(NCSC)C(=O)O d79342730ef2d3fa4148bd4194f0c1b1 [0,1,0,0,0,0|2,0,1]=4 156 B9R0.13 CCC(OCCF)C(=O)N 4a5af37347955d9cc6474b77ce0c4feb [0,1,0,0,0,0|2,0,1]=4 157 B9R0.13 CCC(OCCF)C(=O)O c00ad7906612369696071846d56d58d6 [0,1,0,0,0,0|2,0,1]=4 158 B9R0.13 CCC(OCCS)C(=O)N eb6b012c5810bf7e1f5a030c5dccf517 [0,1,0,0,0,0|2,0,1]=4 159 B9R0.13 CCC(OCCS)C(=O)O e3af5c4fd79a95335149ab48b00e4e02 [0,1,0,0,0,0|2,0,1]=4 160 B9R0.13 CCC(OCOC)C(=O)N 3fa5c522652bf4cc0728aac721ee9f80 [0,1,0,0,0,0|2,0,1]=4 161 B9R0.13 CCC(OCOC)C(=O)O e6b9c845d6bb5735a4f158a19827bbda [0,1,0,0,0,0|2,0,1]=4 162 B9R0.13 CCC(OCSC)C(=O)N 1b463fc2a4b5915ea8e737397216a65d [0,1,0,0,0,0|2,0,1]=4 163 B9R0.13 CCC(OCSC)C(=O)O ccd4ff15a6e6eec5f462ba7c168ece60 [0,1,0,0,0,0|2,0,1]=4 164 B9R0.13 CCCCN(C=O)C(C)C ca25cc0ede1f17e579978b934a7c02df [0,1,0,0,0,0|1,0,1]=3 165 B9R0.13 CCCCN(CC)C(=O)C 6dcc903ab553d1d8d7c18d1a9b5cfc71 [0,1,0,0,0,0|1,0,1]=3 166 B9R0.13 CCCNC(C=O)C(C)C f831ef8703941ee898b4b54edaac5483 [0,1,0,0,0,0|1,0,1]=3 167 B9R0.13 CCCNC(CC)C(=O)N 667caeb7a94f8d9ae9b36913fbb97e0d [0,1,0,0,0,0|1,0,1]=3 168 B9R0.13 CCCNC(CC)C(=O)O f069c353f507c75e209c8348074371d9 [0,1,0,0,0,0|1,0,1]=3 169 B9R0.13 CCCNC(CCl)C(=O)O 83d744b2a78bac7ef1fc1246b7f75153 [0,1,0,0,0,0|2,0,1]=4 170 B9R0.13 CCCNC(CF)C(=O)O 2674f23278ea23c1a3fd9e79cc64f417 [0,1,0,0,0,0|2,0,1]=4 171 B9R0.13 CCCNC(CO)C(=O)N 9c2b75e44bd4651497cab3304501dc4c [0,1,0,0,0,0|2,0,1]=4 172 B9R0.13 CCCNC(CO)C(=O)O f78fc4da322d7ff361a6dd4f22023970 [0,1,0,0,0,0|2,0,1]=4 173 B9R0.13 CCCNC(CS)C(=O)O 7ab935d1954160e0fa48d269e73468b7 [0,1,0,0,0,0|2,0,1]=4 174 B9R0.13 CCCN[C@@H](CC)C(=O)N bb80f4d26611993ee0bd284d09039684 [0,1,0,0,0,0|1,0,1]=3 175 B9R0.13 CCCN[C@@H](CC)C(=O)O 4af529648ddb980425c401ff5a4b13f1 [0,1,0,0,0,0|1,0,1]=3 176 B9R0.13 CCCN[C@@H](CCl)C(=O)O dab0665f81f97191818ff25180caa069 [0,1,0,0,0,0|2,0,1]=4 177 B9R0.13 CCCN[C@@H](CO)C(=O)N 6615855b472bab65ebca7f72bd3cddd9 [0,1,0,0,0,0|2,0,1]=4 178 B9R0.13 CCCN[C@@H](CO)C(=O)O ddf3b03c8510fbc5ca4e2daff87a28f4 [0,1,0,0,0,0|2,0,1]=4 179 B9R0.13 CCCN[C@@H](CS)C(=O)O e3a74b3aff5bc12b4b6807001695fe2d [0,1,0,0,0,0|2,0,1]=4 180 B9R0.13 CCCN[C@H](CC)C(=O)O 61d39a4878aa39f0678d7acfbc68cb8c [0,1,0,0,0,0|1,0,1]=3 181 B9R0.13 CCCN[C@H](CCl)C(=O)O 4dc35c1012b0d0bb7903731dd1c16a51 [0,1,0,0,0,0|2,0,1]=4 182 B9R0.13 CCCN[C@H](CO)C(=O)O 8cf55344ec2a8ea73259764a0785501b [0,1,0,0,0,0|2,0,1]=4 183 B9R0.13 CCCN[C@H](CS)C(=O)O a0487dcbe4739001e1f7043af5abb830 [0,1,0,0,0,0|2,0,1]=4 184 B9R0.13 CCCOC(C=O)C(C)C 9fb3db273830a08549fa464487c1afa9 [0,1,0,0,0,0|1,0,1]=3 185 B9R0.13 CCCOC(CC)C(=O)N 9fda2f7e2d6a6a11459fa617236d25bc [0,1,0,0,0,0|1,0,1]=3 186 B9R0.13 CCCOC(CC)C(=O)O 3313398866cda9d19c5a77c88cc36eb1 [0,1,0,0,0,0|1,0,1]=3 187 B9R0.13 CCCO[C@@H](CC)C(=O)O cc9a140b3b6be041090ec10f8ce0cd25 [0,1,0,0,0,0|1,0,1]=3 188 B9R0.13 CCCO[C@H](CC)C(=O)O 8d217e6f2224fafe55f85fa98a7934d5 [0,1,0,0,0,0|1,0,1]=3 189 B9R0.13 CCCO[C@H](CF)C(=O)O 29086d9c9cd694f8fc4088578e463f2a [0,1,0,0,0,0|2,0,1]=4 190 B9R0.13 CCN(CCCO)C(=O)C e7ae570efef2e6ba7964a40dfee99a87 [0,1,0,0,0,0|2,0,1]=4 191 B9R0.13 CCN(CCOC)C(=O)C 859fe7d575d98ccb55858cdb23984d45 [0,1,0,0,0,0|2,0,1]=4 192 B9R0.13 CCNC[C@H](CC)C(=O)O cffe2fea12875251a32367199af5f540 [0,1,0,0,0,0|1,0,2]=4 193 B9R0.13 CC[C@@H](NCCBr)C(=O)O bb6c187dee35d2ba390554d16dc4aa9c [0,1,0,0,0,0|2,0,1]=4 194 B9R0.13 CC[C@@H](NCCF)C(=O)O b0e08cededed6f6c7a36fd6ec86e9e11 [0,1,0,0,0,0|2,0,1]=4 195 B9R0.13 CC[C@@H](NCCI)C(=O)O 6c91d06ea51585e4b95ef8a66d270abe [0,1,0,0,0,0|2,0,1]=4 196 B9R0.13 CC[C@@H](NCCO)C(=O)O e99f1fcc90431ea7ee28ab87555e864d [0,1,0,0,0,0|2,0,1]=4 197 B9R0.13 CC[C@@H](NCCS)C(=O)O 14a5bfc0158c777ba30bd0f0cd7926c2 [0,1,0,0,0,0|2,0,1]=4 198 B9R0.13 CC[C@@H](NCOC)C(=O)O afdab15192460f324c62f62289f5efe2 [0,1,0,0,0,0|2,0,1]=4 199 B9R0.13 CC[C@@H](NCSC)C(=O)O 5454d4f202e581954955a2783886044d [0,1,0,0,0,0|2,0,1]=4 200 B9R0.13 CC[C@@H](OCCF)C(=O)O 4399f51e9aa45bac3aec0e2f73a04ce4 [0,1,0,0,0,0|2,0,1]=4 201 B9R0.13 CC[C@@H](OCCS)C(=O)O 66d55e860e2b27d00267a7f39525c672 [0,1,0,0,0,0|2,0,1]=4 202 B9R0.13 CC[C@@H](OCOC)C(=O)O eaf672c9caead4abfc19e8f6a11051c8 [0,1,0,0,0,0|2,0,1]=4 203 B9R0.13 CC[C@@H](OCSC)C(=O)O f1b1aa50116639e72a339c9ead522291 [0,1,0,0,0,0|2,0,1]=4 204 B9R0.13 CC[C@H](NCCBr)C(=O)O e8e22504c7ea9404e3c376c4c793bb5c [0,1,0,0,0,0|2,0,1]=4 205 B9R0.13 CC[C@H](NCCF)C(=O)N 6b11b54dd459b0953fa7781edc0c8018 [0,1,0,0,0,0|2,0,1]=4 206 B9R0.13 CC[C@H](NCCF)C(=O)O d1f8996afde19b0565d59a42f964550f [0,1,0,0,0,0|2,0,1]=4 207 B9R0.13 CC[C@H](NCCI)C(=O)O 3a6efc8b485391f685b4ae297821e21f [0,1,0,0,0,0|2,0,1]=4 208 B9R0.13 CC[C@H](NCCO)C(=O)N 3b8b40a08f0784848e957ed8fa1fd003 [0,1,0,0,0,0|2,0,1]=4 209 B9R0.13 CC[C@H](NCCO)C(=O)O 1c6b8d756acf8f1db276283748fda969 [0,1,0,0,0,0|2,0,1]=4 210 B9R0.13 CC[C@H](NCCS)C(=O)N 1fe943a78a5557e1f383d0dd293a801c [0,1,0,0,0,0|2,0,1]=4 211 B9R0.13 CC[C@H](NCCS)C(=O)O c38a05c741bf6a8c2505ebb00a626765 [0,1,0,0,0,0|2,0,1]=4 212 B9R0.13 CC[C@H](NCOC)C(=O)N 9ddeabc9457b2d934bae311dafef643d [0,1,0,0,0,0|2,0,1]=4 213 B9R0.13 CC[C@H](NCOC)C(=O)O 8ff3b44341478cbcc46f6485e982ee40 [0,1,0,0,0,0|2,0,1]=4 214 B9R0.13 CC[C@H](NCSC)C(=O)N c506a023b16717655fa19ccbb8c02389 [0,1,0,0,0,0|2,0,1]=4 215 B9R0.13 CC[C@H](NCSC)C(=O)O 215e8fc56b12daa5ff5365fc69da45a2 [0,1,0,0,0,0|2,0,1]=4 216 B9R0.13 CC[C@H](OCCF)C(=O)O 516044a5d658494039eb40ae3a9e3d22 [0,1,0,0,0,0|2,0,1]=4 217 B9R0.13 CC[C@H](OCCS)C(=O)O d0432edc92842a426feefec6e58ff53e [0,1,0,0,0,0|2,0,1]=4 218 B9R0.13 CC[C@H](OCOC)C(=O)O 986ecf86f31a1bbe015cd3e780e6ebfd [0,1,0,0,0,0|2,0,1]=4 219 B9R0.13 CC[C@H](OCSC)C(=O)O f2917a5a83a3472b302dcc248b0acae0 [0,1,0,0,0,0|2,0,1]=4 220 B9R0.13 COCCN(C=O)C(C)C bd50571c1bcd53ab0105a2b5637e1626 [0,1,0,0,0,0|2,0,1]=4 221 B9R0.13 COCOC(C=O)C(C)C 578829bcc2f5be7b654a9fce0b976ff2 [0,1,0,0,0,0|2,0,1]=4 222 B9R0.26 C=CC(CC)OC(C)CC 31f6af364142e667d7a2879883ca6161 [0,1,0,0,0,0|2,0,1]=4 223 B9R0.26 CCC(C)NC(C=O)CC f01811ba4b7db39ad39306e196d5d5e0 [0,1,0,0,0,0|1,0,1]=3 224 B9R0.26 CCC(C)OC(C=O)CC fca18e20fe281be5e278242534dc6fb4 [0,1,0,0,0,0|1,0,1]=3 225 B9R0.26 CCC(C=O)NC(C)CO d20666353b7048d76250ac0df495ccc7 [0,1,0,0,0,0|2,0,1]=4 226 B9R0.26 CCC(C=O)N[C@@H](C)CC 86efd06e2688e7105a8bfb367c9bc60c [0,1,0,0,0,0|1,0,1]=3 227 B9R0.26 CCC(C=O)N[C@@H](C)CO 52f6d06a25219bf2f287178afffab1ac [0,1,0,0,0,0|2,0,1]=4 228 B9R0.26 CCC(C=O)N[C@H](C)CC 4144d86ddb199c66f3ef3399e570b615 [0,1,0,0,0,0|1,0,1]=3 229 B9R0.26 CCC(C=O)N[C@H](C)CO 504f18630cdb04ebb64f8473eb81c05c [0,1,0,0,0,0|2,0,1]=4 230 B9R0.26 CCC(C=O)OC(C)CF f039eefb4d7db89d2c59a6d7e7dbe19c [0,1,0,0,0,0|2,0,1]=4 231 B9R0.26 CCC(C=O)OC(C)CS bca415b4f793d39ce0de67a92382b805 [0,1,0,0,0,0|2,0,1]=4 232 B9R0.26 CCC(C=O)O[C@@H](C)CC d9e255ead10bcbf7d53a1b761eec1c87 [0,1,0,0,0,0|1,0,1]=3 233 B9R0.26 CCC(C=O)O[C@H](C)CC 2cefbe13abdc0740a404ca0a4a4ef9ed [0,1,0,0,0,0|1,0,1]=3 234 B9R0.26 CCC(C=O)O[C@H](C)CS 0e27da2bb25b35e1021c33bb52d88966 [0,1,0,0,0,0|2,0,1]=4 235 B9R0.26 CCC(O)CN(C=O)CC 64e7e2a9ab2b4074203b5452b29778e8 [0,1,0,0,0,0|1,0,1]=3 236 B9R0.37 CCC(C=O)N(C)CCF f5bb69b8226a59a1ddbb7896e4f06271 [0,1,0,0,0,0|2,0,1]=4 237 B9R0.37 CCC(C=O)N(C)CCO 9c4df3a60040e6f258ab8a97e88ed7ca [0,1,0,0,0,0|2,0,1]=4 238 B9R0.37 CCCN(C)C(C=O)CC 4862bf6cde65948ad4495cf6938c557d [0,1,0,0,0,0|1,0,1]=3 239 B9R0.37 CCN(C=O)C(C)CCO 7a309610cc1b9339501c2ffd01c206f3 [0,1,0,0,0,0|2,0,1]=4 240 B9R0.40 C=CC(CCC)OCCC c8cc8ff99b986a7fae9322886f38af88 [0,1,0,0,0,0|2,0,1]=4 241 B9R0.40 C=CC(CCCC)OCC debe70a957bdc231f9f5bc09ebab038f [0,1,0,0,0,0|1,0,2]=4 242 B9R0.40 C=CCN(CC)CCCC d814498b4a5b7479f8f036e4ba7f7ad9 [0,1,0,0,0,0|2,0,1]=4 243 B9R0.40 CCCCC(CO)NC=O f57b27fd178a9c21476ed36190092a88 [0,1,0,0,0,0|1,0,2]=4 244 B9R0.40 CCCCN(C=O)CC#N 0036f629ddeb7df8a5af9fb5b3447cec [0,1,0,0,0,0|1,0,2]=4 245 B9R0.40 CCCCN(C=O)CCC be8b9ffc5e8551c44e5ab58b1828a0f7 [0,1,0,0,0,0|1,0,1]=3 246 B9R0.40 CCCCN(C=O)CCO 17787dd5e4fe64ab300ff2422659355e [0,1,0,0,0,0|1,0,1]=3 247 B9R0.40 CCCCN(C=O)CCS a20b475fa5d1ceea20c555b8a71771e2 [0,1,0,0,0,0|1,0,1]=3 248 B9R0.40 CCCCN(CC)CC=O d871d9f188cada87ccdeb3afe3a7e109 [0,1,0,0,0,0|1,0,1]=3 249 B9R0.40 CCCC[C@@H](CO)NC=O 42c575253100261406d9404d8f784f62 [0,1,0,0,0,0|1,0,2]=4 250 B9R0.40 CCCC[C@H](CO)NC=O 8e288fee5f34d414b25597e2bfe4aa89 [0,1,0,0,0,0|1,0,2]=4 251 B9R0.40 CCCN(C=O)CCCO 85b67d56bdd81bcfbc08ec2560cc228c [0,1,0,0,0,0|2,0,1]=4 252 B9R0.40 CCCN(C=O)CCOC 22ff5d504b6268548239beab445591a5 [0,1,0,0,0,0|2,0,1]=4 253 B9R0.40 CCN(CC=O)CCCO 6a838cf9ff99de6f86e8529ebe9e73b7 [0,1,0,0,0,0|2,0,1]=4 254 B9R0.40 CCN(CC=O)CCOC d6f2cdbeafba6ea1e94d819f6bcc6527 [0,1,0,0,0,0|2,0,1]=4 255 B9R0.40 O=CN(CCO)CCCO 626dee79b46ba73891aab059598cfd8e [0,1,0,0,0,0|2,0,1]=4 256 B9R0.43 C=C(C)CNC(C=O)CC f68a94f669278b965b2e472dbef9fab2 [0,1,0,0,0,0|1,0,2]=4 257 B9R0.43 C=C(C)COC(C=O)CC 7102772e0eb1e6e8b07a7f98878fd33c [0,1,0,0,0,0|1,0,2]=4 258 B9R0.43 C=CC(CC)OCC(C)C 180b8a57279d5ad2988305efde262076 [0,1,0,0,0,0|2,0,1]=4 259 B9R0.43 CCC(C=O)NCC(=O)C e722b983dfd65925ee993463768d3a21 [0,1,0,0,0,0|1,0,2]=4 260 B9R0.43 CCC(C=O)NCC(C)C d5f37c44afcdf7f2cd65b85b8a5e9839 [0,1,0,0,0,0|1,0,1]=3 261 B9R0.43 CCC(C=O)NCC(C)O 85016c46bc62cbd89da50d89addedfbf [0,1,0,0,0,0|1,0,1]=3 262 B9R0.43 CCC(C=O)NCC(F)F 2442dc85e66e533be989bf755bbe0714 [0,1,0,0,0,0|2,0,1]=4 263 B9R0.43 CCC(C=O)NC[C@@H](C)O 4dc6688e0fe9dc353a5fb76036d3f23e [0,1,0,0,0,0|1,0,1]=3 264 B9R0.43 CCC(C=O)NC[C@H](C)O 7de3342ded8030d2d1218cb990fe247c [0,1,0,0,0,0|1,0,1]=3 265 B9R0.43 CCC(C=O)OCC(=O)C 204385582c9e72ba1ef04200142d0135 [0,1,0,0,0,0|1,0,2]=4 266 B9R0.43 CCC(C=O)OCC(C)C 1996280574ecbef191a65f05232405b5 [0,1,0,0,0,0|1,0,1]=3 267 B9R0.43 CCC(C=O)OCC(C)F 635b6baeb7060998640d72440c8a30fa [0,1,0,0,0,0|1,0,1]=3 268 B9R0.43 CCC(C=O)OCC(C)S d1ac7aa5a02766056bee6d6bb79b5f1b [0,1,0,0,0,0|1,0,1]=3 269 B9R0.43 CCC(C=O)OCC(F)F 2ccaee8e261dd54d54627a2c285bf202 [0,1,0,0,0,0|2,0,1]=4 270 B9R0.43 CCC(C=O)OC[C@@H](C)F c800f02840d0ff4f19166aa09bef68b7 [0,1,0,0,0,0|1,0,1]=3 271 B9R0.43 CCC(C=O)OC[C@H](C)F f6f73f2402af519c831c47eb7e16b8d7 [0,1,0,0,0,0|1,0,1]=3 272 B9R0.43 CCN(C=O)CCN(C)C 4aff10bbcbd362f4518bb1626f2d39d1 [0,1,0,0,0,0|2,0,1]=4 273 B9R0.50 C#CCCNC(C=O)CC 7d6e69da2b2c00011ac0086d49ebd6c2 [0,1,0,0,0,0|1,0,2]=4 274 B9R0.50 C#CCCOC(C=O)CC a6ca847dbae51ecce63dbdd5fa0600e6 [0,1,0,0,0,0|1,0,2]=4 275 B9R0.50 C/C=C/COC(C=O)CC dac43ee1082fa10742fbabcb72c8a561 [0,1,0,0,0,0|1,0,2]=4 276 B9R0.50 C/C=C\COC(C=O)CC 936199af03edbfff4213ddc7387d7ac7 [0,1,0,0,0,0|1,0,2]=4 277 B9R0.50 C=CC(CC)OCCCC c4ab6fc8dfc087891ae2542a53a4d2d9 [0,1,0,0,0,0|1,0,2]=4 278 B9R0.50 C=CC(CC)OCCCF 0b9ec9ffb01f997dc34b086d5976d57b [0,1,0,0,0,0|2,0,1]=4 279 B9R0.50 C=CC(CC)OCCCS 435a1c122437253a703ab7fba5017082 [0,1,0,0,0,0|2,0,1]=4 280 B9R0.50 C=CC(CC)OCCOC b9f63b6d573783f53532dd1b8db359d5 [0,1,0,0,0,0|2,0,1]=4 281 B9R0.50 C=CC(CC)OCCSC a8301f11f387823aac056b6c36774c89 [0,1,0,0,0,0|2,0,1]=4 282 B9R0.50 C=CC(CC)OCOCC 35d46e1176f4336b9ce258df41c5ebf0 [0,1,0,0,0,0|2,0,1]=4 283 B9R0.50 C=CCCNC(C=O)CC 88fb7fc74d4ffa1dd95483cbe964fddc [0,1,0,0,0,0|1,0,2]=4 284 B9R0.50 C=CCCOC(C=O)CC bb56ab03b94fb70c2ef5fecf3acee9ba [0,1,0,0,0,0|1,0,2]=4 285 B9R0.50 CC#CCNC(C=O)CC 52dcfa43d487c8ce7f1dc7a7e47a907d [0,1,0,0,0,0|1,0,2]=4 286 B9R0.50 CC#CCOC(C=O)CC d6ff4402c7004a403d43e772db9f61d0 [0,1,0,0,0,0|1,0,2]=4 287 B9R0.50 CC=CCNC(C=O)CC 8cc63021e827c5beecc4d54cce14b4a8 [0,1,0,0,0,0|1,0,2]=4 288 B9R0.50 CC=CCOC(C=O)CC d57081544b7ced90f91b2309947f9b7e [0,1,0,0,0,0|1,0,2]=4 289 B9R0.50 CCC(C=O)NCCC#N 31ced0d94b060eb5011e42f151ff7a7c [0,1,0,0,0,0|1,0,2]=4 290 B9R0.50 CCC(C=O)NCCCCl 7655b7204f3fc951221e75c8855f70b1 [0,1,0,0,0,0|1,0,1]=3 291 B9R0.50 CCC(C=O)NCCCO 7114e8a20f5b57955f2b3c6ae3807508 [0,1,0,0,0,0|1,0,1]=3 292 B9R0.50 CCC(C=O)NCCOC 51202fc24112e058d1efc429be3c4de7 [0,1,0,0,0,0|1,0,1]=3 293 B9R0.50 CCC(C=O)NCCON 71058c522352f1f30868742abb77b573 [0,1,0,0,0,0|2,0,1]=4 294 B9R0.50 CCC(C=O)NCCSC 523893d38d6c6c97e917442488ac314c [0,1,0,0,0,0|1,0,1]=3 295 B9R0.50 CCC(C=O)OCCC#N 526ac7bf376e63db554f5a9d87b620ec [0,1,0,0,0,0|1,0,2]=4 296 B9R0.50 CCC(C=O)OCCC=O 0d40cbc122613e23525f77d36df3c914 [0,1,0,0,0,0|1,0,2]=4 297 B9R0.50 CCC(C=O)OCCCF b4d2ad23f717620fbb89113cf8433238 [0,1,0,0,0,0|1,0,1]=3 298 B9R0.50 CCC(C=O)OCCCS ab315594c9f74c32affe7d4800d3825b [0,1,0,0,0,0|1,0,1]=3 299 B9R0.50 CCC(C=O)OCCOC 306abaf13c5f8136de1f191dfc93d423 [0,1,0,0,0,0|1,0,1]=3 300 B9R0.50 CCC(C=O)OCCSC 8780cba04cd3e16c25c511f3ea76bd12 [0,1,0,0,0,0|1,0,1]=3 301 B9R0.50 CCCCNC(C=O)CC 774ffd452d5f55c10b198ec0d6ccc481 [0,1,0,0,0,0|0,0,2]=3 302 B9R0.50 CCCCOC(C=O)CC a489a1c0e4d8ef9f526827c78fe09c6d [0,1,0,0,0,0|0,0,2]=3 303 B9R0.50 CCN(C=O)CCCCO 896c8ac6f073a59bbf85b1278bba30de [0,1,0,0,0,0|1,0,1]=3 304 B9R0.50 CCN(C=O)CCCOC b7b16cfedbda674de10c94d6ca2bd75f [0,1,0,0,0,0|1,0,1]=3 305 B9R0.50 CCOCC=C(CCl)CCl 4434b537963a55a296a5801947714ab3 [0,1,0,0,0,0|2,0,1]=4 306 B9R0.50 CCOCCN(C=O)CC eb3480f5c05b7016e9622312387acbc9 [0,1,0,0,0,0|1,0,1]=3 307 B9R1.1 CC1CCN(CC1)C=O cd1885c4b5a60655a81f4f7aac11f926 [0,0,0,1,0,0|1,0,1]=3 308 B9R1.1 CN1CCN(CC1)C=O 425b0a0854116b4d34ccf791328ead5e [0,0,0,1,0,0|2,0,1]=4 309 B9R1.1 O=CN1CCC(CC1)Cl 0f8885b1cbec326e72007210720ce685 [0,0,0,1,0,0|2,0,1]=4 310 B9R1.1 O=CN1CCC(CC1)F a8375fcd63170cc85e942f6f795820d2 [0,0,0,1,0,0|2,0,1]=4 311 B9R1.1 O=CN1CCC(CC1)I 09840532f9aae62595854240e3123351 [0,0,0,1,0,0|2,0,1]=4 312 B9R1.1 O=CN1CCC(CC1)O 9119fcb5a9f758b718576c8b3456fe09 [0,0,0,1,0,0|2,0,1]=4 313 B9R1.4 COCC1CCN1C=O c8b8b5b0fdbcc9317c0fd4bfbe42e156 [0,0,0,1,0,0|2,0,1]=4 314 B9R1.4 COC[C@@H]1CCN1C=O 4300e27a8cfd5eda3ca1f78e5c5877b6 [0,0,0,1,0,0|2,0,1]=4 315 B9R1.4 COC[C@H]1CCN1C=O dc6d58be0dbd75769c416bde7f6785a9 [0,0,0,1,0,0|2,0,1]=4 316 B9R1.4 O=CN1CCC1CCO c85a94914843f4f69a819dff95e34c1e [0,0,0,1,0,0|2,0,1]=4 317 B9R1.12 CCCOC1C=CCC1 c828ce14c6c0406fcb0a810d3d8e329e [0,0,0,1,0,0|2,0,1]=4 318 B9R1.15 CC1CCCCN1C=O 5edffbe7b981e62d376cf463cc81b5a0 [0,0,0,1,0,0|1,0,1]=3 319 B9R1.15 CC1COCCN1C=O 04bb76f81435fa2bb54099b84251b430 [0,0,0,1,0,0|2,0,1]=4 320 B9R1.15 C[C@@H]1CCCCN1C=O a3eec1c9235da9d654fdc4f1cd619716 [0,0,0,1,0,0|1,0,1]=3 321 B9R1.15 C[C@@H]1COCCN1C=O 0c7d5e9730004733a4641e1221ef05f8 [0,0,0,1,0,0|2,0,1]=4 322 B9R1.15 C[C@H]1CCCCN1C=O ca092eb4253ff1332fa8641d72ce7d5e [0,0,0,1,0,0|1,0,1]=3 323 B9R1.15 C[C@H]1COCCN1C=O 768699be3648dab4c6a8b1f24cf31cd1 [0,0,0,1,0,0|2,0,1]=4 324 B9R1.21 CCC1CCN(C1)C=O 511eb19254d8c6b5ffcb350a73123905 [0,0,0,1,0,0|1,0,1]=3 325 B9R1.21 COC1CCN(C1)C=O eb1635d26f811d0395c1eac377e68acf [0,0,0,1,0,0|2,0,1]=4 326 B9R1.21 CO[C@@H]1CCN(C1)C=O baabae39a3b9d32bd95572af9b467d63 [0,0,0,1,0,0|2,0,1]=4 327 B9R1.21 CO[C@H]1CCN(C1)C=O 1345142eebbefb838f95222c23ecea5c [0,0,0,1,0,0|2,0,1]=4 328 B9R1.21 O=CN1CCC(C1)CO 2a5ff912131a40733d604404f5dbc6a9 [0,0,0,1,0,0|2,0,1]=4 329 B9R1.21 O=CN1CC[C@@H](C1)CO 1b5e86f32647c6df6e45e506df19b6c8 [0,0,0,1,0,0|2,0,1]=4 330 B9R1.21 O=CN1CC[C@H](C1)CO c9a78c1ce4394e71f3a66edb1c5981a4 [0,0,0,1,0,0|2,0,1]=4 331 B9R1.39 CCCN[C@H]1CNC1=O d54fb2abe7455950df3e037f3ce21945 [0,0,0,1,0,0|2,0,1]=4 332 B9R1.39 CCCOC1CCC1=O 6747d0d4bf3ca4d2474fd2057207f365 [0,0,0,1,0,0|1,0,1]=3 333 B9R1.39 CCOCC1CCC1=O a06c32f97be82794ffc1ab53b750de7f [0,0,0,1,0,0|1,0,2]=4 334 B9R1.39 COCOC1CCC1=O cb47f60d015388daefcfa2b6dd0ad8dd [0,0,0,1,0,0|2,0,1]=4 335 B9R1.39 CSCOC1CCC1=O 7048061bc11cd0d22a524721b970ff41 [0,0,0,1,0,0|2,0,1]=4 336 B9R1.39 O=C1CCC1NCCI bbc9d8cfca0a3c47d4f408026b04c9ca [0,0,0,1,0,0|2,0,1]=4 337 B9R1.39 O=C1CCC1NCCO 6ba8bc28b11ed8fcaf6b4ee2f92451e5 [0,0,0,1,0,0|2,0,1]=4 338 B9R1.39 O=C1CCC1OCCF dd8162d9e9efdcef395b302d66117a1f [0,0,0,1,0,0|2,0,1]=4 339 B9R1.39 O=C1CCC1OCCS 623af281b20256d582f920eb3b4a5f07 [0,0,0,1,0,0|2,0,1]=4 340 B9R1.70 CCC(C=O)N1CCC1 a503ff2cab8a72ab63cf9de7901223af [0,0,0,1,0,0|1,0,1]=3 341 B9R1.70 CCN(C=O)C1CCC1 6d12deedf9cf0352c456907dbf34f697 [0,0,0,1,0,0|1,0,1]=3 342 B9R1.70 CCN(C=O)C1COC1 6dac9f769eb0fcbcc57047775f3cc5b9 [0,0,0,1,0,0|2,0,1]=4 343 B9R1.70 CCN(C=O)C1CSC1 d12a39c4d741d0504a82fe55e5adf0a0 [0,0,0,1,0,0|2,0,1]=4 344 B9R1.72 C=CC(CC)OC1CC1 86764b498dd09d3f2f075f803e7c03b3 [0,0,0,1,0,0|2,0,1]=4 345 B9R1.72 CCC(C=O)NC1CC1 728e7bf85ad8a20b99fce116173193d6 [0,0,0,1,0,0|1,0,1]=3 346 B9R1.72 CCC(C=O)OC1CC1 4831e40dc7715e22e084216cb3272795 [0,0,0,1,0,0|1,0,1]=3 347 B9R1.72 CCN(C=O)CC1CC1 99a2c6292d0ebe2aac1f90170dfc9802 [0,0,0,1,0,0|1,0,1]=3 348 B9R1.89 O=CN1CCCCCC1 4a543573026aecbb7f088b43cea970d5 [0,0,0,1,0,0|1,0,1]=3 349 B9R1.89 O=CN1CCCOCC1 ac69421f50e86b391ee77e2bd7abf564 [0,0,0,1,0,0|2,0,1]=4 350 B9R1.132 CC1C(CCN1C=O)O 6224b15dc429c09dff767b50cb0be4d8 [0,0,0,1,0,0|2,0,1]=4 351 B9R1.132 C[C@@H]1[C@@H](CCN1C=O)O 3c7246ef7fbf0f5b38ead5c398cfb526 [0,0,0,1,0,0|2,0,1]=4 352 B9R1.132 C[C@H]1[C@H](CCN1C=O)O d9842832849031601c0df07d9d01d0a4 [0,0,0,1,0,0|2,0,1]=4 353 B9R1.193 CCOCC1(CC1)C=O 58bf56a9eb1828ebbe8ce2c226180359 [0,0,0,1,0,0|1,0,2]=4 354 B6R0.1 C=C(C=O)OCC 64c18fcc04a22b045ebc35a9eb4d4363 [2,0,0,0,0,0|1,0,1]=4 355 B6R0.1 CCCN(C)C=O f55d615150194d8a2881f113e75957ad [2,0,0,0,0,0|1,0,0]=3 356 B6R0.1 CCCN(C)CC 063caa89be0fdd356f6455d1751457ac [2,0,0,0,0,0|1,0,1]=4 357 B6R0.1 CCOC(C)C=O 4021b7076259f80e1751543881198165 [2,0,0,0,0,0|1,0,1]=4 358 B6R0.1 CN(C=O)CCF 566a91d7f905563b8be9527ff042caf1 [2,0,0,0,0,0|2,0,0]=4 359 B6R0.1 CN(C=O)CCO dd7ac64299075a3391875b374e6c88cd [2,0,0,0,0,0|2,0,0]=4 360 B6R0.4 C=C(C)CNCC ebc18c3c665b43c324efb5852b5613cc [2,0,0,0,0,0|1,0,1]=4 361 B6R0.4 C=C(C)COCC 6d74b37620be58d1bea5b1911ab2feb1 [2,0,0,0,0,0|1,0,1]=4 362 B6R0.4 CC(=O)NCCBr a50b84b8e00a5eea33926a7cde86e5c2 [2,0,0,0,0,0|2,0,0]=4 363 B6R0.4 CC(=O)NCCF 40474d3cc8ff0aef7c3ef76344b9eebb [2,0,0,0,0,0|2,0,0]=4 364 B6R0.4 CC(=O)NCCI baf3590450994f173452759880fb646a [2,0,0,0,0,0|2,0,0]=4 365 B6R0.4 CC(=O)NCCO c7b03ecf194f0f03f4d08fd319920ef5 [2,0,0,0,0,0|2,0,0]=4 366 B6R0.4 CC(=O)NCCS 3cdd66626928bc1a9bac11e682b344a1 [2,0,0,0,0,0|2,0,0]=4 367 B6R0.4 CCCNC(=O)C 2a730f252c249036b45b0d2d9cd73ca4 [2,0,0,0,0,0|1,0,0]=3 368 B6R0.4 CCNCC(=O)C f174d94c45d739e3b909d0bcb7f774b6 [2,0,0,0,0,0|1,0,1]=4 369 B6R0.4 CCOCC(=O)C 810b545b1a0c4af358d406c93928b4de [2,0,0,0,0,0|1,0,1]=4 370 B6R0.6 CCCCNC=O 1d6cf15c52b7bdddc1e5bbdb0b9deb3d [2,0,0,0,0,0|1,0,1]=4 371 B6R0.6 CCCCNCC 92b5580e2e0a5bde623d85d4114fa5b8 [2,0,0,0,0,0|1,0,1]=4 372 B6R0.6 CCCCOCC 95dd02bf16a1c429e6d73e015abd355f [2,0,0,0,0,0|1,0,1]=4 373 B6R0.6 CCCNCC=O 6f90aab08cc8a4799f8c9819fe03dcf0 [2,0,0,0,0,0|1,0,1]=4 374 B6R0.6 CCCNCCC 1b094650055fd0b18522f92a665c0499 [2,0,0,0,0,0|1,0,1]=4 375 B6R0.6 CCCOCC=O a311990c6ea11edb5945b3bbc64330c1 [2,0,0,0,0,0|1,0,1]=4 376 B6R0.6 CCCOCCC 0a4e87c7914309a78635e74e08d2777c [2,0,0,0,0,0|1,0,1]=4 377 B8R0.1 C#CCC(=O)NCCC 02e18d00f6cac127c3ba925ff7cc6fd1 [1,1,0,0,0,0|1,0,1]=4 378 B8R0.1 C/C=C/C(=O)NCCC 3112d70c0159afb044aaeb01584dde68 [1,1,0,0,0,0|1,0,1]=4 379 B8R0.1 C=CCC(=O)NCCC 0464f3619ee0131de1206f24520111fa [1,1,0,0,0,0|1,0,1]=4 380 B8R0.1 CC#CC(=O)NCCC f3929637650271102a5b6c505641e7e8 [1,1,0,0,0,0|1,0,1]=4 381 B8R0.1 CCCC(=O)NCCBr e3424ddfe0e4582b4445faadedeca9f3 [1,1,0,0,0,0|2,0,0]=4 382 B8R0.1 CCCC(=O)NCCF abd86ad1a4854f306fa4ec91802cd24f [1,1,0,0,0,0|2,0,0]=4 383 B8R0.1 CCCC(=O)NCCI effb943f4ec1dba1ee2232662d0cb367 [1,1,0,0,0,0|2,0,0]=4 384 B8R0.1 CCCC(=O)NCCO d2bc78e5bd2f73aa8619f010857f1926 [1,1,0,0,0,0|2,0,0]=4 385 B8R0.1 CCCC(=O)NCCS c2ef67720d0b2ef54134f82538ee13fd [1,1,0,0,0,0|2,0,0]=4 386 B8R0.1 CCCCC(C)NC=O 203907a44368850c8dee59ecad001a1f [1,1,0,0,0,0|0,0,2]=4 387 B8R0.1 CCCCN(C)CC=O 0b9f4b899180868f46e162e3fdd5a057 [1,1,0,0,0,0|1,0,1]=4 388 B8R0.1 CCCC[C@@H](C)NC=O 85ae0f7eb97c9ecc6858b3133cc13253 [1,1,0,0,0,0|0,0,2]=4 389 B8R0.1 CCCNC(=O)CC#N a35df4e334c2327f92e0bafe31098739 [1,1,0,0,0,0|1,0,1]=4 390 B8R0.1 CCCNC(=O)CC=O c387c4bc3ea86b21200effc59fe151db [1,1,0,0,0,0|1,0,1]=4 391 B8R0.1 CCCNC(=O)CCC 3a4ef615081398a2acfdf5d3349655c4 [1,1,0,0,0,0|1,0,0]=3 392 B8R0.1 CCCNC(=O)CCF 80cac466548133e31f593852e3638107 [1,1,0,0,0,0|1,0,0]=3 393 B8R0.1 CCCNC(=O)CCO 1e17d6cf040450a0042d7883a84b4d20 [1,1,0,0,0,0|1,0,0]=3 394 B8R0.1 CCCNC(=O)CCS 5ca47d6ccf33cee73df146cfd5794783 [1,1,0,0,0,0|1,0,0]=3 395 B8R0.1 CCCNC(=O)COC d992f0c3466a56e61d0974e6b6e8669f [1,1,0,0,0,0|1,0,0]=3 396 B8R0.1 CCCNC(=O)CON 9840c2139f1e78498e25b8fce4d164d2 [1,1,0,0,0,0|2,0,0]=4 397 B8R0.1 CCCNC(=O)CSC 6ae58cb75ea789964eebc3d4df556317 [1,1,0,0,0,0|1,0,0]=3 398 B8R0.1 CCCOC(=S)CCC 553859e26557f67ca84075cb05814f3e [1,1,0,0,0,0|1,1,0]=4 399 B8R0.1 CCNC(=O)COCC c84e7c49da6c2baea65be933f5b80bea [1,1,0,0,0,0|1,0,1]=4 400 B8R0.1 CCNCC(=O)NCC 85e3c6c463358c2ceb6c3f3c07ea189c [1,1,0,0,0,0|1,0,1]=4 401 B8R0.1 CCNCC(=O)OCC 13e479e123264c7bc2cd9986b04b4c24 [1,1,0,0,0,0|1,0,1]=4 402 B8R0.1 CCOCC(=O)OCC a71429e2784f27b770f80be9d4ceb826 [1,1,0,0,0,0|1,0,1]=4 403 B8R0.1 COCC(=O)NCCBr e1d7efa2beb897f6fe8c723e5fef1d8c [1,1,0,0,0,0|2,0,0]=4 404 B8R0.1 COCC(=O)NCCF 5b27f9df05a07da8459d8e50096ac5ef [1,1,0,0,0,0|2,0,0]=4 405 B8R0.1 COCC(=O)NCCI 555339bd86b0ca69dc4cdec31caa1894 [1,1,0,0,0,0|2,0,0]=4 406 B8R0.1 COCC(=O)NCCO 5ced7d6cbd9eed1c30b901e6485d694c [1,1,0,0,0,0|2,0,0]=4 407 B8R0.1 COCC(=O)NCCS 730709bdb2536a5f7519c33efb71b705 [1,1,0,0,0,0|2,0,0]=4 408 B8R0.1 CSCC(=O)NCCBr 98705a0f39eb077061bcbd29b0672e6a [1,1,0,0,0,0|2,0,0]=4 409 B8R0.1 CSCC(=O)NCCF dfda28d66fa36cfb5ce50a1350224197 [1,1,0,0,0,0|2,0,0]=4 410 B8R0.1 CSCC(=O)NCCI 7bfc8d164efaef654c34edd5d1d07835 [1,1,0,0,0,0|2,0,0]=4 411 B8R0.1 CSCC(=O)NCCO 8fe8e72aaf0bb9f5644b18e3c790996d [1,1,0,0,0,0|2,0,0]=4 412 B8R0.1 CSCC(=O)NCCS 0c7243c53eb1aa5322c2775032ee2b33 [1,1,0,0,0,0|2,0,0]=4 413 B8R0.1 O=C(CCF)NCCBr 4e6a83a04fff0ae2002d06f5532a71cf [1,1,0,0,0,0|2,0,0]=4 414 B8R0.1 O=C(CCF)NCCF 3ee47b2b4a969933bf6a2b7769d886d8 [1,1,0,0,0,0|2,0,0]=4 415 B8R0.1 O=C(CCF)NCCI 0514d32be9a459d35ff2d3dd8e59c8c1 [1,1,0,0,0,0|2,0,0]=4 416 B8R0.1 O=C(CCF)NCCO 8a006b90c0f677be977fd587da748001 [1,1,0,0,0,0|2,0,0]=4 417 B8R0.1 O=C(CCF)NCCS cc499bcf14cc4ef20c4a540fd4249535 [1,1,0,0,0,0|2,0,0]=4 418 B8R0.1 O=C(CCO)NCCBr 0598e39f87524871b714a958e56557af [1,1,0,0,0,0|2,0,0]=4 419 B8R0.1 O=C(CCO)NCCF fc3c58338add0c048e7e192017336dc4 [1,1,0,0,0,0|2,0,0]=4 420 B8R0.1 O=C(CCO)NCCI f4b9eac1b1d1ab1205b4f68c01e683b0 [1,1,0,0,0,0|2,0,0]=4 421 B8R0.1 O=C(CCO)NCCO baa85bba8951a71c692dae57f4f0b055 [1,1,0,0,0,0|2,0,0]=4 422 B8R0.1 O=C(CCO)NCCS 67e704856b61f7f4ce061f14d041dc6c [1,1,0,0,0,0|2,0,0]=4 423 B8R0.1 O=C(CCS)NCCBr 0eb47b0aecf2287af30d9b3e94e8bc58 [1,1,0,0,0,0|2,0,0]=4 424 B8R0.1 O=C(CCS)NCCF b7e186cad638003cfed1aa574b20f812 [1,1,0,0,0,0|2,0,0]=4 425 B8R0.1 O=C(CCS)NCCI 56f9d8039c6ce5f07f13c307d4e588bf [1,1,0,0,0,0|2,0,0]=4 426 B8R0.1 O=C(CCS)NCCO 41c5fbd04fe40888bf540f13522d8b85 [1,1,0,0,0,0|2,0,0]=4 427 B8R0.1 O=C(CCS)NCCS a425fac0fa57c463ae17426b0d0c8bcc [1,1,0,0,0,0|2,0,0]=4 428 B8R0.3 CCC(=O)N(C)CCF 318a2530a556961418490c44b6c90fdd [1,1,0,0,0,0|2,0,0]=4 429 B8R0.3 CCC(=O)N(C)CCO e0dd9f4a6beab4473ee465efb09f2b8e [1,1,0,0,0,0|2,0,0]=4 430 B8R0.3 CCCC(=O)N(C)CC d5f34bd9db3ccc82fc95365990f29579 [1,1,0,0,0,0|1,0,1]=4 431 B8R0.3 CCCN(C)C(=O)C=O ae9046810fc57b836f1225fb4fa409a0 [1,1,0,0,0,0|2,0,0]=4 432 B8R0.3 CCCN(C)C(=O)CC ad1ab8a0f5c07e6ab73ee22aeb9c71a9 [1,1,0,0,0,0|1,0,0]=3 433 B8R0.3 CCCN(C)C(=O)CF 080c0d4ce746cadf5e3f0d9a56835299 [1,1,0,0,0,0|2,0,0]=4 434 B8R0.3 CCCN(C)C(=O)CO daa5d896fade5a1be51c39257fa3d5b8 [1,1,0,0,0,0|2,0,0]=4 435 B8R0.3 CCCN(C)C(=O)CS bcfb0bbfdb716f32aeb6ae13debe4701 [1,1,0,0,0,0|2,0,0]=4 436 B8R0.3 CCCN(C)C(C)C=O e6473a1a6d02a5e82b6c038acd576da0 [1,1,0,0,0,0|1,0,1]=4 437 B8R0.3 CCCN(C)[C@H](C)C=O 3790552277429781db5f53610a8878f0 [1,1,0,0,0,0|1,0,1]=4 438 B8R0.6 C#C/C(=C/COCC)/C 4ab1bd2abe7358459c967af9735bb0e3 [1,1,0,0,0,0|1,0,1]=4 439 B8R0.6 C#C/C(=C\COCC)/C 7123009ec411a028193e4a6f537a0b69 [1,1,0,0,0,0|1,0,1]=4 440 B8R0.6 C#CCCNC(=O)CC 675df9b37ab5c9ee6d5c9db4e0b3cee9 [1,1,0,0,0,0|1,0,1]=4 441 B8R0.6 C=C(C=O)OCCCC 6ce71ca855175b3f8b8b50951f61cb4c [1,1,0,0,0,0|0,0,2]=4 442 B8R0.6 C=C(C=O)OCCCF 0eb811d6f95a63d3bfd1c30c0420353a [1,1,0,0,0,0|1,0,1]=4 443 B8R0.6 C=C(C=O)OCCCS f4c5b5b4eb066d1dde7e640ae8b83d6c [1,1,0,0,0,0|1,0,1]=4 444 B8R0.6 C=C(C=O)OCCOC 8adae63bd2505248918f320832a88b6d [1,1,0,0,0,0|1,0,1]=4 445 B8R0.6 C=C(C=O)OCCSC bcf62c6c6fadd7ac5b12dbbe58c89f04 [1,1,0,0,0,0|1,0,1]=4 446 B8R0.6 C=C(C=O)OCOCC a43dcefe7b49a952ac6bc79bdf8dad34 [1,1,0,0,0,0|1,0,1]=4 447 B8R0.6 C=C(CC)CNCCBr 2997f31300e075e12280de78a538d6f2 [1,1,0,0,0,0|1,0,1]=4 448 B8R0.6 C=C(CC)CNCCC 13f11be9634d172790672a2fd9a9840c [1,1,0,0,0,0|0,0,1]=3 449 B8R0.6 C=C(CC)CNCCF 85aeaea14bf77498afd0be50514993fb [1,1,0,0,0,0|1,0,1]=4 450 B8R0.6 C=C(CC)CNCCI 9c0b35da1e0c58b009e99741b9bb42bf [1,1,0,0,0,0|1,0,1]=4 451 B8R0.6 C=C(CC)CNCCO 223a30784a1107a501d92d7e0122084b [1,1,0,0,0,0|1,0,1]=4 452 B8R0.6 C=C(CC)CNCCS 1b35fc01c4a35914bb8ff69eeb12966e [1,1,0,0,0,0|1,0,1]=4 453 B8R0.6 C=C(CC)COCCC 9a03753bc1b5bbc7ba706f1688ccd4c0 [1,1,0,0,0,0|0,0,1]=3 454 B8R0.6 C=C(CC)COCCF e29bcc08014545601ec41df77fd3afb1 [1,1,0,0,0,0|1,0,1]=4 455 B8R0.6 C=C(CC)COCCS 1954896189fc03c4d7a15c9e17b08731 [1,1,0,0,0,0|1,0,1]=4 456 B8R0.6 C=C(CC)COCOC 8620d2b3e026d934a9f25c9b8e5eed2b [1,1,0,0,0,0|1,0,1]=4 457 B8R0.6 C=C(CNCCC)OC 087b8e9db7c5cf69f544a95d2e04b5df [1,1,0,0,0,0|1,0,1]=4 458 B8R0.6 C=C(CO)CNCCC 1a3d72efe9d3ce84e285b2c8b91ed59f [1,1,0,0,0,0|1,0,1]=4 459 B8R0.6 C=C(COCCC)OC 35a576a479e84b27dbf4c71b4925086f [1,1,0,0,0,0|1,0,1]=4 460 B8R0.6 C=CCCNC(=O)CC ff184ef1399f6dc8c7e919b7f0c5c0dc [1,1,0,0,0,0|1,0,1]=4 461 B8R0.6 CC#CCNC(=O)CC 6d9ddda364502c2ffe7bd0b913f40e69 [1,1,0,0,0,0|1,0,1]=4 462 B8R0.6 CC(C=O)NCCCCl 0d8db3a83469f62234c1856a431acaf4 [1,1,0,0,0,0|1,0,1]=4 463 B8R0.6 CC(C=O)NCCCO f3e3ec90d7bece69f286a3910d2673a3 [1,1,0,0,0,0|1,0,1]=4 464 B8R0.6 CC(C=O)OCCCF 408a8a894fa836110edbe4772bda1c05 [1,1,0,0,0,0|1,0,1]=4 465 B8R0.6 CC(C=O)OCCCS 1b21635ff592fc3c755d4caa250cdcb4 [1,1,0,0,0,0|1,0,1]=4 466 B8R0.6 CC=CCNC(=O)CC 0567aadeecba276bde20c091c56d95d3 [1,1,0,0,0,0|1,0,1]=4 467 B8R0.6 CCC(=O)CNCCBr 4ae86c97534187fa67e366dfd1eebd3b [1,1,0,0,0,0|1,0,1]=4 468 B8R0.6 CCC(=O)CNCCF 0bc469d08994cf5b5fbc36250b4ccf28 [1,1,0,0,0,0|1,0,1]=4 469 B8R0.6 CCC(=O)CNCCI 652e280753f4ad7ee550469669c66e91 [1,1,0,0,0,0|1,0,1]=4 470 B8R0.6 CCC(=O)CNCCO c42e5d5f257b37e8ba7acbbae4993f31 [1,1,0,0,0,0|1,0,1]=4 471 B8R0.6 CCC(=O)CNCCS 5d6e1d449d9df5ddcd81a9e54a1f9bcc [1,1,0,0,0,0|1,0,1]=4 472 B8R0.6 CCC(=O)COCCF 42452841604a6e08503574a608b88150 [1,1,0,0,0,0|1,0,1]=4 473 B8R0.6 CCC(=O)COCCS 361d7f9395122f7ce5b0a13a0b0a8b7e [1,1,0,0,0,0|1,0,1]=4 474 B8R0.6 CCC(=O)COCOC 2080604d4fba0b9d8e850f3f84775a84 [1,1,0,0,0,0|1,0,1]=4 475 B8R0.6 CCC(=O)COCSC 20ce94165e7ab9ceae1e7c23a6d6840a [1,1,0,0,0,0|1,0,1]=4 476 B8R0.6 CCC(=O)NCCC#N 48cc6a86c0c6f5553ba199e61ccae9bf [1,1,0,0,0,0|1,0,1]=4 477 B8R0.6 CCC(=O)NCCCCl 8c01153ec31ae9cc62389708147e768e [1,1,0,0,0,0|1,0,0]=3 478 B8R0.6 CCC(=O)NCCCO f98fa75986b7788f9e80577d0f4b70ab [1,1,0,0,0,0|1,0,0]=3 479 B8R0.6 CCC(=O)NCCOC 23e877e020a2c5b2736fc6a95b7c4f02 [1,1,0,0,0,0|1,0,0]=3 480 B8R0.6 CCC(=O)NCCON 5aa4ed8a34147e98db8513bba6021eb1 [1,1,0,0,0,0|2,0,0]=4 481 B8R0.6 CCC(=O)NCCSC c0f9bf4f85b22a82daaa8b7807daec1c [1,1,0,0,0,0|1,0,0]=3 482 B8R0.6 CCCCCN(C)C=O 7b286f721a9c6a91b513309dd89d81c0 [1,1,0,0,0,0|1,0,1]=4 483 B8R0.6 CCCCNC(=O)C=O f208026ec74ccdc3b90201942951f82d [1,1,0,0,0,0|1,0,1]=4 484 B8R0.6 CCCCNC(=O)CC 285e0c69f0d3b13983c95eed26c8d721 [1,1,0,0,0,0|0,0,1]=3 485 B8R0.6 CCCCNC(=O)CF ccc4967a8e0a27400c7d0139924f7409 [1,1,0,0,0,0|1,0,1]=4 486 B8R0.6 CCCCNC(=O)CO a7ebdf854bf2900347fbb690e8e35978 [1,1,0,0,0,0|1,0,1]=4 487 B8R0.6 CCCCNC(=O)CS c89622d02eae8eb9fb1a47fc8bb6fb10 [1,1,0,0,0,0|1,0,1]=4 488 B8R0.6 CCCCNC(C)C=O c990dbf02cb6f8344eb0c4b5b1c5bf1a [1,1,0,0,0,0|0,0,2]=4 489 B8R0.6 CCCCN[C@H](C)C=O a8c57992d16bbaafdc8ecce6752aa20e [1,1,0,0,0,0|0,0,2]=4 490 B8R0.6 CCCCOC(C)C=O 3da272a8eb2eb108a59ce2b6af2c590a [1,1,0,0,0,0|0,0,2]=4 491 B8R0.6 CCCCO[C@H](C)C=O e407b3f8d89671debf616b7fa7dc0ddb [1,1,0,0,0,0|0,0,2]=4 492 B8R0.6 CCCNCC(=O)CC 5f434fb49a11666bfc9ba500f0cbcfca [1,1,0,0,0,0|0,0,1]=3 493 B8R0.6 CCCNCC(=O)CO c0d2ea34a02dfba5aebbad6447271711 [1,1,0,0,0,0|1,0,1]=4 494 B8R0.6 CCCNCC(=O)NC eb0d012f1c9ad7dec4f4287f037196b3 [1,1,0,0,0,0|1,0,1]=4 495 B8R0.6 CCCNCC(=O)OC 3b0745436e6aac5047a752faa3629f9d [1,1,0,0,0,0|1,0,1]=4 496 B8R0.6 CCCOC/C(=C/I)/C dc8f9e85d6578ff08977a63eedf944cc [1,1,0,0,0,0|1,0,1]=4 497 B8R0.6 CCCOCC(=CI)C b3b55d96dd2a298243d83d73d18b42c8 [1,1,0,0,0,0|1,0,1]=4 498 B8R0.6 CCCOCC(=O)CC 3f397a74b90866b03f1163a524097d68 [1,1,0,0,0,0|0,0,1]=3 499 B8R0.6 CCCOCC(=O)NC 58f4813a2cc9a1be45793f06ebe468ea [1,1,0,0,0,0|1,0,1]=4 500 B8R0.6 CCCOCC(=O)OC c6e77fb768013ea608698b73991c1be0 [1,1,0,0,0,0|1,0,1]=4 501 B8R0.6 CCNCCC(=O)NC 1e9b17ee02ba0e5b6aaaa347b3dcbe57 [1,1,0,0,0,0|1,0,1]=4 502 B8R0.6 CCNCCC(=O)OC bbd99f235af5ec44deb263c1fbced8c5 [1,1,0,0,0,0|1,0,1]=4 503 B8R0.6 CCOCCC(=O)NC 04f56cfd8d6885a7e2cb20782e900533 [1,1,0,0,0,0|1,0,1]=4 504 B8R0.6 CCOCCC(=O)OC 6c8ac8346f4b448f7b384f7ba30dc419 [1,1,0,0,0,0|1,0,1]=4 505 B8R0.6 CCOCCN(C)C=O 150e28d8c1b8a1d219f5e81a871d89a8 [1,1,0,0,0,0|1,0,1]=4 506 B8R0.6 CCOCOC(C)C=O 5cb78e20849eab5525da894ea8af7e0c [1,1,0,0,0,0|1,0,1]=4 507 B8R0.6 CN(C=O)CCCCO 7f619f7f07602d0a1e936e8e17f35450 [1,1,0,0,0,0|1,0,1]=4 508 B8R0.6 COCCCN(C)C=O 2dd2589e4563c98a7952d017ac8fb720 [1,1,0,0,0,0|1,0,1]=4 509 B8R0.6 COCCNC(=O)C=O 479a8f4f41f775ca2b6ce8e0cf56b6b2 [1,1,0,0,0,0|2,0,0]=4 510 B8R0.6 COCCNC(=O)CF a94db18f72aef2ec4c716239c23c2008 [1,1,0,0,0,0|2,0,0]=4 511 B8R0.6 COCCNC(=O)CO d671289b16ab36037d0c8d78118b8d68 [1,1,0,0,0,0|2,0,0]=4 512 B8R0.6 COCCNC(=O)CS 4b3174b27751971a4c745429c4f67196 [1,1,0,0,0,0|2,0,0]=4 513 B8R0.6 COCCNC(C)C=O b04cbb0a4cdf90a8659326a2cf39eb2e [1,1,0,0,0,0|1,0,1]=4 514 B8R0.6 COCCN[C@H](C)C=O 07f0113f3333cc700db2bdba012dc811 [1,1,0,0,0,0|1,0,1]=4 515 B8R0.6 COCCOC(C)C=O 2a67c0ff4cec0a7502a789fa42942c5d [1,1,0,0,0,0|1,0,1]=4 516 B8R0.6 COCCO[C@H](C)C=O 0298f0978f907e5e704651f508aa22b0 [1,1,0,0,0,0|1,0,1]=4 517 B8R0.6 CSCCNC(=O)C=O 7c8e4143d4355f24a51fc16bfc32d9a1 [1,1,0,0,0,0|2,0,0]=4 518 B8R0.6 CSCCNC(=O)CF 57944584a9e694467df2be000c951ad6 [1,1,0,0,0,0|2,0,0]=4 519 B8R0.6 CSCCNC(=O)CO 65e8216c2feaa293039f65fdae32ef6d [1,1,0,0,0,0|2,0,0]=4 520 B8R0.6 CSCCNC(=O)CS 2af34aeed751cd9e812792b0dc7e1060 [1,1,0,0,0,0|2,0,0]=4 521 B8R0.6 CSCCNC(C)C=O 286c4e550db8cb5119661e7962d8357e [1,1,0,0,0,0|1,0,1]=4 522 B8R0.6 CSCCN[C@H](C)C=O 768bae1d4934c91a34c8e3922ada33b7 [1,1,0,0,0,0|1,0,1]=4 523 B8R0.6 CSCCOC(C)C=O 8eef5310c6a16cef75ae44a0d99083e0 [1,1,0,0,0,0|1,0,1]=4 524 B8R0.6 CSCCO[C@H](C)C=O 9648e4c84642a1c7a6b140c2bb515679 [1,1,0,0,0,0|1,0,1]=4 525 B8R0.6 C[C@H](C=O)NCCCCl c9aa0b7b106e210f3da0b2a7b7b494b0 [1,1,0,0,0,0|1,0,1]=4 526 B8R0.6 C[C@H](C=O)NCCCO 8f472ce1305fcb3f83b357c37349df87 [1,1,0,0,0,0|1,0,1]=4 527 B8R0.6 C[C@H](C=O)OCCCF bdc4dc4cbe2cde044d3c10a313632ac7 [1,1,0,0,0,0|1,0,1]=4 528 B8R0.6 C[C@H](C=O)OCCCS 9971ffaf5c0c56ccc1660bb6715f0a74 [1,1,0,0,0,0|1,0,1]=4 529 B8R0.6 O=C(CF)NCCCCl 934b8e6ee889c80727ea8b7e3cae7f71 [1,1,0,0,0,0|2,0,0]=4 530 B8R0.6 O=C(CF)NCCCO f98476c767e724b095b3ceb9c47c191c [1,1,0,0,0,0|2,0,0]=4 531 B8R0.6 O=C(CO)NCCCCl 0c789d035d9d5ee643962906d4106d8a [1,1,0,0,0,0|2,0,0]=4 532 B8R0.6 O=C(CO)NCCCO 8d20a4d16a68281342a6c9aa794f8168 [1,1,0,0,0,0|2,0,0]=4 533 B8R0.6 O=C(CS)NCCCCl 17654daec75e68e56a406f3209f982cd [1,1,0,0,0,0|2,0,0]=4 534 B8R0.6 O=C(CS)NCCCO 9609fec7c0df8b51e8b529e1db0af996 [1,1,0,0,0,0|2,0,0]=4 535 B8R0.6 O=CC(=O)NCCCCl 64f1b2357217366e1bf6fcb0b40fa18e [1,1,0,0,0,0|2,0,0]=4 536 B8R0.6 O=CC(=O)NCCCO c7baf2e22cfdb49043ef0f7982d363e4 [1,1,0,0,0,0|2,0,0]=4 537 B8R0.8 C=C(C)C(=O)NCCC 2afd5e95dd9734696b78b1287c8e40c3 [1,1,0,0,0,0|1,0,1]=4 538 B8R0.8 CC(F)C(=O)NCCI 8a0369cfed1018ee828f00a2e04759cb [1,1,0,0,0,0|2,0,0]=4 539 B8R0.8 CC(F)C(=O)NCCO 5714b08de3ce4f90a90b82e533206732 [1,1,0,0,0,0|2,0,0]=4 540 B8R0.8 CC(F)C(=O)NCCS b39d80e8f07ef9221c0aa27f4f78917f [1,1,0,0,0,0|2,0,0]=4 541 B8R0.8 CC(O)C(=O)NCCF 91832489eb3405f9b8e768fbbfba918a [1,1,0,0,0,0|2,0,0]=4 542 B8R0.8 CC(O)C(=O)NCCI 5facf5561b562fe9df389faa15b577b9 [1,1,0,0,0,0|2,0,0]=4 543 B8R0.8 CC(O)C(=O)NCCO 6eae43744294511500b3285e9523f49e [1,1,0,0,0,0|2,0,0]=4 544 B8R0.8 CC(O)C(=O)NCCS e3260ab4fe247ca165e429cfa29782cf [1,1,0,0,0,0|2,0,0]=4 545 B8R0.8 CC(S)C(=O)NCCBr 126071a5e51b1b4d749efb8373eb23f1 [1,1,0,0,0,0|2,0,0]=4 546 B8R0.8 CC(S)C(=O)NCCF bd1e9d5683d56052e1e5cebd3f28f61a [1,1,0,0,0,0|2,0,0]=4 547 B8R0.8 CC(S)C(=O)NCCI d038059eeddb4ba2e800fd8c5ef18be5 [1,1,0,0,0,0|2,0,0]=4 548 B8R0.8 CC(S)C(=O)NCCO 3004d33b884c289d9839660aa24797db [1,1,0,0,0,0|2,0,0]=4 549 B8R0.8 CC(S)C(=O)NCCS 94de661ebd08e98861fe24c1031e17a2 [1,1,0,0,0,0|2,0,0]=4 550 B8R0.8 CCCCN(C)C(=O)C 88d1b3a05bc92700007f7660d5b84e56 [1,1,0,0,0,0|1,0,1]=4 551 B8R0.8 CCCNC(=O)C(=O)C 6616f52ba2db0bc51edea61ef0a86e36 [1,1,0,0,0,0|1,0,1]=4 552 B8R0.8 CCCNC(=O)C(=O)N 13b9d7246a4f43d25f7b6094605e09c1 [1,1,0,0,0,0|2,0,0]=4 553 B8R0.8 CCCNC(=O)C(C)F 26c3e292e8bf81a2774c215b87fe205c [1,1,0,0,0,0|1,0,0]=3 554 B8R0.8 CCCNC(=O)C(C)O 1c4275cc840c120b08a43a51d620d9a2 [1,1,0,0,0,0|1,0,0]=3 555 B8R0.8 CCCNC(=O)C(C)S 14ef60dcd7bf53e38f1b48b3ac0916eb [1,1,0,0,0,0|1,0,0]=3 556 B8R0.8 CCCNC(=O)C(F)F 071dc3f73dcbda1779f15b4fb1ae3271 [1,1,0,0,0,0|2,0,0]=4 557 B8R0.8 CCCNC(=O)C(O)O 1935daac569a1d73c1bfec746173b734 [1,1,0,0,0,0|2,0,0]=4 558 B8R0.8 CCCNC(=O)[C@@H](C)F 56745f27d02daa9bdc007207f8e02ad7 [1,1,0,0,0,0|1,0,0]=3 559 B8R0.8 CCCNC(=O)[C@@H](C)O dd45fdcbcb7fa52143ea0a380ce96207 [1,1,0,0,0,0|1,0,0]=3 560 B8R0.8 CCCNC(=O)[C@H](C)F a5efcba7d8423bf0c2ba50ff959f1165 [1,1,0,0,0,0|1,0,0]=3 561 B8R0.8 CCCNC(=O)[C@H](C)O b394796d74a22374522cf1e72768ff60 [1,1,0,0,0,0|1,0,0]=3 562 B8R0.8 CCCNC(C)C(=O)C 6c20f55484fcd603f7867a7e61cb3d7e [1,1,0,0,0,0|1,0,1]=4 563 B8R0.8 CCCNC(C)C(=O)N b2fc625c38ab8c709841d5c7372d4adf [1,1,0,0,0,0|1,0,1]=4 564 B8R0.8 CCCNC(C)C(=O)O 0bb3e38e8c1f88931a7fe4405f55b48f [1,1,0,0,0,0|1,0,1]=4 565 B8R0.8 CCCN[C@@H](C)C(=O)N 02dd18b86b56ba975cc40a36af64e278 [1,1,0,0,0,0|1,0,1]=4 566 B8R0.8 CCCN[C@@H](C)C(=O)O ef0370d06100564dc30ac92abf332f2f [1,1,0,0,0,0|1,0,1]=4 567 B8R0.8 CCCN[C@H](C)C(=O)N 99c67abc53ca408bd7a07e11216e0931 [1,1,0,0,0,0|1,0,1]=4 568 B8R0.8 CCCN[C@H](C)C(=O)O a8f2478751dbbc6b16132b4c2221ee6f [1,1,0,0,0,0|1,0,1]=4 569 B8R0.8 CCCOC(C)C(=O)C f2ac291285b506c3aa995ed18a49b95f [1,1,0,0,0,0|1,0,1]=4 570 B8R0.8 CCCOC(C)C(=O)N 960017c2975c35a65e9a919d09986bae [1,1,0,0,0,0|1,0,1]=4 571 B8R0.8 CCCOC(C)C(=O)O 1322f7b5e7c49e969524d97c6c86e731 [1,1,0,0,0,0|1,0,1]=4 572 B8R0.8 CCCO[C@@H](C)C(=O)N b8c1d5a3f29f788c88f92112d4a6c2ab [1,1,0,0,0,0|1,0,1]=4 573 B8R0.8 CCCO[C@@H](C)C(=O)O 6d34f6dc5dea70a72e909784584aa3d0 [1,1,0,0,0,0|1,0,1]=4 574 B8R0.8 CCCO[C@H](C)C(=O)N ca342d08f32f80afdbcc627d7b3ff5e4 [1,1,0,0,0,0|1,0,1]=4 575 B8R0.8 CCCO[C@H](C)C(=O)O c80966cb853c5464154df7c1b20e2fad [1,1,0,0,0,0|1,0,1]=4 576 B8R0.8 C[C@@H](F)C(=O)NCCI 3800b05361fad7ddfa1629fce9d20fa0 [1,1,0,0,0,0|2,0,0]=4 577 B8R0.8 C[C@@H](F)C(=O)NCCO d7174fc5c801463ae00a56232eff941a [1,1,0,0,0,0|2,0,0]=4 578 B8R0.8 C[C@@H](F)C(=O)NCCS 749fd7706d0ec6e0daade6c7e1cd3708 [1,1,0,0,0,0|2,0,0]=4 579 B8R0.8 C[C@@H](O)C(=O)NCCF a16414928601b2d6fce8684097146547 [1,1,0,0,0,0|2,0,0]=4 580 B8R0.8 C[C@@H](O)C(=O)NCCI 12bd14996ece1fc55d11b04df696dca9 [1,1,0,0,0,0|2,0,0]=4 581 B8R0.8 C[C@@H](O)C(=O)NCCO 35de042b0d140c54bda91feb1cdb127d [1,1,0,0,0,0|2,0,0]=4 582 B8R0.8 C[C@@H](O)C(=O)NCCS 4ea55b84babe82864696fb723221b8ee [1,1,0,0,0,0|2,0,0]=4 583 B8R0.8 C[C@H](F)C(=O)NCCI 5f656c51ae2dfaf00b4ef9a34c71ecd6 [1,1,0,0,0,0|2,0,0]=4 584 B8R0.8 C[C@H](F)C(=O)NCCO 3757477e5dbeaeb7bd7368631f26cff2 [1,1,0,0,0,0|2,0,0]=4 585 B8R0.8 C[C@H](F)C(=O)NCCS 768c95e6a0f1ac131a654b3bd54857ca [1,1,0,0,0,0|2,0,0]=4 586 B8R0.8 C[C@H](O)C(=O)NCCF 9cb153874861efa121a2a3efd64f7b30 [1,1,0,0,0,0|2,0,0]=4 587 B8R0.8 C[C@H](O)C(=O)NCCI fb8bee75ecdef23926c8dd96e5a8446c [1,1,0,0,0,0|2,0,0]=4 588 B8R0.8 C[C@H](O)C(=O)NCCO a8a620bab8ff63cc8d6c82762d26d446 [1,1,0,0,0,0|2,0,0]=4 589 B8R0.8 C[C@H](O)C(=O)NCCS 473cfe5bd499406c2c4ec28ce5acf099 [1,1,0,0,0,0|2,0,0]=4 590 B8R0.9 C=C(C)CNC(=O)CC 32c4b91879f81cdaadb4286b48c67a5d [1,1,0,0,0,0|1,0,1]=4 591 B8R0.9 C=C(C=O)OCC(C)C c5cdf695798fe36105735778dae3c7a0 [1,1,0,0,0,0|1,0,1]=4 592 B8R0.9 C=C(CC)COC(C)C 158b3c8f8440057d90f95fd6ad44dfdf [1,1,0,0,0,0|1,0,1]=4 593 B8R0.9 CC(C)CCN(C)C=O 516a2a022cb88171d447755eeb173861 [1,1,0,0,0,0|1,0,1]=4 594 B8R0.9 CC(C)CNC(=O)C=O b40cc57029845c8997b7aa8efc245b60 [1,1,0,0,0,0|2,0,0]=4 595 B8R0.9 CC(C)CNC(=O)CF 9eb01591588fc3f21824d07c6994c4ce [1,1,0,0,0,0|2,0,0]=4 596 B8R0.9 CC(C)CNC(=O)CO 748dd4a1556e9d036080c13c38338fdb [1,1,0,0,0,0|2,0,0]=4 597 B8R0.9 CC(C)CNC(=O)CS 24a37322ef0bc9a4c645dfd16fd4ed0f [1,1,0,0,0,0|2,0,0]=4 598 B8R0.9 CC(C)CNC(C)C=O 03449348422393b4e0bdd254036a8d58 [1,1,0,0,0,0|1,0,1]=4 599 B8R0.9 CC(C)CN[C@H](C)C=O 7c782c131d4d366690f182c8ead9a413 [1,1,0,0,0,0|1,0,1]=4 600 B8R0.9 CC(C)COC(C)C=O 0b8c6cf115c2322fa1674f79e1d3c4dd [1,1,0,0,0,0|1,0,1]=4 601 B8R0.9 CC(C)CO[C@H](C)C=O 5c45a366049badd5e36b154ae522c338 [1,1,0,0,0,0|1,0,1]=4 602 B8R0.9 CC(C=O)NC[C@@H](C)O d6dc2629bd4430c3bd67a8f081c11379 [1,1,0,0,0,0|1,0,1]=4 603 B8R0.9 CC(C=O)NC[C@H](C)O 7869ad4f3cbe7e38dea9b0d6c90c6141 [1,1,0,0,0,0|1,0,1]=4 604 B8R0.9 CC(C=O)OC[C@@H](C)F 44348d98ecea104d30821f34423bd4e0 [1,1,0,0,0,0|1,0,1]=4 605 B8R0.9 CC(C=O)OC[C@H](C)F 9637178c90bdbe6a1061955c6d3c749b [1,1,0,0,0,0|1,0,1]=4 606 B8R0.9 CC(F)COC(C)C=O a88f9eb602b828f938892defccbfe947 [1,1,0,0,0,0|1,0,1]=4 607 B8R0.9 CC(F)CO[C@H](C)C=O ab2b879912e041805a15c42eb98ff36e [1,1,0,0,0,0|1,0,1]=4 608 B8R0.9 CC(O)CCN(C)C=O 32af2d18851b8de7c2fbf9dc298410b8 [1,1,0,0,0,0|1,0,1]=4 609 B8R0.9 CC(O)CNC(=O)C=O a19c80ebbd3c5b0340f36c5c68b9e508 [1,1,0,0,0,0|2,0,0]=4 610 B8R0.9 CC(O)CNC(=O)CF d59c5e79c77aa7d822e3ecb11dcaef82 [1,1,0,0,0,0|2,0,0]=4 611 B8R0.9 CC(O)CNC(=O)CO 9be864f31d0f9194e8eb36240c465097 [1,1,0,0,0,0|2,0,0]=4 612 B8R0.9 CC(O)CNC(=O)CS dbff926c910e39aef95fc4a90e7f24a8 [1,1,0,0,0,0|2,0,0]=4 613 B8R0.9 CC(O)CNC(C)C=O 383ad87f47185da30b4a1f76d3fc6516 [1,1,0,0,0,0|1,0,1]=4 614 B8R0.9 CC(O)CN[C@H](C)C=O 8a0a71f4d2dc211ad7713289d588e2ee [1,1,0,0,0,0|1,0,1]=4 615 B8R0.9 CC(S)COC(C)C=O 3be1d5c17e9ab7f7a6674fa02b1f8eb9 [1,1,0,0,0,0|1,0,1]=4 616 B8R0.9 CC(S)CO[C@H](C)C=O 6171e06cfb5a5db48bbba1b7f4375842 [1,1,0,0,0,0|1,0,1]=4 617 B8R0.9 CCC(=O)COC(C)C 5c8d297b0416149f24332452b8f0f1e3 [1,1,0,0,0,0|1,0,1]=4 618 B8R0.9 CCC(=O)NCC(=O)C 5911502c3a8395822fc4c0959647e135 [1,1,0,0,0,0|1,0,1]=4 619 B8R0.9 CCC(=O)NCC(C)C 80d4e4c057e6f7b9eae8a2bfacaea014 [1,1,0,0,0,0|1,0,0]=3 620 B8R0.9 CCC(=O)NCC(C)O a0cefa62fd20423cdc1bf66278a42129 [1,1,0,0,0,0|1,0,0]=3 621 B8R0.9 CCC(=O)NCC(F)F 4cc4f3b720e259ef94d2e9ddeae5379b [1,1,0,0,0,0|2,0,0]=4 622 B8R0.9 CCC(=O)NC[C@@H](C)O a391cc3778995f10350211a29d249a09 [1,1,0,0,0,0|1,0,0]=3 623 B8R0.9 CCC(=O)NC[C@H](C)O 700448fc71267e87914b635955ddeec8 [1,1,0,0,0,0|1,0,0]=3 624 B8R0.9 C[C@@H](O)CNC(=O)C=O 2603ee2d0f069eae7661384f7ee697eb [1,1,0,0,0,0|2,0,0]=4 625 B8R0.9 C[C@@H](O)CNC(=O)CF 6a61f49e9c0d24ab6d4f46deb1461e7d [1,1,0,0,0,0|2,0,0]=4 626 B8R0.9 C[C@@H](O)CNC(=O)CO 9634e7d0b81aeff4d0ebcb0b1d05ff89 [1,1,0,0,0,0|2,0,0]=4 627 B8R0.9 C[C@@H](O)CNC(=O)CS 74f2114c184fa00cea5ec42867e295a6 [1,1,0,0,0,0|2,0,0]=4 628 B8R0.9 C[C@H](C=O)NC[C@@H](C)O e7c9c037399ac257f04fd04c210bf172 [1,1,0,0,0,0|1,0,1]=4 629 B8R0.9 C[C@H](C=O)OC[C@@H](C)F 1f5893c2e9eac3fefa5fe404e93fe70a [1,1,0,0,0,0|1,0,1]=4 630 B8R0.9 C[C@H](F)CO[C@H](C)C=O 02995616d1e99566d5726c66b80d922d [1,1,0,0,0,0|1,0,1]=4 631 B8R0.9 C[C@H](O)CNC(=O)C=O 93688556993d21a2fc23a4f3acf54052 [1,1,0,0,0,0|2,0,0]=4 632 B8R0.9 C[C@H](O)CNC(=O)CF de054442a5e1e940c151636e21f7cde2 [1,1,0,0,0,0|2,0,0]=4 633 B8R0.9 C[C@H](O)CNC(=O)CO a9cb6b1498a706bccaa6d180a5a461c7 [1,1,0,0,0,0|2,0,0]=4 634 B8R0.9 C[C@H](O)CNC(=O)CS a2cc47a92507f6d2ddfbe5205109d70d [1,1,0,0,0,0|2,0,0]=4 635 B8R0.9 C[C@H](O)CN[C@H](C)C=O 53b9e59588b92175a902e97408217ade [1,1,0,0,0,0|1,0,1]=4 636 B8R0.19 C=C(C=O)OC(C)CC c5f7d9036a8fdea0d25979e46bb39add [1,1,0,0,0,0|1,0,1]=4 637 B8R0.19 C=C(CC)CN(C)CC a5edac56bd516c3e08abe80274b2ef4e [1,1,0,0,0,0|1,0,1]=4 638 B8R0.19 CCC(=O)CN(C)CC 5ff470863ab78226aff558b26acaa6bb [1,1,0,0,0,0|1,0,1]=4 639 B8R0.19 CCC(=O)NC(C)CC 276f63d9911911bef583b63399d6babf [1,1,0,0,0,0|1,0,0]=3 640 B8R0.19 CCC(=O)NC(C)CO 31f73ee0dabaaa5a17015c929f45f2fd [1,1,0,0,0,0|2,0,0]=4 641 B8R0.19 CCC(=O)N[C@@H](C)CC 5015556f6119dada9330f459ef8b4a95 [1,1,0,0,0,0|1,0,0]=3 642 B8R0.19 CCC(=O)N[C@@H](C)CO a3bcc6db0615cc40ae6703cd20d3dc45 [1,1,0,0,0,0|2,0,0]=4 643 B8R0.19 CCC(=O)N[C@H](C)CC 0aeecce7ca86d9a6cf7c4003d6b8deb5 [1,1,0,0,0,0|1,0,0]=3 644 B8R0.19 CCC(=O)N[C@H](C)CO 3449d5b097ace6785d86df28155e11e4 [1,1,0,0,0,0|2,0,0]=4 645 B8R0.19 CCC(C)NC(=O)C=O d87e951102d767f8f5aa3b902ef92349 [1,1,0,0,0,0|2,0,0]=4 646 B8R0.19 CCC(C)NC(=O)CF be99e999222b335d1cb75f36b6d9cd45 [1,1,0,0,0,0|2,0,0]=4 647 B8R0.19 CCC(C)NC(=O)CO 33a44afa4449469b04b268f3719a3e59 [1,1,0,0,0,0|2,0,0]=4 648 B8R0.19 CCC(C)NC(=O)CS 2bbecd1472ce4a0c07af9c3693119c31 [1,1,0,0,0,0|2,0,0]=4 649 B8R0.19 CCC(C)NC(C)C=O 610b4a8ffb3807f31c76d2eb3d0b9780 [1,1,0,0,0,0|1,0,1]=4 650 B8R0.19 CCC(C)N[C@H](C)C=O bcb94071dd29361c15a01b7c88596d57 [1,1,0,0,0,0|1,0,1]=4 651 B8R0.19 CCC(C)OC(C)C=O eff298f26322e5014e51cb58e37ec95a [1,1,0,0,0,0|1,0,1]=4 652 B8R0.19 CCC(C)O[C@H](C)C=O 8b0db61f6f95e4e0ee500a8429036305 [1,1,0,0,0,0|1,0,1]=4 653 B8R0.19 CCC(O)CN(C)C=O a5ca11d122e7bb722666ea345a9e6e66 [1,1,0,0,0,0|1,0,1]=4 654 B8R0.19 CC[C@@H](C)NC(=O)C=O 21ac8ac32e78a362dc133e8e3bbda567 [1,1,0,0,0,0|2,0,0]=4 655 B8R0.19 CC[C@@H](C)NC(=O)CF 972ccf96eab46daa18ae78e952074e33 [1,1,0,0,0,0|2,0,0]=4 656 B8R0.19 CC[C@@H](C)NC(=O)CO 102bc53795a33daa61b0e6c2cdbc40e6 [1,1,0,0,0,0|2,0,0]=4 657 B8R0.19 CC[C@@H](C)NC(=O)CS 6576ffdd87c3ad0b66c846698b8c9218 [1,1,0,0,0,0|2,0,0]=4 658 B8R0.19 CC[C@@H](C)NC(C)C=O abf2de4d64d8367bf152827fa19c8747 [1,1,0,0,0,0|1,0,1]=4 659 B8R0.19 CC[C@@H](C)N[C@H](C)C=O 3342a1648b9263897ca0c454c43aa5e6 [1,1,0,0,0,0|1,0,1]=4 660 B8R0.19 CC[C@@H](C)OC(C)C=O 665da496f78ef9cbb93bd2fbabb6c4bb [1,1,0,0,0,0|1,0,1]=4 661 B8R0.19 CC[C@@H](C)O[C@H](C)C=O 89b33ea7698450df463669e4946abea4 [1,1,0,0,0,0|1,0,1]=4 662 B8R0.19 CC[C@H](C)NC(=O)C=O e638670223a406eb6167bccd4c1dfde1 [1,1,0,0,0,0|2,0,0]=4 663 B8R0.19 CC[C@H](C)NC(=O)CF 4effc7db6392db0aa027693c9704097d [1,1,0,0,0,0|2,0,0]=4 664 B8R0.19 CC[C@H](C)NC(=O)CO 7070ce3ef500a05442ee4538ea055e46 [1,1,0,0,0,0|2,0,0]=4 665 B8R0.19 CC[C@H](C)NC(=O)CS 035bd81fae7cc99474ceaac0a841b71d [1,1,0,0,0,0|2,0,0]=4 666 B8R0.19 CC[C@H](C)NC(C)C=O 018c527e97f5ffc308f69037c7d3a009 [1,1,0,0,0,0|1,0,1]=4 667 B8R0.19 CC[C@H](C)N[C@H](C)C=O d64bf9f3a5fe53c581afe2fb82ccfd54 [1,1,0,0,0,0|1,0,1]=4 668 B8R0.19 CC[C@H](C)OC(C)C=O 0ca2a7fbf13c00f26ded9cafaaef3a1d [1,1,0,0,0,0|1,0,1]=4 669 B8R0.19 CC[C@H](C)O[C@H](C)C=O 65f006b95602312ad77964961ea5b1e5 [1,1,0,0,0,0|1,0,1]=4 670 B8R0.15 C/C=C(\OCC)/C(=O)O ed3460e0bbe0f0b117145ec3b6c6a2c3 [1,1,0,0,0,0|1,0,1]=4 671 B8R0.15 CC(C)N(C=O)CCO 1344fe535ad12ab3e47a62841ebe0545 [1,1,0,0,0,0|2,0,0]=4 672 B8R0.15 CCCN(C=O)C(C)C 9cecb4b84cf566581125ea24b6665c66 [1,1,0,0,0,0|1,0,0]=3 673 B8R0.15 CCCN(CC)C(=O)C aaa318fb9f18848accdb9fbfd1cf28a8 [1,1,0,0,0,0|1,0,0]=3 674 B8R0.15 CCN(CCCl)C(=O)C 10dbbc5db7469d566a3048f4a18456a3 [1,1,0,0,0,0|2,0,0]=4 675 B8R0.15 CCN(CCO)C(=O)C 7d70110607468d775832ae23e9934092 [1,1,0,0,0,0|2,0,0]=4 676 B8R0.15 CCNC(CC)C(=O)N 4d4bbfd758d3d1406449d11a7d12f485 [1,1,0,0,0,0|1,0,1]=4 677 B8R0.15 CCNC(CC)C(=O)O 811bed40f759e9415b190b45b938f031 [1,1,0,0,0,0|1,0,1]=4 678 B8R0.15 CCN[C@@H](CC)C(=O)N 2ecd0466ce0392cdd810df37e1818d79 [1,1,0,0,0,0|1,0,1]=4 679 B8R0.15 CCN[C@@H](CC)C(=O)O ad39164e8fc918d5e58308b586171474 [1,1,0,0,0,0|1,0,1]=4 680 B8R0.15 CCN[C@H](CC)C(=O)O f7f7d1d8bf30d5fe2da91fe96021fe3c [1,1,0,0,0,0|1,0,1]=4 681 B8R0.15 CCOC(CC)C(=O)N cc881244ff63cfdfd012c91254de1749 [1,1,0,0,0,0|1,0,1]=4 682 B8R0.15 CCOC(CC)C(=O)O 382aa920ebdd6f2bbe768902640ad9e2 [1,1,0,0,0,0|1,0,1]=4 683 B8R0.15 CCO[C@@H](CC)C(=O)O 94f5195873e16b29cb1b8369b5daad14 [1,1,0,0,0,0|1,0,1]=4 684 B8R0.15 CCO[C@H](CC)C(=O)O b8c9ca25086a8c61d2a1f7aecbcec13d [1,1,0,0,0,0|1,0,1]=4 685 B8R0.16 C=C(C)CN(C=O)CC 5c2806787b75a62cfaae63fad2e8f32f [1,1,0,0,0,0|1,0,1]=4 686 B8R0.16 CCC(C=O)OC(C)C 64971e54da0bc5dd8c61368ff4482427 [1,1,0,0,0,0|1,0,1]=4 687 B8R0.16 CCN(C=O)CC(C)C a0d4f7e2b09765b708dd4f00ebe2d340 [1,1,0,0,0,0|1,0,0]=3 688 B8R0.16 CCN(C=O)CC(C)O 2437be87a2e81f295f09928becec40c6 [1,1,0,0,0,0|1,0,0]=3 689 B8R0.16 CCN(C=O)CC(F)F fef5c33754c2da4e91f59c606aea6814 [1,1,0,0,0,0|2,0,0]=4 690 B8R0.16 CCN(C=O)C[C@H](C)O 1f7ddfd4388d4f78b5345d6a6e9121a1 [1,1,0,0,0,0|1,0,0]=3 691 B8R0.20 CCC(C=O)N(C)CC 6cd7fea7d913ebc4dd115f632f3cdadb [1,1,0,0,0,0|1,0,1]=4 692 B8R0.20 CCN(C=O)C(C)CO 2b7554c35b7ee11c88f30889764dd701 [1,1,0,0,0,0|2,0,0]=4 693 B8R0.22 C=CC(CCC)OCC 83f7ef8d30a51e1e5c4db64e2faf14e7 [1,1,0,0,0,0|1,0,1]=4 694 B8R0.22 C=CCN(C=O)CCC 8915f0bd4ca3257466688dc7b8e97b40 [1,1,0,0,0,0|1,0,1]=4 695 B8R0.22 C=CCN(CC)CCC 7aebbfb3f75baa8bbab14ad7e2fc6fe2 [1,1,0,0,0,0|2,0,0]=4 696 B8R0.22 CCC(COC)NC=O 53905710bc62d6f533f443331f56e2bc [1,1,0,0,0,0|1,0,1]=4 697 B8R0.22 CCCC(CO)NC=O 41f5afc0296d6847bc820d8afc2b5787 [1,1,0,0,0,0|1,0,1]=4 698 B8R0.22 CCCN(C=O)CCC b8d16e0fe5e219991097fa7af52168fc [1,1,0,0,0,0|1,0,0]=3 699 B8R0.22 CCCN(C=O)CCO 05c7e3c748b410d220017381f77da8d3 [1,1,0,0,0,0|1,0,0]=3 700 B8R0.22 CCCN(CC)CC=O 10f91472c4600bbc31b6ae1008baca40 [1,1,0,0,0,0|1,0,0]=3 701 B8R0.22 CCC[C@@H](CO)NC=O 3c94a70b3970ecaf12f548b2138bdede [1,1,0,0,0,0|1,0,1]=4 702 B8R0.22 CCC[C@H](CO)NC=O 930af0e5fd8674584b8a8514e2d4657f [1,1,0,0,0,0|1,0,1]=4 703 B8R0.22 CCN(CC=O)CCCl 4ed90969909b022e2ac83da8060f9efc [1,1,0,0,0,0|2,0,0]=4 704 B8R0.22 CCN(CC=O)CCO 97dbc0347b45240747141aa67b4d0675 [1,1,0,0,0,0|2,0,0]=4 705 B8R0.22 O=CN(CCCl)CCCl 054ac3afb7fe32e280913aeabd7450cf [1,1,0,0,0,0|2,0,0]=4 706 B8R0.22 O=CN(CCO)CCO c0fe14cb4fe87b0f51f8507a4f962117 [1,1,0,0,0,0|2,0,0]=4 707 B10R0.17 CCCCN(C(=O)C)C(C)C d90320039e33fa2c6fedd5ab9efef7c6 [0,2,0,0,0,0|1,0,1]=4 708 B10R0.17 CCCNC(C(=O)N)C(C)C d46aa55de79e6c4083aa4f16bc76d74f [0,2,0,0,0,0|1,0,1]=4 709 B10R0.17 CCCNC(C(=O)O)C(C)C 56369fac0f0b6833242838b1d0fa6aee [0,2,0,0,0,0|1,0,1]=4 710 B10R0.17 CCCNC(C(=O)O)C(C)F c8e85179841305c035b14073f90cdae9 [0,2,0,0,0,0|1,0,1]=4 711 B10R0.17 CCCNC(C(=O)O)C(C)O 69a51e6d9f4a3e227816d6edf8ba177f [0,2,0,0,0,0|1,0,1]=4 712 B10R0.17 CCCNC(C(=O)O)[C@H](C)O c5dbe5cec3cd061333a0d2252ff02f83 [0,2,0,0,0,0|1,0,1]=4 713 B10R0.17 CCCN[C@@H](C(=O)O)C(C)C 052f745d43170dd6cb94fa2f7036a47a [0,2,0,0,0,0|1,0,1]=4 714 B10R0.17 CCCN[C@@H](C(=O)O)[C@@H](C)O fdfc97e456edf5dbb06efa95e081fa4b [0,2,0,0,0,0|1,0,1]=4 715 B10R0.17 CCCN[C@@H](C(=O)O)[C@H](C)O 366f251016b0acefb83253adf4da7897 [0,2,0,0,0,0|1,0,1]=4 716 B10R0.17 CCCN[C@H](C(=O)N)[C@@H](C)O 2cc31baf0b4bc8230513160aafe17775 [0,2,0,0,0,0|1,0,1]=4 717 B10R0.17 CCCN[C@H](C(=O)O)C(C)C 841b833691bf927e328d81ed728e6aaf [0,2,0,0,0,0|1,0,1]=4 718 B10R0.17 CCCN[C@H](C(=O)O)[C@@H](C)O e93af758b11c6091ae578a018ebbc21d [0,2,0,0,0,0|1,0,1]=4 719 B10R0.17 CCCN[C@H](C(=O)O)[C@H](C)O 31a0b8aa14f47922f6e78ab4ba819942 [0,2,0,0,0,0|1,0,1]=4 720 B10R0.17 CCCOC(C(=O)N)C(C)C 93feebfe940462f4717de4603334d106 [0,2,0,0,0,0|1,0,1]=4 721 B10R0.17 CCCOC(C(=O)O)C(C)C 41980c6a5668f53bb56227a93dfd0e85 [0,2,0,0,0,0|1,0,1]=4 722 B10R0.17 CCCO[C@@H](C(=O)O)C(C)C a195f1c0df7143bf7b3f853e7b0ec791 [0,2,0,0,0,0|1,0,1]=4 723 B10R0.17 CCCO[C@H](C(=O)O)C(C)C 47d0a19134425b843ee3910b5b49405a [0,2,0,0,0,0|1,0,1]=4 724 B10R0.53 C/C=C(\OC(C)CC)/C(=O)O 47b727b3b411d5e8198077e0ccff139a [0,2,0,0,0,0|1,0,1]=4 725 B10R0.53 CCC(C)NC(C=O)C(C)C 87f66fe2a63e907e16a477deedf2e31c [0,2,0,0,0,0|1,0,1]=4 726 B10R0.53 CCC(C)NC(CC)C(=O)N f292a23c86b5eb073bc52e0899771af4 [0,2,0,0,0,0|1,0,1]=4 727 B10R0.53 CCC(C)NC(CC)C(=O)O 121c3fb9a30268f123d6d3190804f844 [0,2,0,0,0,0|1,0,1]=4 728 B10R0.53 CCC(C)N[C@@H](CC)C(=O)N 5088761eeaa0be973aa38eed8b9aeab9 [0,2,0,0,0,0|1,0,1]=4 729 B10R0.53 CCC(C)N[C@@H](CC)C(=O)O 4aaca66297e489a22c9a682d57413cf6 [0,2,0,0,0,0|1,0,1]=4 730 B10R0.53 CCC(C)N[C@H](CC)C(=O)O 0b6019cf70cacda86e84e381365206c2 [0,2,0,0,0,0|1,0,1]=4 731 B10R0.53 CCC(C)OC(C=O)C(C)C 303602d1a11bd658def918fc1f209bf9 [0,2,0,0,0,0|1,0,1]=4 732 B10R0.53 CCC(C)OC(CC)C(=O)N 7bd59ffe34ed79503331d0bfda4a64f1 [0,2,0,0,0,0|1,0,1]=4 733 B10R0.53 CCC(C)OC(CC)C(=O)O 7740de7d2c69a0038f89c3ea8597fbfa [0,2,0,0,0,0|1,0,1]=4 734 B10R0.53 CCC(C)O[C@@H](CC)C(=O)O 8dc3a06e57223462fcd5cd1eb118c1a1 [0,2,0,0,0,0|1,0,1]=4 735 B10R0.53 CCC(C)O[C@H](CC)C(=O)O 29df69c9e71a75655ac074ec25a423ef [0,2,0,0,0,0|1,0,1]=4 736 B10R0.53 CCC(N[C@@H](C)CC)C(=O)N efc034c24e609c7502bbf70b23227844 [0,2,0,0,0,0|1,0,1]=4 737 B10R0.53 CCC(N[C@@H](C)CC)C(=O)O 1c1b3125fb9b5834370a0e3657a94aba [0,2,0,0,0,0|1,0,1]=4 738 B10R0.53 CCC(N[C@H](C)CC)C(=O)N 151007d414f940a18e470334286abc7f [0,2,0,0,0,0|1,0,1]=4 739 B10R0.53 CCC(N[C@H](C)CC)C(=O)O 5d433d84c45fbb9501e168dd4f20a3a8 [0,2,0,0,0,0|1,0,1]=4 740 B10R0.53 CCC(O)CN(CC)C(=O)C fabd47558de3ea84026452075d8daab2 [0,2,0,0,0,0|1,0,1]=4 741 B10R0.53 CCC(O[C@@H](C)CC)C(=O)N 5b0de60e723f37576bdcbbe05009ebf9 [0,2,0,0,0,0|1,0,1]=4 742 B10R0.53 CCC(O[C@@H](C)CC)C(=O)O d143ef38219a247c866ae763c43ead7d [0,2,0,0,0,0|1,0,1]=4 743 B10R0.53 CCC(O[C@H](C)CC)C(=O)N ed0daa08c126554bf56a43ec8be68cd5 [0,2,0,0,0,0|1,0,1]=4 744 B10R0.53 CCC(O[C@H](C)CC)C(=O)O ccad3deb9073ad90dfaa533a33d64657 [0,2,0,0,0,0|1,0,1]=4 745 B10R0.53 CC[C@@H](C)NC(C=O)C(C)C 68022fd0ad0ffe151c46734b5c3fdd11 [0,2,0,0,0,0|1,0,1]=4 746 B10R0.53 CC[C@@H](C)N[C@@H](CC)C(=O)O 608818a754f10ce3a38cebf2689c53a6 [0,2,0,0,0,0|1,0,1]=4 747 B10R0.53 CC[C@@H](C)N[C@H](CC)C(=O)O 193f5c2544a14e10655ed7740f0228c3 [0,2,0,0,0,0|1,0,1]=4 748 B10R0.53 CC[C@@H](C)OC(C=O)C(C)C 51f3a6ac0a5c2b4c45965dcdbd45fb05 [0,2,0,0,0,0|1,0,1]=4 749 B10R0.53 CC[C@@H](C)O[C@@H](CC)C(=O)O d8477ecf97bfc11bb44a57bd3d6a1bd3 [0,2,0,0,0,0|1,0,1]=4 750 B10R0.53 CC[C@@H](C)O[C@H](CC)C(=O)O a00d04ff2d6e8dcba48831d64618d08c [0,2,0,0,0,0|1,0,1]=4 751 B10R0.53 CC[C@H](C)NC(C=O)C(C)C 091eb2107c30ae8afd2d7f94ab54d7f4 [0,2,0,0,0,0|1,0,1]=4 752 B10R0.53 CC[C@H](C)N[C@H](CC)C(=O)O 7aa183c4f73962643e5870144f65cebf [0,2,0,0,0,0|1,0,1]=4 753 B10R0.53 CC[C@H](C)OC(C=O)C(C)C a942401d77ef8e019a2314d33b2304ce [0,2,0,0,0,0|1,0,1]=4 754 B10R0.53 CC[C@H](C)O[C@H](CC)C(=O)O c11898d08a65ab33eb13a3e94df80956 [0,2,0,0,0,0|1,0,1]=4 755 B10R0.53 CC[C@H](N[C@@H](C)CC)C(=O)O c3f0dc1a47dfe2c76fe5702c63f77ed0 [0,2,0,0,0,0|1,0,1]=4 756 B10R0.53 CC[C@H](O[C@@H](C)CC)C(=O)O e174d7daaf2ebc8823f139b0992fe07a [0,2,0,0,0,0|1,0,1]=4 757 B10R0.84 C/C=C(\OCC(C)C)/C(=O)O d4b3c9a6d039098eab6404cd3ffccdf6 [0,2,0,0,0,0|1,0,1]=4 758 B10R0.84 CC(C)C(C=O)NC[C@@H](C)O dd23c634ed4e208b11916ab02161e2b7 [0,2,0,0,0,0|1,0,1]=4 759 B10R0.84 CC(C)C(C=O)NC[C@H](C)O 59f6b8eb9d6843cc1327c8676fa6868d [0,2,0,0,0,0|1,0,1]=4 760 B10R0.84 CC(C)C(C=O)OC[C@@H](C)F 2d3e173726f21166f29d75ace3294085 [0,2,0,0,0,0|1,0,1]=4 761 B10R0.84 CC(C)C(C=O)OC[C@H](C)F aa4b47ae2d3fb974cf8b4e68fef4d63d [0,2,0,0,0,0|1,0,1]=4 762 B10R0.84 CC(C)CNC(C=O)C(C)C b446e81da63a3ad5779a705a4533d4fb [0,2,0,0,0,0|1,0,1]=4 763 B10R0.84 CC(C)COC(C=O)C(C)C 310d8ebfe6d8ddbd6d648b91eadb626a [0,2,0,0,0,0|1,0,1]=4 764 B10R0.84 CC(F)COC(C=O)C(C)C deb3acdab001b4ea811575e1808bf72f [0,2,0,0,0,0|1,0,1]=4 765 B10R0.84 CC(O)CNC(C=O)C(C)C 844e964c91cf90aa67f70a4f1fb4453a [0,2,0,0,0,0|1,0,1]=4 766 B10R0.84 CC(S)COC(C=O)C(C)C a97d816869ee913ee0c162e92160ef6a [0,2,0,0,0,0|1,0,1]=4 767 B10R0.84 CCC(NCC(C)C)C(=O)N d162d3cdccfa1b6641c05cd77fe90b2a [0,2,0,0,0,0|1,0,1]=4 768 B10R0.84 CCC(NCC(C)C)C(=O)O 114b240a44c15a74cf56e83680b30ac3 [0,2,0,0,0,0|1,0,1]=4 769 B10R0.84 CCC(NCC(C)O)C(=O)N dc2dbb80232635b73d0099631633c541 [0,2,0,0,0,0|1,0,1]=4 770 B10R0.84 CCC(NCC(C)O)C(=O)O 22a00ec8c45ef3b6fb2f9b05eb555ecb [0,2,0,0,0,0|1,0,1]=4 771 B10R0.84 CCC(NC[C@@H](C)O)C(=O)N 0e7ce2214dd354826f1f4e8a1253f170 [0,2,0,0,0,0|1,0,1]=4 772 B10R0.84 CCC(NC[C@@H](C)O)C(=O)O dd85a55ca89cd94b809a907573e9cde2 [0,2,0,0,0,0|1,0,1]=4 773 B10R0.84 CCC(NC[C@H](C)O)C(=O)N b4641a58045269139bd83d4444da1ae5 [0,2,0,0,0,0|1,0,1]=4 774 B10R0.84 CCC(NC[C@H](C)O)C(=O)O ced02c7fb2d10f4e7fac260649a1b32b [0,2,0,0,0,0|1,0,1]=4 775 B10R0.84 CCC(OCC(C)C)C(=O)N c9156df14e5fa8b806fd0d708920bd4c [0,2,0,0,0,0|1,0,1]=4 776 B10R0.84 CCC(OCC(C)C)C(=O)O faa749d1700fed3e16b71fc1c380eac3 [0,2,0,0,0,0|1,0,1]=4 777 B10R0.84 CCC(OCC(C)F)C(=O)N a236aea9c2061d2ef750f4e7fdc94c32 [0,2,0,0,0,0|1,0,1]=4 778 B10R0.84 CCC(OCC(C)F)C(=O)O 7b6a8ed3f12f2f6b52c2ca923859c5a6 [0,2,0,0,0,0|1,0,1]=4 779 B10R0.84 CCC(OCC(C)S)C(=O)N 0d54605a157627312265db035d83efd9 [0,2,0,0,0,0|1,0,1]=4 780 B10R0.84 CCC(OCC(C)S)C(=O)O 2b81dfa19fe0cb72f4227a37b700a926 [0,2,0,0,0,0|1,0,1]=4 781 B10R0.84 CCC(OC[C@@H](C)F)C(=O)N c4cea49c238e071f885e2359719a8a2c [0,2,0,0,0,0|1,0,1]=4 782 B10R0.84 CCC(OC[C@@H](C)F)C(=O)O 5aea3bead0c322a59bd16c87f17784c0 [0,2,0,0,0,0|1,0,1]=4 783 B10R0.84 CCC(OC[C@H](C)F)C(=O)N 5e1afa71cf6fe78f048e814b877ee1da [0,2,0,0,0,0|1,0,1]=4 784 B10R0.84 CCC(OC[C@H](C)F)C(=O)O 0ab1bb93e14b56f7672d0b1053c10efd [0,2,0,0,0,0|1,0,1]=4 785 B10R0.84 CC[C@@H](NCC(C)C)C(=O)O 07494be2063455ed00e473cffa855f68 [0,2,0,0,0,0|1,0,1]=4 786 B10R0.84 CC[C@@H](NCC(C)O)C(=O)O c855882b0dc47ff0a03cab5ca42318de [0,2,0,0,0,0|1,0,1]=4 787 B10R0.84 CC[C@@H](NC[C@@H](C)O)C(=O)O 1a527fcc143e287145671ac8e2c670ee [0,2,0,0,0,0|1,0,1]=4 788 B10R0.84 CC[C@@H](NC[C@H](C)O)C(=O)O 517f47e1a9882e6ad23aad0befce10d8 [0,2,0,0,0,0|1,0,1]=4 789 B10R0.84 CC[C@@H](OCC(C)C)C(=O)O 62187726b870b3ebb3e1cc0ad26926eb [0,2,0,0,0,0|1,0,1]=4 790 B10R0.84 CC[C@@H](OCC(C)F)C(=O)O 39353cb769ba9a9da862166147868d01 [0,2,0,0,0,0|1,0,1]=4 791 B10R0.84 CC[C@@H](OCC(C)S)C(=O)O 629b99cf6b8df20f513f03f5b6abd271 [0,2,0,0,0,0|1,0,1]=4 792 B10R0.84 CC[C@@H](OC[C@@H](C)F)C(=O)O 4c0fcbe088e9c155d3c2dfe84eeaf6e0 [0,2,0,0,0,0|1,0,1]=4 793 B10R0.84 CC[C@@H](OC[C@H](C)F)C(=O)O 4a157ea137189e36f13e53ed087be237 [0,2,0,0,0,0|1,0,1]=4 794 B10R0.84 CC[C@H](NCC(C)C)C(=O)N da8d0f31431b169924719c964be8f3f9 [0,2,0,0,0,0|1,0,1]=4 795 B10R0.84 CC[C@H](NCC(C)C)C(=O)O 62bb24ecb0dfc732ec57061f4e9662c5 [0,2,0,0,0,0|1,0,1]=4 796 B10R0.84 CC[C@H](NCC(C)O)C(=O)N 5c7229cca2afaee0824f8d187637a1a7 [0,2,0,0,0,0|1,0,1]=4 797 B10R0.84 CC[C@H](NCC(C)O)C(=O)O 178f24557cad45aedcd91d60d503d1f1 [0,2,0,0,0,0|1,0,1]=4 798 B10R0.84 CC[C@H](NC[C@@H](C)O)C(=O)N 812eeb47215082c01d6f0ce3167d04ab [0,2,0,0,0,0|1,0,1]=4 799 B10R0.84 CC[C@H](NC[C@@H](C)O)C(=O)O 34b58e7fce3b7c7a65e4d62428378533 [0,2,0,0,0,0|1,0,1]=4 800 B10R0.84 CC[C@H](NC[C@H](C)O)C(=O)N 9bb99c25d0cc3a084143dcdb9cb4d3ea [0,2,0,0,0,0|1,0,1]=4 801 B10R0.84 CC[C@H](NC[C@H](C)O)C(=O)O 8f3f7ed25ad09e22efaa7eba2ba9e68b [0,2,0,0,0,0|1,0,1]=4 802 B10R0.84 CC[C@H](OCC(C)C)C(=O)O 54347b8623971f09b240f71cba72af1d [0,2,0,0,0,0|1,0,1]=4 803 B10R0.84 CC[C@H](OCC(C)F)C(=O)O 8c8622fc7f0a0180f5c0d45aea3df02b [0,2,0,0,0,0|1,0,1]=4 804 B10R0.84 CC[C@H](OCC(C)S)C(=O)O abbfdf1429246c0a281de20ed17ca08e [0,2,0,0,0,0|1,0,1]=4 805 B10R0.84 CC[C@H](OC[C@@H](C)F)C(=O)O b569945e2f76f02c395b568ba64b4ddf [0,2,0,0,0,0|1,0,1]=4 806 B10R0.84 CC[C@H](OC[C@H](C)F)C(=O)O b23ea981bf84b69354a2d03932919418 [0,2,0,0,0,0|1,0,1]=4 807 B10R0.85 C#CC(=O)N(CC)CCCC cced24b5695688e9ece2cfd90388ae0e [0,2,0,0,0,0|1,0,1]=4 808 B10R0.85 C=CC(=O)N(CC)CCCC 4ea2e0b0f4ca9eaf64537528ee514d35 [0,2,0,0,0,0|1,0,1]=4 809 B10R0.85 CCCCN(CC)C(=O)C=O 67bb28f9f8b1abd8592cfb48435c82e2 [0,2,0,0,0,0|1,0,1]=4 810 B10R0.85 CCCCN(CC)C(=O)CC 5d38b3c23aabe3c68049c8de2efbbedd [0,2,0,0,0,0|1,0,1]=4 811 B10R0.85 CCCCN(CC)C(=O)CF 7b11bf04f80d439ba0c2e4f0c8c03476 [0,2,0,0,0,0|1,0,1]=4 812 B10R0.85 CCCCN(CC)C(=O)CO c2dd0f94260c1736e017b78b5f3791f1 [0,2,0,0,0,0|1,0,1]=4 813 B10R0.85 CCCCN(CC)C(=O)CS 56e58ad442d96d52ea1c064f4803066c [0,2,0,0,0,0|1,0,1]=4 814 B10R0.85 CCCCN(CC)C(C)C=O d17d0d2cbf70ce81056dbb813b789dcf [0,2,0,0,0,0|1,0,1]=4 815 B10R0.85 CCCCN(CC)[C@H](C)C=O 9ca7ab15d7e19cc923158a0834541763 [0,2,0,0,0,0|1,0,1]=4 816 B10R0.85 CCCNC(CC)C(=O)NC 06f314566b9db920d787f01b46bda3d3 [0,2,0,0,0,0|1,0,1]=4 817 B10R0.85 CCCNC(CC)C(=O)NO 9e4e6a0e75b5e7a95c7f03d5f8e6dedd [0,2,0,0,0,0|1,0,1]=4 818 B10R0.85 CCCNC(CC)C(=O)OC 7c9391c2b011d1a844e878d37c53c8de [0,2,0,0,0,0|1,0,1]=4 819 B10R0.85 CCCN[C@@H](CC)C(=O)OC 29b664aeaadc6d33629ac508d9be8d7d [0,2,0,0,0,0|1,0,1]=4 820 B10R0.85 CCCN[C@H](CC)C(=O)OC 600d8876107e26e24a8ac0e19aae5d96 [0,2,0,0,0,0|1,0,1]=4 821 B10R0.85 CCCOC(CC)C(=O)CC 1b758d1db96329780a6bed9a40a41196 [0,2,0,0,0,0|1,0,1]=4 822 B10R0.85 CCCOC(CC)C(=O)OC e73c3966229c76cecb77a48c05533324 [0,2,0,0,0,0|1,0,1]=4 823 B10R0.85 CCCO[C@@H](CC)C(=O)OC ebcf57738e956d021bd573d7c29f12f8 [0,2,0,0,0,0|1,0,1]=4 824 B10R0.85 CCCO[C@H](CC)C(=O)OC 3b1537b2e9ad8c49f909bceb4cdfa72e [0,2,0,0,0,0|1,0,1]=4 825 B10R0.86 C/C=C(\OCCCC)/C(=O)O adf87a46a4c97bdee6e27cc804da1a77 [0,2,0,0,0,0|0,0,2]=4 826 B10R0.86 C/C=C(\OCCCF)/C(=O)O edb0586874a68ac898020e347fd070f6 [0,2,0,0,0,0|1,0,1]=4 827 B10R0.86 C/C=C(\OCCCS)/C(=O)O 4d5461f93e3932c6085601e14bcc1830 [0,2,0,0,0,0|1,0,1]=4 828 B10R0.86 C/C=C(\OCCOC)/C(=O)O e14584ef900f31dea0f73e367deadd1a [0,2,0,0,0,0|1,0,1]=4 829 B10R0.86 C/C=C(\OCCSC)/C(=O)O cf7cb4b5126e55c08c950552d332a992 [0,2,0,0,0,0|1,0,1]=4 830 B10R0.86 C/C=C(\OCOCC)/C(=O)O edf32c12f19f0e2f41e0d4134f544a46 [0,2,0,0,0,0|1,0,1]=4 831 B10R0.86 CC(C)C(C=O)NCCCCl 738a950a6779b8f796bffa3605c857cb [0,2,0,0,0,0|1,0,1]=4 832 B10R0.86 CC(C)C(C=O)NCCCO 7817b0176284ce78e8e4103861e3d57b [0,2,0,0,0,0|1,0,1]=4 833 B10R0.86 CC(C)C(C=O)OCCCF 2f15f55e898642bd306e5774f56ab572 [0,2,0,0,0,0|1,0,1]=4 834 B10R0.86 CC(C)C(C=O)OCCCS aa108963c0629d173318d0e9ac3308af [0,2,0,0,0,0|1,0,1]=4 835 B10R0.86 CC(C)N(C=O)CCCCO 7e6ce9b28be78f74a1be43a38a8dc251 [0,2,0,0,0,0|1,0,1]=4 836 B10R0.86 CCC(NCCCCl)C(=O)N ea9cd7dae8f06aef5f8978f25de00168 [0,2,0,0,0,0|1,0,1]=4 837 B10R0.86 CCC(NCCCCl)C(=O)O 35dc13cda5eeed13f08fd31483a4bdee [0,2,0,0,0,0|1,0,1]=4 838 B10R0.86 CCC(NCCCF)C(=O)N 58662736061ed07250ba59e29d74a26f [0,2,0,0,0,0|1,0,1]=4 839 B10R0.86 CCC(NCCCF)C(=O)O 081f15c3b7bb0f40d73d030c9d35973c [0,2,0,0,0,0|1,0,1]=4 840 B10R0.86 CCC(NCCCO)C(=O)N 986ad8555474cc078e17a349a31d7b20 [0,2,0,0,0,0|1,0,1]=4 841 B10R0.86 CCC(NCCCO)C(=O)O 20262387b09f703d7e75acf7faaef936 [0,2,0,0,0,0|1,0,1]=4 842 B10R0.86 CCC(NCCCS)C(=O)N 37c81674ecdc929923ccfd2d3e07ec5b [0,2,0,0,0,0|1,0,1]=4 843 B10R0.86 CCC(NCCCS)C(=O)O 088ac4f3fb8a2cde32a9ae9929fe0679 [0,2,0,0,0,0|1,0,1]=4 844 B10R0.86 CCC(NCCOC)C(=O)N 541e49a8eea3ea1f976395f7a8f890bb [0,2,0,0,0,0|1,0,1]=4 845 B10R0.86 CCC(NCCOC)C(=O)O 15aeeb2669372a0c3aeadb44dae1a3b5 [0,2,0,0,0,0|1,0,1]=4 846 B10R0.86 CCC(NCCSC)C(=O)N 25af9c778470b2539159ef02e30ed5e3 [0,2,0,0,0,0|1,0,1]=4 847 B10R0.86 CCC(NCCSC)C(=O)O e3814169e25644a5c7a64d8a244e3aeb [0,2,0,0,0,0|1,0,1]=4 848 B10R0.86 CCC(OCCCF)C(=O)N 8532a39a061cd94da9bf52078f58d841 [0,2,0,0,0,0|1,0,1]=4 849 B10R0.86 CCC(OCCCF)C(=O)O 965190164712212a286277580092bac1 [0,2,0,0,0,0|1,0,1]=4 850 B10R0.86 CCC(OCCCS)C(=O)N 23e1eef6fe0f1ff1f6b007e86c71503a [0,2,0,0,0,0|1,0,1]=4 851 B10R0.86 CCC(OCCOC)C(=O)N e45cd51a645af6813b71b5d97a6d672d [0,2,0,0,0,0|1,0,1]=4 852 B10R0.86 CCC(OCCOC)C(=O)O 351d2b7f30941fa7de9d6d763061b3b7 [0,2,0,0,0,0|1,0,1]=4 853 B10R0.86 CCC(OCCSC)C(=O)N 417ed5312483c149604253ca649b4b6d [0,2,0,0,0,0|1,0,1]=4 854 B10R0.86 CCC(OCCSC)C(=O)O ef1577262500e4c9a56e785bd8a9f3df [0,2,0,0,0,0|1,0,1]=4 855 B10R0.86 CCCCCN(C=O)C(C)C f8b9cb176229a2f30a11b26203dd787e [0,2,0,0,0,0|1,0,1]=4 856 B10R0.86 CCCCNC(C=O)C(C)C 53c5906e9a024b3d2fd4168cb003077b [0,2,0,0,0,0|0,0,2]=4 857 B10R0.86 CCCCNC(CC)C(=O)N ac87fb65866c04d7aafd47c6125d7541 [0,2,0,0,0,0|0,0,2]=4 858 B10R0.86 CCCCNC(CC)C(=O)O cfca1c9e3ea778edda886fbfac44c654 [0,2,0,0,0,0|0,0,2]=4 859 B10R0.86 CCCCN[C@@H](CC)C(=O)N df7add428a3fc7553adcca2d85ed69c5 [0,2,0,0,0,0|0,0,2]=4 860 B10R0.86 CCCCN[C@@H](CC)C(=O)O 930ca8da4e7c5ae2754a07f3a4814639 [0,2,0,0,0,0|0,0,2]=4 861 B10R0.86 CCCCN[C@H](CC)C(=O)O 984c4215ac999f4ae79146bb9ff08103 [0,2,0,0,0,0|0,0,2]=4 862 B10R0.86 CCCCOC(C=O)C(C)C fcf764099bc043544b4be1283d912b71 [0,2,0,0,0,0|0,0,2]=4 863 B10R0.86 CCCCOC(CC)C(=O)N 0799293f439007569e4993ef1021f4c1 [0,2,0,0,0,0|0,0,2]=4 864 B10R0.86 CCCCOC(CC)C(=O)O 02c74ec6bc64a918c09890438800137f [0,2,0,0,0,0|0,0,2]=4 865 B10R0.86 CCCCO[C@@H](CC)C(=O)O 29d354ef6b46737ae3172c4a019d5dc2 [0,2,0,0,0,0|0,0,2]=4 866 B10R0.86 CCCCO[C@H](CC)C(=O)O 7fa13262dea5ed1da5ad15467b8332ee [0,2,0,0,0,0|0,0,2]=4 867 B10R0.86 CCCNC[C@H](CC)C(=O)O 6a574743cffa1b13d9ca61537185a6ff [0,2,0,0,0,0|0,0,2]=4 868 B10R0.86 CCN(CCCCO)C(=O)C 876c539a75f979a060f26a76a38f2cd8 [0,2,0,0,0,0|1,0,1]=4 869 B10R0.86 CCN(CCCOC)C(=O)C 8bba3601e41534d9078ff1038c500caa [0,2,0,0,0,0|1,0,1]=4 870 B10R0.86 CCOCCN(CC)C(=O)C acc81bd1c5329e990bd9e237645a8b2b [0,2,0,0,0,0|1,0,1]=4 871 B10R0.86 CCOCNC(CC)C(=O)N 47ecdb9f778d9975eed1d99589d01c24 [0,2,0,0,0,0|1,0,1]=4 872 B10R0.86 CCOCNC(CC)C(=O)O c8304c48520a745db34eb0bbfe7bd856 [0,2,0,0,0,0|1,0,1]=4 873 B10R0.86 CCOCN[C@@H](CC)C(=O)N 299d10a66a2cfe457230aaf2407d136d [0,2,0,0,0,0|1,0,1]=4 874 B10R0.86 CCOCN[C@@H](CC)C(=O)O d9c867bfeb3e0fce3cd2b95f488e1afc [0,2,0,0,0,0|1,0,1]=4 875 B10R0.86 CCOCN[C@H](CC)C(=O)O be0e449b6bee68157d98e2849efd6045 [0,2,0,0,0,0|1,0,1]=4 876 B10R0.86 CCOCOC(CC)C(=O)N c5ec9fdde689792e191fd21dae0c046d [0,2,0,0,0,0|1,0,1]=4 877 B10R0.86 CCOCOC(CC)C(=O)O 58cd7d059d6604ff100cddc4c5c80a5f [0,2,0,0,0,0|1,0,1]=4 878 B10R0.86 CCOCO[C@@H](CC)C(=O)O 6bedb28550bff7917930a93f403b144b [0,2,0,0,0,0|1,0,1]=4 879 B10R0.86 CCOCO[C@H](CC)C(=O)O 3b45a043eb74e38b42242caa32fc2db4 [0,2,0,0,0,0|1,0,1]=4 880 B10R0.86 CC[C@@H](NCCCCl)C(=O)O b95ded7aa381c3ec66292b6f75035d5c [0,2,0,0,0,0|1,0,1]=4 881 B10R0.86 CC[C@@H](NCCCF)C(=O)O 1b7b49f8c47461fc00af0ff235666d19 [0,2,0,0,0,0|1,0,1]=4 882 B10R0.86 CC[C@@H](NCCCO)C(=O)O c5329cbcfde5a41ab2c40dd574618fee [0,2,0,0,0,0|1,0,1]=4 883 B10R0.86 CC[C@@H](NCCCS)C(=O)O 62e4c2089daa31eea57ca934af514f00 [0,2,0,0,0,0|1,0,1]=4 884 B10R0.86 CC[C@@H](NCCOC)C(=O)O 7b6d809c423de89acc9b9f484356988a [0,2,0,0,0,0|1,0,1]=4 885 B10R0.86 CC[C@@H](NCCSC)C(=O)O ed620698884b1617274d17472309bf36 [0,2,0,0,0,0|1,0,1]=4 886 B10R0.86 CC[C@@H](OCCCF)C(=O)O 33c30ad9603151852e0ce89090a471ad [0,2,0,0,0,0|1,0,1]=4 887 B10R0.86 CC[C@@H](OCCOC)C(=O)O bda235caf7b9050b3b4b3ef20520846c [0,2,0,0,0,0|1,0,1]=4 888 B10R0.86 CC[C@@H](OCCSC)C(=O)O 64cbaffa809613063aabe330f93e8a68 [0,2,0,0,0,0|1,0,1]=4 889 B10R0.86 CC[C@H](NCCCCl)C(=O)O 17f6fb609ff8356aba1537fd9fc07079 [0,2,0,0,0,0|1,0,1]=4 890 B10R0.86 CC[C@H](NCCCF)C(=O)N 380ccb00e27effb2a50b5475ae4262f1 [0,2,0,0,0,0|1,0,1]=4 891 B10R0.86 CC[C@H](NCCCF)C(=O)O 862096f32cfe481aeb166eb0b175101f [0,2,0,0,0,0|1,0,1]=4 892 B10R0.86 CC[C@H](NCCCO)C(=O)N f705e2bb92af70f0cb9c0a86067f9ba2 [0,2,0,0,0,0|1,0,1]=4 893 B10R0.86 CC[C@H](NCCCO)C(=O)O cb151637c603016ff5187724cc4040d7 [0,2,0,0,0,0|1,0,1]=4 894 B10R0.86 CC[C@H](NCCCS)C(=O)N 6785bab0f383cf438b26d34d4c7ca699 [0,2,0,0,0,0|1,0,1]=4 895 B10R0.86 CC[C@H](NCCCS)C(=O)O 3716b7a10141909729e84c0b5182cf90 [0,2,0,0,0,0|1,0,1]=4 896 B10R0.86 CC[C@H](NCCOC)C(=O)N c7b45a19554949d8fb538e7746e36e7c [0,2,0,0,0,0|1,0,1]=4 897 B10R0.86 CC[C@H](NCCOC)C(=O)O b4291c452587f24e1226681f2dfdf520 [0,2,0,0,0,0|1,0,1]=4 898 B10R0.86 CC[C@H](NCCSC)C(=O)N ddf71732d2dc31920116b7e39ed76449 [0,2,0,0,0,0|1,0,1]=4 899 B10R0.86 CC[C@H](NCCSC)C(=O)O 7acb4528acf0593e200e6dc27750068a [0,2,0,0,0,0|1,0,1]=4 900 B10R0.86 CC[C@H](OCCCF)C(=O)O 3b4d9128f0d802cf6026c7c166ad2477 [0,2,0,0,0,0|1,0,1]=4 901 B10R0.86 CC[C@H](OCCOC)C(=O)O ced1c63c821b09d50a344430212ec69b [0,2,0,0,0,0|1,0,1]=4 902 B10R0.86 CC[C@H](OCCSC)C(=O)O bc4d150ea21fc242bdf68787558d9a90 [0,2,0,0,0,0|1,0,1]=4 903 B10R0.86 COCCCN(C=O)C(C)C 6ff5136701045fbf77fe50bc6f94170e [0,2,0,0,0,0|1,0,1]=4 904 B10R0.86 COCCNC(C=O)C(C)C b4e0d27c91827a33d90bc6dcc6efda5f [0,2,0,0,0,0|1,0,1]=4 905 B10R0.86 COCCOC(C=O)C(C)C 9af62e63f779a68cecaeecd6169fe158 [0,2,0,0,0,0|1,0,1]=4 906 B10R0.86 CSCCNC(C=O)C(C)C e3a34def855620ccc1ef5e59c0afc871 [0,2,0,0,0,0|1,0,1]=4 907 B10R0.86 CSCCOC(C=O)C(C)C db3e20fb3582bd213d93bd1696a7aede [0,2,0,0,0,0|1,0,1]=4 908 B10R0.88 CCCCC(NCC)C(=O)N c1258c9de45345833efaa8f5b9efa1e8 [0,2,0,0,0,0|0,0,2]=4 909 B10R0.88 CCCCC(NCC)C(=O)O 19afefdf9a0dc101c3e3fca215d9c7b1 [0,2,0,0,0,0|0,0,2]=4 910 B10R0.88 CCCCC(OCC)C(=O)O 0f352149ce74024fc046b5ca610f4e45 [0,2,0,0,0,0|0,0,2]=4 911 B10R0.88 CCCCN(CC=O)C(C)C 97c9333689b49bc1d681e1ba142f8428 [0,2,0,0,0,0|1,0,1]=4 912 B10R0.88 CCCCN(CCC)C(=O)C 25c7057490a6d91183978dc672f17466 [0,2,0,0,0,0|1,0,1]=4 913 B10R0.88 CCCCN(CCO)C(=O)C 5e1894dd96d61bcf269036be34701e2e [0,2,0,0,0,0|1,0,1]=4 914 B10R0.88 CCCCN(CCS)C(=O)C a596d59073c7e72333ee48187f3a9e6e [0,2,0,0,0,0|1,0,1]=4 915 B10R0.88 CCCC[C@@H](NCC)C(=O)O 95ad414be444c13b7955e67f44252ff1 [0,2,0,0,0,0|0,0,2]=4 916 B10R0.88 CCCC[C@@H](OCC)C(=O)O 6d2de7eeef8fa36ba16abc39c96c4de8 [0,2,0,0,0,0|0,0,2]=4 917 B10R0.88 CCCC[C@H](NCC)C(=O)O cf01ba2ece95c0be4aa1f2867e8d34b1 [0,2,0,0,0,0|0,0,2]=4 918 B10R0.88 CCCC[C@H](OCC)C(=O)O 735b82d55f6f8b61c7d0c4b06f432e62 [0,2,0,0,0,0|0,0,2]=4 919 B10R0.88 CCCNC(CCC)C(=O)C f0662deadff37b1fb5b9667fa11ca1f4 [0,2,0,0,0,0|1,0,1]=4 920 B10R0.88 CCCNC(CCC)C(=O)O 50a9c67e92808a13e00b7a95cac79abd [0,2,0,0,0,0|1,0,1]=4 921 B10R0.88 CCCNC(CCO)C(=O)C dfec94287a48f4b9ca980b9d05465a76 [0,2,0,0,0,0|1,0,1]=4 922 B10R0.88 CCCNC(CCO)C(=O)O 7ed6dedeeecd820ee5ab950bb6009c0d [0,2,0,0,0,0|1,0,1]=4 923 B10R0.88 CCCNC(CCS)C(=O)O c6c2eb1fdd26af94731694339f0dbaa7 [0,2,0,0,0,0|1,0,1]=4 924 B10R0.88 CCCNC(COC)C(=O)O b31db81e5952f2995006fecdbc455246 [0,2,0,0,0,0|1,0,1]=4 925 B10R0.88 CCCNC(CSC)C(=O)O 7c39f6490b89eed98864d30c0d663ddd [0,2,0,0,0,0|1,0,1]=4 926 B10R0.88 CCCN[C@@H](CCC)C(=O)O deca272af1b14ae79117b0449a49ed6b [0,2,0,0,0,0|1,0,1]=4 927 B10R0.88 CCCN[C@@H](CCO)C(=O)O 017a1fae83b5dd9c198dc69dff032fd7 [0,2,0,0,0,0|1,0,1]=4 928 B10R0.88 CCCN[C@@H](CCS)C(=O)O 4abff8e34b29b8a4c349ac7dfc6ed0d9 [0,2,0,0,0,0|1,0,1]=4 929 B10R0.88 CCCN[C@@H](COC)C(=O)O bc3171b8d9a8bc929843d58e41e2ab28 [0,2,0,0,0,0|1,0,1]=4 930 B10R0.88 CCCN[C@@H](CSC)C(=O)O a15c16ed5cfab7827503e38427dd3d3e [0,2,0,0,0,0|1,0,1]=4 931 B10R0.88 CCCN[C@H](CCC)C(=O)O 88c61f149b410c312dade3bddfaf922b [0,2,0,0,0,0|1,0,1]=4 932 B10R0.88 CCCN[C@H](CCO)C(=O)O 12005f0225024972172ca037c1caa189 [0,2,0,0,0,0|1,0,1]=4 933 B10R0.88 CCCN[C@H](CCS)C(=O)O c244592afedd3cf42db1538f4a56811f [0,2,0,0,0,0|1,0,1]=4 934 B10R0.88 CCCN[C@H](COC)C(=O)O 161e6df73f31b0dcef3a540a30235be1 [0,2,0,0,0,0|1,0,1]=4 935 B10R0.88 CCCN[C@H](CSC)C(=O)O c0d3c4865133b0e307b5fa9b0efbb1bb [0,2,0,0,0,0|1,0,1]=4 936 B10R0.88 CCCOC(CCC)C(=O)C 480f8e2665b22cb000fdef1e4315ca03 [0,2,0,0,0,0|1,0,1]=4 937 B10R0.88 CCCOC(CCC)C(=O)N 3fd12799f296847d58a31816c69ceb39 [0,2,0,0,0,0|1,0,1]=4 938 B10R0.88 CCCOC(CCC)C(=O)O b0344db7ef010f25677ad426e40779df [0,2,0,0,0,0|1,0,1]=4 939 B10R0.88 CCCOC(COC)C(=O)O d0cfcc4aa2947d441cedd1f31010c3df [0,2,0,0,0,0|1,0,1]=4 940 B10R0.88 CCCOC(CSC)C(=O)O 172e783728462059c97fecfdbb914635 [0,2,0,0,0,0|1,0,1]=4 941 B10R0.88 CCCO[C@@H](CCC)C(=O)O fa1d5f73df2c34baee44eb479404c5aa [0,2,0,0,0,0|1,0,1]=4 942 B10R0.88 CCCO[C@H](CCC)C(=O)O 75865b15351d0d421de5ac5dce0ceaa8 [0,2,0,0,0,0|1,0,1]=4 943 B10R0.101 CCCN(C)C(C=O)C(C)C 4d5a457b017d0968300ce824bc3e85cd [0,2,0,0,0,0|1,0,1]=4 944 B10R0.101 CCCN(C)C(CC)C(=O)N af4a493c35098186321355f9fc27e828 [0,2,0,0,0,0|1,0,1]=4 945 B10R0.101 CCCN(C)C(CC)C(=O)O aefd4f13213aa0cbf37f25858dcce031 [0,2,0,0,0,0|1,0,1]=4 946 B10R0.101 CCCN(C)[C@@H](CC)C(=O)O ece59ddef05e303cb9f6d2e6ca7f69d3 [0,2,0,0,0,0|1,0,1]=4 947 B10R0.101 CCCN(C)[C@H](CC)C(=O)O 1a927808e2275a649ba83318ab167cb5 [0,2,0,0,0,0|1,0,1]=4 948 B10R0.133 CCCNC(C)(CC)C(=O)N 415a093411c75e28bf50c9d2807911bd [0,2,0,0,0,0|1,0,1]=4 949 B10R0.133 CCCNC(C)(CC)C(=O)O 891534bebdc088d6819d97bebd465144 [0,2,0,0,0,0|1,0,1]=4 950 B10R0.133 CCCN[C@@](C)(CC)C(=O)O 8e4f288fc33f61ffd88aee819bbefc91 [0,2,0,0,0,0|1,0,1]=4 951 B10R0.133 CCCN[C@](C)(CC)C(=O)O e395b33a46bc68b7491c792c1f238a53 [0,2,0,0,0,0|1,0,1]=4 952 B10R0.29 CCC(O)CN(CC)CC=O 355d7707fafed49cd054045b1966d277 [0,2,0,0,0,0|1,0,1]=4 953 B10R0.34 CCC(C=O)NC(C)CCO 98ca57bee8341894b6e1cb663887363d [0,2,0,0,0,0|1,0,1]=4 954 B10R0.34 CCC(C=O)NC(C)COC f1e84c63b75a22f32894fff6a74e80de [0,2,0,0,0,0|1,0,1]=4 955 B10R0.34 CCC(C=O)N[C@@H](C)CCO 7c641180ff2f3e5f6f3194f4d2aa8781 [0,2,0,0,0,0|1,0,1]=4 956 B10R0.34 CCC(C=O)N[C@@H](C)COC f0c3214084bb464f3438653c48f57e7c [0,2,0,0,0,0|1,0,1]=4 957 B10R0.34 CCC(C=O)N[C@H](C)CCO 80662bb41ec8b7d0a2b6aa68c17b241c [0,2,0,0,0,0|1,0,1]=4 958 B10R0.34 CCC(C=O)N[C@H](C)COC ce563117ec12da2239719214ae3bf25c [0,2,0,0,0,0|1,0,1]=4 959 B10R0.34 CCC(C=O)OC(C)COC 3663cdc2a60970ec8fa0e280ff179c41 [0,2,0,0,0,0|1,0,1]=4 960 B10R0.34 CCC(C=O)OC(C)CSC a74e9acab9dbf1d94691c6c79ca2e758 [0,2,0,0,0,0|1,0,1]=4 961 B10R0.34 CCC(C=O)O[C@@H](C)COC 63c88992e5c0ef310e6cbf7504b8d37b [0,2,0,0,0,0|1,0,1]=4 962 B10R0.34 CCC(C=O)O[C@H](C)COC ef84158a16922ba0bb177be70b82b827 [0,2,0,0,0,0|1,0,1]=4 963 B10R0.34 CCCC(=S)OC(C=O)CC 0ea81cad5c425475a9985124239d0a24 [0,2,0,0,0,0|0,0,1]=3 964 B10R0.34 CCCC(C)NC(C=O)CC d054d2823c5b820b39465ae891fdd719 [0,2,0,0,0,0|0,0,2]=4 965 B10R0.34 CCCC(C)OC(C=O)CC 0a10b3ed5e9cfbb2b132051707c598cb [0,2,0,0,0,0|0,0,2]=4 966 B10R0.34 CCC[C@@H](C)OC(C=O)CC b0bf0e11e05edc6eb59d950f5629b07f [0,2,0,0,0,0|0,0,2]=4 967 B10R0.34 CCC[C@H](C)NC(C=O)CC 3a2c5365942d23ff262de2354ae55317 [0,2,0,0,0,0|0,0,2]=4 968 B10R0.34 CCC[C@H](C)OC(C=O)CC f8d3b426d06b83528dc4261c956dbbce [0,2,0,0,0,0|0,0,2]=4 969 B10R0.34 CCNC(=O)CN(C=O)CC da44bf9f77c0e1279287a5e1daba9ecd [0,2,0,0,0,0|2,0,0]=4 970 B10R0.34 CCOC(=O)CN(C=O)CC b7812bec65a7a8b0aab82f99eed55874 [0,2,0,0,0,0|2,0,0]=4 971 B10R0.38 C/C=C(/CC)\C(=O)N(C)CC 0598276c1dc20b17f662838e699eb769 [0,2,0,0,0,0|2,0,0]=4 972 B10R0.38 C/C=C(\CC)/C(=O)N(C)CC 606d5aa174c5b5f6be43ecdee4226d62 [0,2,0,0,0,0|2,0,0]=4 973 B10R0.38 CC=C(CC)C(=O)N(C)CC 21d553f9fc0fdbc948d23e0db770fbcb [0,2,0,0,0,0|2,0,0]=4 974 B10R0.38 CCC(C)N(C)C(C=O)CC 915a65b6279701ba5077861ff7fd573b [0,2,0,0,0,0|1,0,1]=4 975 B10R0.72 CCC(C=O)NC(C)C(C)C 08f245b6fd467db7029986fff3927416 [0,2,0,0,0,0|1,0,1]=4 976 B10R0.72 CCC(C=O)NC(C)C(C)O ff2a38d80a3f7968e9a54e003083b66f [0,2,0,0,0,0|1,0,1]=4 977 B10R0.72 CCC(C=O)N[C@@H](C)C(C)C 6dbd0e67dc50019d04cde159151164fe [0,2,0,0,0,0|1,0,1]=4 978 B10R0.72 CCC(C=O)N[C@H](C)C(C)C dc18edffe3793fd93442e7584c3d9095 [0,2,0,0,0,0|1,0,1]=4 979 B10R0.72 CCC(C=O)OC(C)C(C)C 8bffcbff219571fd0437627ab16961d7 [0,2,0,0,0,0|1,0,1]=4 980 B10R0.72 CCC(C=O)OC(C)C(C)S 11b18834ddd22927b2419925f4330f8b [0,2,0,0,0,0|1,0,1]=4 981 B10R0.72 CCC(C=O)O[C@@H](C)C(C)C e4ddcda756dab50bdb9418c9d80a0064 [0,2,0,0,0,0|1,0,1]=4 982 B10R0.72 CCC(C=O)O[C@H](C)C(C)C 0feeb366ae0558d794d908adbe5fa020 [0,2,0,0,0,0|1,0,1]=4 983 B10R0.145 C#CC(CC)OC(C=O)CC 0344be5bddcb43a0df083065d05e90f7 [0,2,0,0,0,0|1,0,1]=4 984 B10R0.145 C=CC(CC)OC(C=O)CC a00dfbc2428adbc1afe4c1a5e75b40fc [0,2,0,0,0,0|1,0,1]=4 985 B10R0.145 CCC(C#N)OC(C=O)CC 1c970bd8ec8fa17b90d20c40b72b9903 [0,2,0,0,0,0|1,0,1]=4 986 B10R0.145 CCC(C=O)NC(CC)CC 671942585e4084d78f10dd1d6fc2c9b2 [0,2,0,0,0,0|1,0,1]=4 987 B10R0.145 CCC(C=O)NC(CC)CO 0c8de7b2d91bca6b0f51e51929781e26 [0,2,0,0,0,0|1,0,1]=4 988 B10R0.145 CCC(C=O)N[C@@H](CC)CO af54e38bc2e7e7adefbce3dfb5387cdc [0,2,0,0,0,0|1,0,1]=4 989 B10R0.145 CCC(C=O)N[C@H](CC)CO cdaba79e34e2f45f41947425f6b329a3 [0,2,0,0,0,0|1,0,1]=4 990 B10R0.145 CCC(C=O)OC(CC)CC badb1555b87c4bb102bae688945bbbb7 [0,2,0,0,0,0|1,0,1]=4 991 B10R0.153 CCC(C=O)NC(C)(C)CC 0f4a575f9c273fdb38aa5ea978199c28 [0,2,0,0,0,0|1,0,1]=4 992 B10R0.20 CCCN(CC)C(C=O)CC a74c8dfcc53aeaf77db02a71f9159c2c [0,2,0,0,0,0|1,0,1]=4 993 B10R0.21 C/C=C(/CC)\C(=O)NCCBr e9a1fc2b7db2e53a9e3da5f866a740d5 [0,2,0,0,0,0|2,0,0]=4 994 B10R0.21 C/C=C(/CC)\C(=O)NCCC 456eef33744203476c9bb18a367f66ae [0,2,0,0,0,0|1,0,0]=3 995 B10R0.21 C/C=C(/CC)\C(=O)NCCF 1eb200f3567bd94f13f9651deb6a37e6 [0,2,0,0,0,0|2,0,0]=4 996 B10R0.21 C/C=C(/CC)\C(=O)NCCI ed27f344100e745fb3db25e34f4405ab [0,2,0,0,0,0|2,0,0]=4 997 B10R0.21 C/C=C(/CC)\C(=O)NCCO c87196d2f5d94a8e261b56173b8845b6 [0,2,0,0,0,0|2,0,0]=4 998 B10R0.21 C/C=C(/CC)\C(=O)NCCS 61fee290ca0b38f0f8e5183ed648bbe6 [0,2,0,0,0,0|2,0,0]=4 999 B10R0.21 C/C=C(\CC)/C(=O)NCCBr a99b54d4e38d079bdd0ac4e96ca6e4bd [0,2,0,0,0,0|2,0,0]=4 1000 B10R0.21 C/C=C(\CC)/C(=O)NCCC 26c38cb34e2adee718540249cbc20629 [0,2,0,0,0,0|1,0,0]=3 1001 B10R0.21 C/C=C(\CC)/C(=O)NCCF 5e9e2a3b206c120d0c57c0533dc99061 [0,2,0,0,0,0|2,0,0]=4 1002 B10R0.21 C/C=C(\CC)/C(=O)NCCI 80981541ae665f628acd2652bb2ec4ab [0,2,0,0,0,0|2,0,0]=4 1003 B10R0.21 C/C=C(\CC)/C(=O)NCCO 19a600be993cad4b37be12ec04b489e2 [0,2,0,0,0,0|2,0,0]=4 1004 B10R0.21 C/C=C(\CC)/C(=O)NCCS abf40f676ffe8af0ac17fbd561cd8710 [0,2,0,0,0,0|2,0,0]=4 1005 B10R0.21 CC=C(CC)C(=O)NCCBr 026e769405697842579ce12662d179c0 [0,2,0,0,0,0|2,0,0]=4 1006 B10R0.21 CC=C(CC)C(=O)NCCC 5980a9eefea9f01d5b7d0589596d210b [0,2,0,0,0,0|1,0,0]=3 1007 B10R0.21 CC=C(CC)C(=O)NCCF 64671f924bda5b205871e705481465eb [0,2,0,0,0,0|2,0,0]=4 1008 B10R0.21 CC=C(CC)C(=O)NCCI bf734ff608aaab1f3c1a22187713afdf [0,2,0,0,0,0|2,0,0]=4 1009 B10R0.21 CC=C(CC)C(=O)NCCO 05e9d3ebb4531c8877c22bd90fa111b7 [0,2,0,0,0,0|2,0,0]=4 1010 B10R0.21 CC=C(CC)C(=O)NCCS ed8de3b45df9c5809cd9c6b42651f009 [0,2,0,0,0,0|2,0,0]=4 1011 B10R0.21 CCC(C=O)N(C)CCCO 268e1e08ad9612ae6b506fdb009a9bfd [0,2,0,0,0,0|1,0,1]=4 1012 B10R0.21 CCC(C=O)N(C)CCOC 630e9b54bce7747dbf7f47b8ceb59eb0 [0,2,0,0,0,0|1,0,1]=4 1013 B10R0.21 CCC(C=O)N(C)CCSC df9198b660e7f06c056db29981c243b9 [0,2,0,0,0,0|1,0,1]=4 1014 B10R0.21 CCCCN(C)C(C=O)CC 35b878d4fe43b70a5a1ae2eb20cf89c7 [0,2,0,0,0,0|0,0,2]=4 1015 B10R0.33 CCNC(=O)C(CC)NC=O 69654904665a5f13b751aa7c9a165129 [0,2,0,0,0,0|1,0,1]=4 1016 B10R0.33 CCOC(=O)C(CC)NC=O 3e320f6251f4be0eb4c6f6859787a496 [0,2,0,0,0,0|1,0,1]=4 1017 B10R0.33 CCOC(=O)[C@@H](CC)NC=O 2f8d29905e1e4933a5ff3525e976dc8a [0,2,0,0,0,0|1,0,1]=4 1018 B10R0.33 CCOC(=O)[C@H](CC)NC=O 4df37a536ec64b7b6d4a93c9c45eebcc [0,2,0,0,0,0|1,0,1]=4 1019 B10R0.144 CCC(C=O)N(C)CC(C)C e6a8e29d23fa2609f851cef870c307fd [0,2,0,0,0,0|1,0,1]=4 1020 B10R0.144 CCC(C=O)N(C)CC(C)O 1f4b11f1ad863a5675a2694b14d7bad9 [0,2,0,0,0,0|1,0,1]=4 1021 B10R0.144 CCC(C=O)N(C)C[C@H](C)O 3ad518259a5034b04281c04754b07625 [0,2,0,0,0,0|1,0,1]=4 1022 B10R0.16 CCC/C=C(\CC)/COCC a13df6dc40ecf590499376b9b6903afa [0,2,0,0,0,0|0,0,2]=4 1023 B10R0.16 CCC/C=C(\CC)/COCF 04fa90d6f638dc73b4b1b2f87bdec5af [0,2,0,0,0,0|0,0,2]=4 1024 B10R0.16 CCCCC(CC)CNC=O 63f1fd025f35a258b0803ba73f3e1a72 [0,2,0,0,0,0|0,0,2]=4 1025 B10R0.16 CCCCC(CC)OCC=O 38b4833ef281acf6c43e55daafea93fe [0,2,0,0,0,0|0,0,2]=4 1026 B10R0.16 CCCCN(C=O)CCC#N 36224a7003ce4b12dd1b1e611567075f [0,2,0,0,0,0|1,0,1]=4 1027 B10R0.16 CCCCN(C=O)CCCC ea96c0b4503c73e427961c44193cc2a3 [0,2,0,0,0,0|1,0,1]=4 1028 B10R0.16 CCCCN(CC)CCC=O e93c2e78f0bf5ff0324aed41bb837c8c [0,2,0,0,0,0|1,0,1]=4 1029 B10R0.24 CCCCCN(C=O)CCC 8646abf1faa254eafc312659290c903a [0,2,0,0,0,0|1,0,1]=4 1030 B10R0.24 CCCCCN(C=O)CCO 96121951b82ae2714360bd22f86e4e05 [0,2,0,0,0,0|1,0,1]=4 1031 B10R0.24 CCN(CC=O)CCCCO 958ee55a164fd1c93eb31f63d90f34c3 [0,2,0,0,0,0|1,0,1]=4 1032 B10R0.24 CCN(CC=O)CCCOC 352aec8797d38b9824d4915d90d8344b [0,2,0,0,0,0|1,0,1]=4 1033 B10R0.24 CCOCCN(CC)CC=O 3c8f8940ead3305ab52d87e1942612f8 [0,2,0,0,0,0|1,0,1]=4 1034 B10R0.87 CCCCN(CC)CC(=O)N fdabdc091933181a8b0b755e7ad2ecee [0,2,0,0,0,0|1,0,1]=4 1035 B10R0.87 CCCCN(CC)CC(=O)O 772add9f0e887e86d0cbf3269f3f6ddb [0,2,0,0,0,0|1,0,1]=4 1036 B10R0.87 CCCNC(CC)CC(=O)O b2b438470e8613c4cb1b71f20eb9f370 [0,2,0,0,0,0|1,0,1]=4 1037 B10R0.87 CCCN[C@@H](CC)CC(=O)O 2a8a45d34c1dda4044ad9c2e8398ec46 [0,2,0,0,0,0|1,0,1]=4 1038 B10R0.87 CCCN[C@H](CC)CC(=O)O 190232932dc7952509c4d4a7c70c1d89 [0,2,0,0,0,0|1,0,1]=4 1039 B10R0.87 CCCOC(CC)CC(=O)O c4d8b7398bb7277176d1defff4ae6f9a [0,2,0,0,0,0|1,0,1]=4 1040 B10R0.87 CCCO[C@@H](CC)CC(=O)O f7681333e7d1842bf262675afad73c51 [0,2,0,0,0,0|1,0,1]=4 1041 B10R0.87 CCCO[C@H](CC)CC(=O)O 5546955c5c22062d12cbbffd167d46a3 [0,2,0,0,0,0|1,0,1]=4 1042 B10R0.90 CCCCN(CC=O)CCC 5b08e5c5b0f11367f412c326281fb6d0 [0,2,0,0,0,0|1,0,1]=4 1043 B10R0.90 CCCCN(CC=O)CCO 43416b91646207f17904f5557b9eb8c7 [0,2,0,0,0,0|1,0,1]=4 1044 B10R0.90 CCCCN(CC=O)CCS 7fc6894db28b0cc79bd2cc1ffd7baea5 [0,2,0,0,0,0|1,0,1]=4 1045 B10R0.11 CCC(C=O)NCC(C)(C)C 99daa37303b9d188e4f7530ef45c8fe7 [0,2,0,0,0,0|1,0,1]=4 1046 B10R0.11 CCC(C=O)NCC(C)(C)O 5b954edef3f4d9c0d10012737a3b5ba6 [0,2,0,0,0,0|1,0,1]=4 1047 B10R0.11 CCC(C=O)NCC(C)(F)F 5ae4152af39ed636eb764ec8fff61863 [0,2,0,0,0,0|1,0,1]=4 1048 B10R0.11 CCC(C=O)OCC(C)(C)Br 86462e314c07d471446f9a78ad03f2d1 [0,2,0,0,0,0|1,0,1]=4 1049 B10R0.11 CCC(C=O)OCC(C)(C)C 760d5d4478546ba36543e95b4b91677a [0,2,0,0,0,0|1,0,1]=4 1050 B10R0.11 CCC(C=O)OCC(C)(C)F d9495f1da98d5ca4dafea3e34737b821 [0,2,0,0,0,0|1,0,1]=4 1051 B10R0.11 CCC(C=O)OCC(C)(C)S 3ddec31d76da3f888bb7f2da6a37bcee [0,2,0,0,0,0|1,0,1]=4 1052 B10R0.11 CCC(C=O)OCC(C)(F)F 32abcf0ae9ea4b6ad95a41ea73a50ac8 [0,2,0,0,0,0|1,0,1]=4 1053 B10R0.45 C=CC(C)COC(C=O)CC 7eed2bc4496df96e85495b08c117c85a [0,2,0,0,0,0|1,0,1]=4 1054 B10R0.45 CCC(=O)COC(C=O)CC 82bb41c935dabc9325518c3b6a9dcdf3 [0,2,0,0,0,0|1,0,1]=4 1055 B10R0.45 CCC(C)CNC(C=O)CC 6900f93a79da43d0bb3be62bca606556 [0,2,0,0,0,0|0,0,2]=4 1056 B10R0.45 CCC(C)COC(C=O)CC 5601176484f3db52e810caae498eb1b5 [0,2,0,0,0,0|0,0,2]=4 1057 B10R0.45 CCC(C=O)NCC(Br)CBr bbfb072ed4d67d32ab9c8311dbf2c25f [0,2,0,0,0,0|1,0,1]=4 1058 B10R0.45 CCC(C=O)NCC(C)C#N ef919bb06676f515f126df385585dd25 [0,2,0,0,0,0|1,0,1]=4 1059 B10R0.45 CCC(C=O)NCC(C)CO 8b4ab534986c677c9b2e5578f0750c48 [0,2,0,0,0,0|1,0,1]=4 1060 B10R0.45 CCC(C=O)NCC(F)CO 268ef8f63e19993dc5d35134da63d5f4 [0,2,0,0,0,0|1,0,1]=4 1061 B10R0.45 CCC(C=O)NCC(O)CO 2e25f83435c708b2bc81f004bf96a9ac [0,2,0,0,0,0|1,0,1]=4 1062 B10R0.45 CCC(C=O)NC[C@@H](C)CC c7cdac6da9948025b7ca3d358fdaaedd [0,2,0,0,0,0|0,0,2]=4 1063 B10R0.45 CCC(C=O)NC[C@@H](C)OC 1c3553cca3e523c8cc09846b1a9aa00d [0,2,0,0,0,0|1,0,1]=4 1064 B10R0.45 CCC(C=O)NC[C@@H](F)CO a7bb0211c93e0c83ba48757962b71fd9 [0,2,0,0,0,0|1,0,1]=4 1065 B10R0.45 CCC(C=O)NC[C@@H](O)CO db52fcd8890f2483c375e072c26f0e56 [0,2,0,0,0,0|1,0,1]=4 1066 B10R0.45 CCC(C=O)NC[C@H](C)CO 5cd4cfe958921655a6402d4847ae0afc [0,2,0,0,0,0|1,0,1]=4 1067 B10R0.45 CCC(C=O)NC[C@H](C)OC 3034192757595960eb5bf64d6ad9430a [0,2,0,0,0,0|1,0,1]=4 1068 B10R0.45 CCC(C=O)NC[C@H](F)CO e0b8eebf405f7166976b2847c28efcb0 [0,2,0,0,0,0|1,0,1]=4 1069 B10R0.45 CCC(C=O)NC[C@H](O)CC 8523420e990831974aaf88c043c519e4 [0,2,0,0,0,0|0,0,2]=4 1070 B10R0.45 CCC(C=O)NC[C@H](O)CO 50799b35690b37f90149ca65168ccca4 [0,2,0,0,0,0|1,0,1]=4 1071 B10R0.45 CCC(C=O)OCC(Br)CBr 966ee14668a385147b918d99dbac3255 [0,2,0,0,0,0|1,0,1]=4 1072 B10R0.45 CCC(C=O)OCC(C)C#N e3dfe33c63057a07549396d846b0aa30 [0,2,0,0,0,0|1,0,1]=4 1073 B10R0.45 CCC(C=O)OCC(C)OC 73822c2b4bead9044de7aa653c6e7574 [0,2,0,0,0,0|1,0,1]=4 1074 B10R0.45 CCC(C=O)OCC(Cl)CCl 555b523aaeeb36746dad9877b0d8f539 [0,2,0,0,0,0|1,0,1]=4 1075 B10R0.45 CCC(C=O)OCC(S)CS ed0e963fe65bde2cb41f5420aed1dd9c [0,2,0,0,0,0|1,0,1]=4 1076 B10R0.45 CCC(C=O)OC[C@@H](C)CC c797cce38acfbbd8fabb859194de9741 [0,2,0,0,0,0|0,0,2]=4 1077 B10R0.45 CCC(C=O)OC[C@@H](C)OC bd6ce385e6bcee45cac5455ddafdc280 [0,2,0,0,0,0|1,0,1]=4 1078 B10R0.45 CCC(C=O)OC[C@H](C)CC b093a53fe0a3066e821b51141df7b180 [0,2,0,0,0,0|0,0,2]=4 1079 B10R0.45 CCC(C=O)OC[C@H](C)OC 5c28d620e9289b6575d14a2105cf99f8 [0,2,0,0,0,0|1,0,1]=4 1080 B10R0.45 CCC(O)CNC(C=O)CC a661bbc1944af3c8a3cef276f1d3e51c [0,2,0,0,0,0|0,0,2]=4 1081 B10R0.41 C#CCCCNC(C=O)CC e3c5bf3eb5619b94ec0afe2d636b4085 [0,2,0,0,0,0|1,0,1]=4 1082 B10R0.41 C#CCCCOC(C=O)CC 2d0eafea1b8ba2f150d0e1c02cb3fa6c [0,2,0,0,0,0|1,0,1]=4 1083 B10R0.41 C/C=C/CCOC(C=O)CC 1f82be4c917f3a72565fafb225a8dbc5 [0,2,0,0,0,0|1,0,1]=4 1084 B10R0.41 C=CCCCNC(C=O)CC 3d2855a42d10c367715bf3e265241989 [0,2,0,0,0,0|1,0,1]=4 1085 B10R0.41 C=CCCCOC(C=O)CC 990728c6653e9d35b98d64515c9dcd66 [0,2,0,0,0,0|1,0,1]=4 1086 B10R0.41 CC#CCCOC(C=O)CC e0c42c68d1cf0ea353678ad0428dab31 [0,2,0,0,0,0|1,0,1]=4 1087 B10R0.41 CC/C=C/COC(C=O)CC 13e2eeafa9c35e9b4f2b5a9484394963 [0,2,0,0,0,0|0,0,2]=4 1088 B10R0.41 CC/C=C\COC(C=O)CC f1c230c668d6b4ded61633b4508ffb35 [0,2,0,0,0,0|0,0,2]=4 1089 B10R0.41 CCC#CCOC(C=O)CC 2b4632af1fdb1af91b13314922aa453c [0,2,0,0,0,0|1,0,1]=4 1090 B10R0.41 CCC(C=O)NCCCC#N 99c6261fce597bf9010987a614704d40 [0,2,0,0,0,0|1,0,1]=4 1091 B10R0.41 CCC(C=O)NCCCCCl d95c96d9429168fc321d0717e8a77ef1 [0,2,0,0,0,0|0,0,2]=4 1092 B10R0.41 CCC(C=O)NCCCCO a56df56d6bff77c10b51e9f7a6063607 [0,2,0,0,0,0|0,0,2]=4 1093 B10R0.41 CCC(C=O)NCCCCS 541ab4fac437278167c9a663c60800ee [0,2,0,0,0,0|0,0,2]=4 1094 B10R0.41 CCC(C=O)NCCCOC dc020655a4b88dac21383ba76bbd2f2f [0,2,0,0,0,0|0,0,2]=4 1095 B10R0.41 CCC(C=O)NCCCSC 930891c0d698e67f27f83528366e4fe0 [0,2,0,0,0,0|0,0,2]=4 1096 B10R0.41 CCC(C=O)OCCCC#N cf3ed73a1c279c74234093d01e9630e3 [0,2,0,0,0,0|1,0,1]=4 1097 B10R0.41 CCC(C=O)OCCCC=O 6475232c25b8615060400ca8b69d509f [0,2,0,0,0,0|1,0,1]=4 1098 B10R0.41 CCC(C=O)OCCCCF f1f43e044b6f65472b53fcbffd1f871e [0,2,0,0,0,0|0,0,2]=4 1099 B10R0.41 CCC(C=O)OCCCCS 867c7f83c210081bbca6b22ddc15e882 [0,2,0,0,0,0|0,0,2]=4 1100 B10R0.41 CCC(C=O)OCCCOC 39e3494d9f0a0347aa12a490f4173df7 [0,2,0,0,0,0|0,0,2]=4 1101 B10R0.41 CCC(C=O)OCCCSC 13849281d4bb07175917d4a332652925 [0,2,0,0,0,0|0,0,2]=4 1102 B10R0.41 CCCCCNC(C=O)CC 12d22b6718bb34daa837a86af61630b2 [0,2,0,0,0,0|0,0,2]=4 1103 B10R0.41 CCCCCOC(C=O)CC 868e7873b395a96668a3795dee2fa98a [0,2,0,0,0,0|0,0,2]=4 1104 B10R0.41 CCOCCNC(C=O)CC 8b5c1ba6b1a915fd6d2758447cca6106 [0,2,0,0,0,0|0,0,2]=4 1105 B10R0.41 CCOCCOC(C=O)CC 4efbbde272951b88cf9bf4217c933b1f [0,2,0,0,0,0|0,0,2]=4 1106 B10R0.41 CCSCCNC(C=O)CC 0cb38caa13ab5a2302da9b7d579ed529 [0,2,0,0,0,0|0,0,2]=4 1107 B10R0.41 CCSCCOC(C=O)CC ef7497f29cf14046507647af262059ac [0,2,0,0,0,0|0,0,2]=4 1108 B10R0.77 C=C(C)CCNC(C=O)CC 11e4ced31f441e811af4a8dade2fd91d [0,2,0,0,0,0|1,0,1]=4 1109 B10R0.77 C=C(C)CCOC(C=O)CC 919cf18bb44557ade5cf147244ecc6c7 [0,2,0,0,0,0|1,0,1]=4 1110 B10R0.77 CCC(C=O)NCCC(C)C c406ecabb95375a21bc5567cb81ed92e [0,2,0,0,0,0|0,0,2]=4 1111 B10R0.77 CCC(C=O)NCCC(C)O 14e2c08a7c37c11612c1f9f57438f48c [0,2,0,0,0,0|0,0,2]=4 1112 B10R0.77 CCC(C=O)NCCC(F)F f87ad03c39e23ccce327d46627beb73d [0,2,0,0,0,0|1,0,1]=4 1113 B10R0.77 CCC(C=O)NCCN(C)C 0e4bed7db9d2d1d6d3f2659f0f4cf034 [0,2,0,0,0,0|1,0,1]=4 1114 B10R0.77 CCC(C=O)NCCS(=O)C 1c6ddaf8c1a5ffd1dd48aa1c3ca24f33 [0,2,0,0,0,0|1,0,1]=4 1115 B10R0.77 CCC(C=O)NCC[C@@H](C)O ab653f2d5bd1ee4f34a209ac3ebb069b [0,2,0,0,0,0|0,0,2]=4 1116 B10R0.77 CCC(C=O)NCC[C@H](C)O c7bcb6255a985c170c0e7348ed9c9905 [0,2,0,0,0,0|0,0,2]=4 1117 B10R0.77 CCC(C=O)OCCC(=O)C b73da0f02d090dcd415ebca6e2e951e5 [0,2,0,0,0,0|1,0,1]=4 1118 B10R0.77 CCC(C=O)OCCC(C)C b63029965d90eb9396cd47f7aa21b5be [0,2,0,0,0,0|0,0,2]=4 1119 B10R0.77 CCC(C=O)OCCC(F)F b359bea028d5af467287aaab5eb2b203 [0,2,0,0,0,0|1,0,1]=4 1120 B10R0.77 CCC(C=O)OCCN(C)C 5f14bdf13dd8777d687708a7af4d2a17 [0,2,0,0,0,0|1,0,1]=4 1121 B10R0.77 CCC(C=O)OCCS(=O)C 1fdfd30d20671f2390cf07649b6441de [0,2,0,0,0,0|1,0,1]=4 1122 B10R0.77 CCN(C=O)CCCN(C)C 2fb9e5d5ac94c74caa99341d0486de87 [0,2,0,0,0,0|1,0,1]=4 1123 B8R1.1 CC1CCN(C1)C=O 802232b85eec3baa7ee60be5f84b67b5 [1,0,0,1,0,0|1,0,1]=4 1124 B8R1.13 CCOC1CCC1=O 3dbc6f04881f51171a4de09e2024a401 [1,0,0,1,0,0|1,0,1]=4 1125 B8R1.38 CC(C=O)N1CCC1 b3b552e7b160cd5acb51c776f72f7634 [1,0,0,1,0,0|1,0,1]=4 1126 B8R1.38 CCC(=O)N1CCC1 d52503cf4cfc194127f664b5bcf57565 [1,0,0,1,0,0|1,0,0]=3 1127 B8R1.38 C[C@H](C=O)N1CCC1 92650f4896a859e9500741deb7ae1705 [1,0,0,1,0,0|1,0,1]=4 1128 B8R1.38 O=C(CF)N1CCC1 e1631cac567168a725b0163e106fbfc3 [1,0,0,1,0,0|2,0,0]=4 1129 B8R1.38 O=C(CO)N1CCC1 14506b695520a8256189bb97564c8706 [1,0,0,1,0,0|2,0,0]=4 1130 B8R1.38 O=C(CS)N1CCC1 483ef26b984ed24bd38f07147cc524a3 [1,0,0,1,0,0|2,0,0]=4 1131 B8R1.38 O=CC(=O)N1CCC1 3cd44a972429668a2e301e83de6705a9 [1,0,0,1,0,0|2,0,0]=4 1132 B8R1.40 C=C(C=O)OC1CC1 b9ffb3a59a8a9a3920997cae2c377c7b [1,0,0,1,0,0|1,0,1]=4 1133 B8R1.40 CC(C=O)NC1CC1 691e0889ed251bf8aa7c3b68c5df0349 [1,0,0,1,0,0|1,0,1]=4 1134 B8R1.40 CC(C=O)OC1CC1 23105afb975e278e4885544692b945fa [1,0,0,1,0,0|1,0,1]=4 1135 B8R1.40 CCC(=O)NC1CC1 bc1edd04b4e58cbfa3a5f5c726ebfe6b [1,0,0,1,0,0|1,0,0]=3 1136 B8R1.40 CN(C=O)CC1CC1 3ebaae3355b02d7a76d4d660673266ff [1,0,0,1,0,0|1,0,1]=4 1137 B8R1.40 C[C@H](C=O)NC1CC1 b2dc22049a6d22620bf79363de94a32e [1,0,0,1,0,0|1,0,1]=4 1138 B8R1.40 C[C@H](C=O)OC1CC1 0bd45590cb6813e5f06145925c580d8f [1,0,0,1,0,0|1,0,1]=4 1139 B8R1.40 O=C(CF)NC1CC1 9ccf83dad7006c7283aead2cfdfd9cfa [1,0,0,1,0,0|2,0,0]=4 1140 B8R1.40 O=C(CO)NC1CC1 bb096758b55cfb0505bd2d10961bc923 [1,0,0,1,0,0|2,0,0]=4 1141 B8R1.40 O=C(CS)NC1CC1 47ed3dec057db245af795d634c1f00f4 [1,0,0,1,0,0|2,0,0]=4 1142 B8R1.40 O=CC(=O)NC1CC1 288abfcb7bdb635fa8f12884916c723b [1,0,0,1,0,0|2,0,0]=4 1143 B8R1.47 CCC1CN(C1)C=O 9645ce44596bcd4aa700308ce0a15fd2 [1,0,0,1,0,0|1,0,1]=4 1144 B8R1.11 CC1CCCN1C=O 3ea4d1e6647fbd09960c2c26417f1af4 [1,0,0,1,0,0|1,0,0]=3 1145 B8R1.11 CC1SCCN1C=O a4140bf0d296ba848f3453d4bea5de05 [1,0,0,1,0,0|2,0,0]=4 1146 B8R1.11 C[C@@H]1CCCN1C=O 5b11f1ed15ba14e3311dd9d4b620d01b [1,0,0,1,0,0|1,0,0]=3 1147 B8R1.11 C[C@H]1CCCN1C=O 47ce3e99eee2f4d382d5e118e22fa773 [1,0,0,1,0,0|1,0,0]=3 1148 B8R1.11 O=CN1CCCC1O a26ec465eebf98c295c9d7f5c4bb6e0a [1,0,0,1,0,0|2,0,0]=4 1149 B8R1.12 CCC1CCN1C=O 4d6ef5a44aefaf3ec9d57c4c6afb459e [1,0,0,1,0,0|1,0,0]=3 1150 B8R1.12 O=CN1CCC1CO edd971460a08454ceeb6be017da9f618 [1,0,0,1,0,0|2,0,0]=4 1151 B8R1.12 O=CN1CC[C@@H]1CO ce19f0bce3454d05cb7c121458132ef7 [1,0,0,1,0,0|2,0,0]=4 1152 B8R1.12 O=CN1CC[C@H]1CO e22630134adf9d5eaa8ff5bdd2c4924a [1,0,0,1,0,0|2,0,0]=4 1153 B8R1.33 CCN(C=O)C1CC1 01cfb1cb1bee8be07aafce80b6f4fac9 [1,0,0,1,0,0|1,0,0]=3 1154 B10R1.13 CC(=O)N1CCC(CC1)C 1b760e49050c38e65a44c83de7209996 [0,1,0,1,0,0|1,0,1]=4 1155 B10R1.19 CC1CCCCCN1C=O ba5fbd4c623eec64d4689114c99d9b50 [0,1,0,1,0,0|1,0,1]=4 1156 B10R1.19 CC1CCOCCN1C=O 263ee2b9c309f1e9f4da772f5bbec9c8 [0,1,0,1,0,0|1,0,1]=4 1157 B10R1.19 CC1COCCCN1C=O b121eccdc12e2f47bcf982ba930d37cf [0,1,0,1,0,0|1,0,1]=4 1158 B10R1.25 CC1CC(CCN1C=O)O 5fe338fbcff872ebabda0acbbb296137 [0,1,0,1,0,0|1,0,1]=4 1159 B10R1.25 CC1CCN(C(C1)C)C=O d0ae47647de4238d6ddf0afb15714255 [0,1,0,1,0,0|1,0,1]=4 1160 B10R1.25 C[C@@H]1CCN([C@@H](C1)C)C=O e8d62963b56fa21bde585709290c452c [0,1,0,1,0,0|1,0,1]=4 1161 B10R1.25 C[C@@H]1C[C@@H](CCN1C=O)O 55e46069810c87a3ab82cc39357535c8 [0,1,0,1,0,0|1,0,1]=4 1162 B10R1.25 C[C@@H]1C[C@H](CCN1C=O)O fb872f7126a379e6bbfa6a09653e1fbb [0,1,0,1,0,0|1,0,1]=4 1163 B10R1.25 C[C@H]1CCN([C@H](C1)C)C=O 29c21008b0fb95a1bd335da9e423aefb [0,1,0,1,0,0|1,0,1]=4 1164 B10R1.29 CCCNC1CCCC1=O 92270db65b4e768bf74c060f3ddca1d2 [0,1,0,1,0,0|1,0,1]=4 1165 B10R1.29 CCCNC1CCNC1=O 826c3328fa4dd7dd5dd8c3d568a3408e [0,1,0,1,0,0|1,0,1]=4 1166 B10R1.29 CCCNC1CCSC1=O 2f88eaf0893fc5d79036a5fe5a76847c [0,1,0,1,0,0|1,0,1]=4 1167 B10R1.29 CCCN[C@@H]1CCNC1=O 881bee3ef919f2d395ee9f82cce415b2 [0,1,0,1,0,0|1,0,1]=4 1168 B10R1.29 CCCN[C@@H]1CCOC1=O 093e5b8bf1b7aee96a6d4b18a27dd8a3 [0,1,0,1,0,0|1,0,1]=4 1169 B10R1.29 CCCN[C@H]1CCNC1=O 28513bf65ca36f558ae2e34f11c0860c [0,1,0,1,0,0|1,0,1]=4 1170 B10R1.29 CCCN[C@H]1CCOC1=O 6fb700cd323815a8f11591a44ec6a9ee [0,1,0,1,0,0|1,0,1]=4 1171 B10R1.29 CCCOC1=CCCC1=O fadefa381d9ba1fee3a737cdc60aa0fe [0,1,0,1,0,0|1,0,0]=3 1172 B10R1.29 CCCOC1CCCC1=O 6b93fa99d3716532fe6b9fa26488dd4e [0,1,0,1,0,0|1,0,1]=4 1173 B10R1.29 CCCOC1CCNC1=O 53dd243a9f8f1e7eacf3fc4b0133cfbe [0,1,0,1,0,0|1,0,1]=4 1174 B10R1.29 CCCOC1CCOC1=O 81b1a44df3caf13a7904e6e1637022cc [0,1,0,1,0,0|1,0,1]=4 1175 B10R1.29 CCCO[C@@H]1CCNC1=O defea96294aac13f1e3bb47afec7acb5 [0,1,0,1,0,0|1,0,1]=4 1176 B10R1.29 CCCO[C@@H]1CCOC1=O a61cf9ea463c92a0de26354c56c59a42 [0,1,0,1,0,0|1,0,1]=4 1177 B10R1.29 CCCO[C@H]1CCNC1=O 0c65acf6b283fd1270fb0902388bc278 [0,1,0,1,0,0|1,0,1]=4 1178 B10R1.29 CCCO[C@H]1CCOC1=O 0ca8453d27df7ed3deef2a5f6389b306 [0,1,0,1,0,0|1,0,1]=4 1179 B10R1.29 CCOCC1=CCCC1=O 1b35cb27c216af6dbf9fafa3e8334a80 [0,1,0,1,0,0|1,0,1]=4 1180 B10R1.29 COCOC1=CCCC1=O 72dcab3afd444c0c1c7d6d6795677127 [0,1,0,1,0,0|2,0,0]=4 1181 B10R1.29 CSCOC1=CCCC1=O ece18d604a840db1de6af33c09890bd3 [0,1,0,1,0,0|2,0,0]=4 1182 B10R1.29 O=C1CCC=C1OCCF e8bccd1eeb19bbc6a76ec3435be9a809 [0,1,0,1,0,0|2,0,0]=4 1183 B10R1.29 O=C1CCC=C1OCCS 553434a343daa8d472856f456e3c55b3 [0,1,0,1,0,0|2,0,0]=4 1184 B10R1.31 CCC1CCN(C1)C(=O)C e5cc8531ed45be6563a1f79e866d207d [0,1,0,1,0,0|1,0,1]=4 1185 B10R1.38 CC1(CCCCN1C=O)C ae6587fc5f84afc3a79f1000db32e637 [0,1,0,1,0,0|1,0,1]=4 1186 B10R1.61 CC(=O)N1CCCCC1C 4f5cacb6e20ae65458b172f21fa4c03b [0,1,0,1,0,0|1,0,1]=4 1187 B10R1.61 CC(=O)N1CCCC[C@@H]1C 88289ec06bdb4324567eee30991d3abe [0,1,0,1,0,0|1,0,1]=4 1188 B10R1.61 CC(=O)N1CCCC[C@H]1C 3deac15cb8095a5a8513253ec4f9434f [0,1,0,1,0,0|1,0,1]=4 1189 B10R1.86 CCCN1CCC1C(=O)N 35d1b93e33c2b266d54f8780ed2b7ffa [0,1,0,1,0,0|1,0,1]=4 1190 B10R1.86 CCCN1CCC1C(=O)O 4b455e0294207b1a2bf667cca1518823 [0,1,0,1,0,0|1,0,1]=4 1191 B10R1.86 CCCN1CC[C@@H]1C(=O)N 2816a3560ebdcb13b04668ba0a938ba7 [0,1,0,1,0,0|1,0,1]=4 1192 B10R1.86 CCCN1CC[C@@H]1C(=O)O d13b2957294e68e46c0da3b6d0fff09d [0,1,0,1,0,0|1,0,1]=4 1193 B10R1.86 CCCN1CC[C@H]1C(=O)N 80639e7c53f8b8293ed9f7dceaa5030b [0,1,0,1,0,0|1,0,1]=4 1194 B10R1.86 CCCN1CC[C@H]1C(=O)O db973ca0f7546753e639c1a516b768cc [0,1,0,1,0,0|1,0,1]=4 1195 B10R1.219 CC(C)C(C=O)N1CCC1 e9f51915c5c2c6e45574c2ccb5d3c1f2 [0,1,0,1,0,0|1,0,1]=4 1196 B10R1.219 CCC(C(=O)N)N1CCC1 04469b6901af266c8ca77ccfa0991e1d [0,1,0,1,0,0|1,0,1]=4 1197 B10R1.219 CCN(C(=O)C)C1CCC1 d74d751c6d534bd09d4e150fce58e0d9 [0,1,0,1,0,0|1,0,1]=4 1198 B10R1.259 CC1CCN(C1(C)C)C=O c1f26f999c86df4912f7819c9070f08b [0,1,0,1,0,0|1,0,1]=4 1199 B10R1.348 CC(=O)N1CCCCCC1 bd008ed1d89241423499eab40b9ddd3a [0,1,0,1,0,0|1,0,1]=4 1200 B10R1.437 CCCNC1(CC1)C(=O)N a958a17663b25835911c4e48dfb6306f [0,1,0,1,0,0|1,0,1]=4 1201 B10R1.437 CCCNC1(CC1)C(=O)O d7743370848a4a76bdd1a77e54e73a4f [0,1,0,1,0,0|1,0,1]=4 1202 B10R1.469 C/C=C(\OC1CC1)/C(=O)O e150074a3a1722752a1a0e8967cf6651 [0,1,0,1,0,0|1,0,1]=4 1203 B10R1.469 CC(C)C(C=O)NC1CC1 369773409ed156bd3911f80a5a2f9902 [0,1,0,1,0,0|1,0,1]=4 1204 B10R1.469 CC(C)C(C=O)OC1CC1 8c8c505735ca9f88bafb0c53642efbf9 [0,1,0,1,0,0|1,0,1]=4 1205 B10R1.469 CCC(NC1CC1)C(=O)N 94ec0fd9e5b115f7db5da2e6b19120b4 [0,1,0,1,0,0|1,0,1]=4 1206 B10R1.469 CCC(NC1CC1)C(=O)O aed3ccecec3063d2090f29a94d5e6c2e [0,1,0,1,0,0|1,0,1]=4 1207 B10R1.469 CCC(OC1CC1)C(=O)N a4e869419fa21c94dae161bb269be259 [0,1,0,1,0,0|1,0,1]=4 1208 B10R1.469 CCC(OC1CC1)C(=O)O 45684648ff6a9c7bf86272fec1077ca3 [0,1,0,1,0,0|1,0,1]=4 1209 B10R1.469 CCN(CC1CC1)C(=O)C 8d6cc8b2beb6831aa626892f72ec4469 [0,1,0,1,0,0|1,0,1]=4 1210 B10R1.469 CC[C@@H](NC1CC1)C(=O)O 002e53c96fd6225cc878e01eada951ca [0,1,0,1,0,0|1,0,1]=4 1211 B10R1.469 CC[C@@H](OC1CC1)C(=O)O bbc01f7c1a305d5f6dbdbb55dab19bf1 [0,1,0,1,0,0|1,0,1]=4 1212 B10R1.469 CC[C@H](NC1CC1)C(=O)N 72867105bc1338f8a0a0432bb0140744 [0,1,0,1,0,0|1,0,1]=4 1213 B10R1.469 CC[C@H](NC1CC1)C(=O)O 3de61728ad6376c89279c83d6bbd0eca [0,1,0,1,0,0|1,0,1]=4 1214 B10R1.469 CC[C@H](OC1CC1)C(=O)O 78e789fb44518f093a1eccb8b8e94f82 [0,1,0,1,0,0|1,0,1]=4 1215 B10R1.30 CC1CCC(CN1C=O)O 7b005dd5eef9df2edfa5eb5e1ac782fd [0,1,0,1,0,0|1,0,1]=4 1216 B10R1.30 C[C@@H]1CC[C@H](CN1C=O)O afd6f269a6e3407d07512f25baf71ffe [0,1,0,1,0,0|1,0,1]=4 1217 B10R1.121 CCC(C=O)NC1CC1C 6b460a7003c32825c79f2980987f13d4 [0,1,0,1,0,0|0,0,2]=4 1218 B10R1.121 CCC(C=O)N[C@@H]1C[C@H]1F 6049002abbb0a9b12ff88974a7120d14 [0,1,0,1,0,0|1,0,1]=4 1219 B10R1.121 CCC(C=O)N[C@H]1C[C@@H]1F 5230fb120b511a4d1eaf662e5f597c0c [0,1,0,1,0,0|1,0,1]=4 1220 B10R1.121 CCC(C=O)N[C@H]1C[C@H]1F fb0956891480e81fe26379a1d3f70c40 [0,1,0,1,0,0|1,0,1]=4 1221 B10R1.122 CCC(C=O)NC1CCC1 8da97b05227ceb2d945ed7701aa05807 [0,1,0,1,0,0|0,0,2]=4 1222 B10R1.122 CCC(C=O)NC1COC1 06ca970ed4703b359057d095b699191f [0,1,0,1,0,0|1,0,1]=4 1223 B10R1.122 CCC(C=O)OC1CCC1 238e95c4370eb9b699ec550169709a01 [0,1,0,1,0,0|0,0,2]=4 1224 B10R1.122 CCC(C=O)OC1COC1 34a8f4bd94856de4728dce6056388b56 [0,1,0,1,0,0|1,0,1]=4 1225 B10R1.122 CCC(C=O)OC1CSC1 4825a6cc7a2ae52ca1eefa051383e2c9 [0,1,0,1,0,0|1,0,1]=4 1226 B10R1.162 O=CN1CCCCC(C1)O 6963e9a074f606b38dce3449384cb9be [0,1,0,1,0,0|1,0,1]=4 1227 B10R1.162 O=CN1CCCC[C@H](C1)O c542bdc034425e93cfcfd6a4821f5780 [0,1,0,1,0,0|1,0,1]=4 1228 B10R1.172 CCC1CCCN(C1)C=O ebb5f49a23f9ba47a405491329eb8ec3 [0,1,0,1,0,0|1,0,1]=4 1229 B10R1.172 CCC1CN(CCO1)C=O f8018d8cfb7077bc6b9f0e5e7372167c [0,1,0,1,0,0|1,0,1]=4 1230 B10R1.172 CC[C@@H]1CN(CCO1)C=O 390e2095dd36170fb72a7d5cd264e7ae [0,1,0,1,0,0|1,0,1]=4 1231 B10R1.172 CC[C@H]1CN(CCO1)C=O 8da636dfeeee1570cf8c01c0814bfb71 [0,1,0,1,0,0|1,0,1]=4 1232 B10R1.176 CC1CCN(CC1O)C=O d5f48301a87769511e2a5cfb323fec6d [0,1,0,1,0,0|1,0,1]=4 1233 B10R1.176 C[C@@H]1CCN(C[C@@H]1O)C=O 5c05d1905416723ded5c27a877a60d26 [0,1,0,1,0,0|1,0,1]=4 1234 B10R1.176 C[C@@H]1CCN(C[C@H]1O)C=O 6fbbe27cfdd366fc29bd762ca5d56bb3 [0,1,0,1,0,0|1,0,1]=4 1235 B10R1.176 C[C@H]1CCN(C[C@@H]1O)C=O e449325255df37632a68e029ef16c8b7 [0,1,0,1,0,0|1,0,1]=4 1236 B10R1.176 C[C@H]1CCN(C[C@H]1O)C=O 6636344910345cf4445cbbd06d804ffe [0,1,0,1,0,0|1,0,1]=4 1237 B10R1.273 CCC(C=O)NC1(CC1)C 91a5939a18478ba9c326a647b549ac39 [0,1,0,1,0,0|1,0,1]=4 1238 B10R1.463 CCC(C)OC1CCC1=O 0e09bc8c783183c62fe0c3e62a849285 [0,1,0,1,0,0|1,0,1]=4 1239 B10R1.521 CCC1(CCN(C1)C=O)C 412eb05ec0c0823f77393beabba2cfcc [0,1,0,1,0,0|1,0,1]=4 1240 B10R1.521 CCC1(CCN(C1)C=O)F 480ffff5c43a769f45722d54ca9db400 [0,1,0,1,0,0|1,0,1]=4 1241 B10R1.5 CCCC1SCCN1C=O e719891fa385a47d81fa2e22c9d8eae7 [0,1,0,1,0,0|1,0,1]=4 1242 B10R1.5 CCNc1n[nH]cc1CC f73b1cfe05ef2f3fd7f210f13e8fbdfa [0,1,0,1,0,0|2,0,0]=4 1243 B10R1.5 CCNc1oncc1CC fdd4b3980fa8eb2a38069523154c516d [0,1,0,1,0,0|1,0,1]=4 1244 B10R1.9 CCC(C=O)N1CCSC1 c647c1f7d6ecbd2513db52d751c979c6 [0,1,0,1,0,0|1,0,1]=4 1245 B10R1.9 CCN(C=O)C1CCCC1 cda5aedd9dcfdaed6026628a0b488231 [0,1,0,1,0,0|1,0,1]=4 1246 B10R1.9 CCN(C=O)C1CCOC1 c81ec2b743884b1d85222d3835a5a48b [0,1,0,1,0,0|1,0,1]=4 1247 B10R1.125 CCC(C=O)N1CC(C1)F bc255f445cc2602b90f6b8e343ff14a8 [0,1,0,1,0,0|1,0,1]=4 1248 B10R1.125 CCC(C=O)N1CC(C1)O 8bb2dec1be871b558b6b6c03730c4f72 [0,1,0,1,0,0|1,0,1]=4 1249 B10R1.222 CCC(C=O)N(C)C1CC1 b7e21437b17834a99ebf8f3d6eae99cc [0,1,0,1,0,0|1,0,1]=4 1250 B10R1.222 CCN(C=O)C(C)C1CC1 5a487bafb22b24805078c23a87670a24 [0,1,0,1,0,0|1,0,1]=4 1251 B10R1.245 CC1CCCC(N1C=O)C 1a30b5cb607c77faa4597603dd875d8f [0,1,0,1,0,0|1,0,1]=4 1252 B10R1.245 C[C@@H]1CCC[C@@H](N1C=O)C a6d663435f3f86501af6d316ae61f032 [0,1,0,1,0,0|1,0,1]=4 1253 B10R1.245 C[C@@H]1CCC[C@H](N1C=O)C 854deca45d05ea72b33eea6028c2f268 [0,1,0,1,0,0|1,0,1]=4 1254 B10R1.245 C[C@H]1CCC[C@@H](N1C=O)C 622b818546739aa55bd37329ec1c59c9 [0,1,0,1,0,0|1,0,1]=4 1255 B10R1.258 CC1C(CCN1C=O)CO 40fad83f46632e052bc970fa34ad8ec5 [0,1,0,1,0,0|1,0,1]=4 1256 B10R1.258 C[C@H]1[C@@H](CCN1C=O)CO 7778ec7fae3262a66eb8afb697ce197b [0,1,0,1,0,0|1,0,1]=4 1257 B10R1.258 C[C@H]1[C@H](CCN1C=O)CO bf087cffebf777e2a1ce1c7871cc17b1 [0,1,0,1,0,0|1,0,1]=4 1258 B10R1.1 CC1CCC(CC1)NC=O 49445304b581de601fa04023a9c9fe9e [0,1,0,1,0,0|0,0,2]=4 1259 B10R1.1 CC1CCN(CC1)CC=O b2df6192e65646884c09da6cd5a6a8ec [0,1,0,1,0,0|1,0,1]=4 1260 B10R1.1 C[C@H]1CC[C@@H](CC1)NC=O 7b9d3006b1003937c69a824430f79b59 [0,1,0,1,0,0|0,0,2]=4 1261 B10R1.1 C[C@H]1CC[C@H](CC1)NC=O 2e46076871a33ec81e210eee2940299a [0,1,0,1,0,0|0,0,2]=4 1262 B10R1.4 CC1CCCCC1NC=O 4fd9fa7a65ca398ed79f81ac509c8018 [0,1,0,1,0,0|0,0,2]=4 1263 B10R1.4 CC1CCCCN1CC=O 62c0bbb8af52ea1fa506ef64adafd791 [0,1,0,1,0,0|1,0,1]=4 1264 B10R1.4 CCOC1CCCCC1=O 507ef4f19e89191dc15f42fb27f687ef [0,1,0,1,0,0|0,0,2]=4 1265 B10R1.4 C[C@@H]1CCCCN1CC=O 814ac02c18c447f025bc8aee73a1045b [0,1,0,1,0,0|1,0,1]=4 1266 B10R1.4 C[C@@H]1CCCC[C@@H]1NC=O cdefab676ed956f0f985e780591b60ff [0,1,0,1,0,0|0,0,2]=4 1267 B10R1.4 C[C@@H]1CCCC[C@H]1NC=O f829a42871a4ab0b9776c06cd36de92b [0,1,0,1,0,0|0,0,2]=4 1268 B10R1.4 C[C@H]1CCCCN1CC=O 6f5ce6f7d96182cae349a65a68bdd503 [0,1,0,1,0,0|1,0,1]=4 1269 B10R1.4 C[C@H]1CCCC[C@@H]1NC=O 6df21a0e3e8e89c2bca8e0d82625af9a [0,1,0,1,0,0|0,0,2]=4 1270 B10R1.4 C[C@H]1CCCC[C@H]1NC=O 19f2468f008fbcdafda27b73fe3a043b [0,1,0,1,0,0|0,0,2]=4 1271 B10R1.16 CCCOC1=CC(=O)CC1 a2353883a2bd2b42e0a88c8646a1e90b [0,1,0,1,0,0|1,0,0]=3 1272 B10R1.16 CCCOC1=CC(=O)NC1 569531b643bfafeec4dbbf8109f7ba8e [0,1,0,1,0,0|2,0,0]=4 1273 B10R1.16 CCCOC1CCC(=O)C1 0118665d271ddbcc63e9ba5f111fa1f6 [0,1,0,1,0,0|1,0,1]=4 1274 B10R1.16 COCOC1=CC(=O)CC1 438c9509f766d67fe1e4c65e974b7432 [0,1,0,1,0,0|2,0,0]=4 1275 B10R1.16 CSCOC1=CC(=O)CC1 c6fbd2a22c2e376b9e078a11836cb4c7 [0,1,0,1,0,0|2,0,0]=4 1276 B10R1.16 O=C1C=C(CC1)OCCS f163a17e6f28896ca0ffc84b99a3f64e [0,1,0,1,0,0|2,0,0]=4 1277 B10R1.20 CCC1CCCCN1C=O 27a4a5b5f21fa731674f9aa01a3c227e [0,1,0,1,0,0|0,0,2]=4 1278 B10R1.20 CCN1CCCCC1C=O 57d72406aab1a9f4330e5d48c26c2322 [0,1,0,1,0,0|0,0,2]=4 1279 B10R1.20 CC[C@@H]1CCCCN1C=O 1d50945c7648c106577c77f3f40d5082 [0,1,0,1,0,0|0,0,2]=4 1280 B10R1.20 CC[C@H]1CCCCN1C=O 8ae182ce76973d922887541423f6cc7c [0,1,0,1,0,0|0,0,2]=4 1281 B10R1.20 O=CN1CCCCC1CO 07e2943a686a28971f94c77c32e8d4ac [0,1,0,1,0,0|1,0,1]=4 1282 B10R1.20 O=CN1CCCC[C@@H]1CO 0bc87d4b55d8a4380a897b91dfec074b [0,1,0,1,0,0|1,0,1]=4 1283 B10R1.20 O=CN1CCCC[C@H]1CO e2cc28d054fc52fba804f3f9d95f0e67 [0,1,0,1,0,0|1,0,1]=4 1284 B10R1.67 CCN(CC=O)C1CCC1 dc202b8fccb4146449274b9b0672ab44 [0,1,0,1,0,0|1,0,1]=4 1285 B10R1.67 O=CN(CCO)C1CCC1 fc214083481c1f4ecf648e0177f59628 [0,1,0,1,0,0|1,0,1]=4 1286 B10R1.69 CCCN(C=O)CC1CC1 0787010b32c82f57eae980fd55561b46 [0,1,0,1,0,0|1,0,1]=4 1287 B10R1.69 CCN(CC=O)CC1CC1 923ffa85a4a15b5afd988321249ab3e8 [0,1,0,1,0,0|1,0,1]=4 1288 B10R1.69 O=CN(CCO)CC1CC1 1a8f4e2398cdc6c9a3fa403bfb43628f [0,1,0,1,0,0|1,0,1]=4 1289 B10R1.85 O=CCN1CCCCCC1 f724e4ec53ccca226b2bc57eaef06e6e [0,1,0,1,0,0|1,0,1]=4 1290 B10R1.85 O=CNC1CCCCCC1 113187389de6916fbb9a078d48160950 [0,1,0,1,0,0|0,0,2]=4 1291 B10R1.96 CCC1CCN(C1)CC=O e0f4d32e9b7eab84e498178b13c94775 [0,1,0,1,0,0|1,0,1]=4 1292 B10R1.96 CCCC1CCN(C1)C=O 1ca2ffad4e158b463296876152d0a61e [0,1,0,1,0,0|1,0,1]=4 1293 B10R1.96 CCNc1cnn(c1)CC 9aa2b4991023db7e0fe6b245b99ae749 [0,1,0,1,0,0|2,0,0]=4 1294 B10R1.96 CCNc1ncc([nH]1)CC 14312cbb3af9a8a1cfe8069a14412610 [0,1,0,1,0,0|2,0,0]=4 1295 B10R1.96 CCNc1ncc(s1)CC 8c072929a7bf77e9c9ed474f2306e747 [0,1,0,1,0,0|2,0,0]=4 1296 B10R1.96 CCO[C@@H]1CCN(C1)C=O d6cd9bb8dd63a265edecb714702d92ad [0,1,0,1,0,0|1,0,1]=4 1297 B10R1.96 CCO[C@H]1CCN(C1)C=O 886748265175ab436036ed27206e8893 [0,1,0,1,0,0|1,0,1]=4 1298 B10R1.96 CCOc1cnn(c1)CC ea97dfe3e6a1503422888082f61f8ffb [0,1,0,1,0,0|2,0,0]=4 1299 B10R1.96 CCOn1cc(cn1)CC 243afd4b5d780b955b2d9835ece162aa [0,1,0,1,0,0|2,0,0]=4 1300 B10R1.96 COCC1CCN(C1)C=O c8e5f339f66fe1f44ba9e304ef171ad9 [0,1,0,1,0,0|1,0,1]=4 1301 B10R1.96 COC[C@@H]1CCN(C1)C=O 3374d991d03e4971a18b7835cf62da10 [0,1,0,1,0,0|1,0,1]=4 1302 B10R1.96 COC[C@H]1CCN(C1)C=O 918b3b9eb07979e8a3139f789d1a84fc [0,1,0,1,0,0|1,0,1]=4 1303 B10R1.96 O=CN1CCC(C1)CCO 210e45c122f601e5105361eb59c95fa2 [0,1,0,1,0,0|1,0,1]=4 1304 B10R1.161 O=CN1CCCCCCC1 14239ffff398bd6f4a702e6ce486d956 [0,1,0,1,0,0|1,0,1]=4 1305 B10R1.197 CC1CCCN(CC1)C=O 377760f9fe9460ff48ba55e169ecc323 [0,1,0,1,0,0|1,0,1]=4 1306 B10R1.197 CN1CCCN(CC1)C=O dae680ef23b42ac483237fa402772a79 [0,1,0,1,0,0|1,0,1]=4 1307 B10R1.197 O=CN1CCCC(CC1)F 063cb542d0437eea52ad7ed38fb65de0 [0,1,0,1,0,0|1,0,1]=4 1308 B10R1.197 O=CN1CCCC(CC1)O cb48dbbabe7a1d17ce4f711ff2fc4ea5 [0,1,0,1,0,0|1,0,1]=4 1309 B10R1.197 O=CN1CCC[C@@H](CC1)O f1679d0bd86c075edcc421e88fc1e969 [0,1,0,1,0,0|1,0,1]=4 1310 B10R1.197 O=CN1CCC[C@H](CC1)O 52e26b23698adace6455f16a782f5f0f [0,1,0,1,0,0|1,0,1]=4 1311 B10R1.217 CCCN[C@@H]1CN(C1=O)C 3b1aa9e435499b72ae2d8185eacbee04 [0,1,0,1,0,0|1,0,1]=4 1312 B10R1.217 CCCN[C@H]1CN(C1=O)C 09e77dfb1967ba72f2765041abe621ad [0,1,0,1,0,0|1,0,1]=4 1313 B10R1.26 CC1(CCN(CC1)C=O)C 0194f75d9307792a3ab2ffe537fb7f67 [0,1,0,1,0,0|1,0,1]=4 1314 B10R1.26 CC1(CCN(CC1)C=O)O 77a2e5cdf190f7f869e2455e3c5afa35 [0,1,0,1,0,0|1,0,1]=4 1315 B10R1.117 CC(C)COC1CCC1=O 558a6072da058795dec9aa4425f836f1 [0,1,0,1,0,0|1,0,1]=4 1316 B10R1.123 CCC(C=O)NCC1CC1 36e362908749ff6a25cc3d965a627efd [0,1,0,1,0,0|0,0,2]=4 1317 B10R1.123 CCC(C=O)OCC1CC1 14bf8e98bb18dfa5b3e6df5de3388929 [0,1,0,1,0,0|0,0,2]=4 1318 B10R1.220 CC1N(CCC1(C)C)C=O bfc0ab9cd61a93ea75bea42e61fa5abf [0,1,0,1,0,0|1,0,1]=4 1319 B10R1.341 CCC(C=O)N1CC1(C)C a22dc67dc3a9680f3fb884a8c12a9b95 [0,1,0,1,0,0|1,0,1]=4 1320 B10R1.2 CC1C(CCCN1C=O)O 2a1b9d864824c13b5925eaf663265aef [0,1,0,1,0,0|1,0,1]=4 1321 B10R1.2 C[C@@H]1[C@H](CCCN1C=O)O 6d7541523fecb90672f86793cf69bd27 [0,1,0,1,0,0|1,0,1]=4 1322 B10R1.2 C[C@H]1[C@@H](CCCN1C=O)O b9b4b3538f04b83d7d0b8cfff1133139 [0,1,0,1,0,0|1,0,1]=4 1323 B10R1.3 CCC1CCN(CC1)C=O 0f7c00c20a40ae5056ab69ed4bc07700 [0,1,0,1,0,0|1,0,1]=4 1324 B10R1.3 CCN1CCC(CC1)C=O e42114532df26d87ab8a26f60a4b1426 [0,1,0,1,0,0|0,0,2]=4 1325 B10R1.3 CCN1CCN(CC1)C=O a907c861275211bf3ed4ef4da9bc0ab2 [0,1,0,1,0,0|1,0,1]=4 1326 B10R1.3 COC1CCN(CC1)C=O 07d7cb870935d90e38ad35f0a6eb9b82 [0,1,0,1,0,0|1,0,1]=4 1327 B10R1.3 CSC1CCN(CC1)C=O 11b9fcae91ab5d1a4133fd147f7b0f5b [0,1,0,1,0,0|1,0,1]=4 1328 B10R1.3 O=CN1CCC(CC1)CF b5e9f7ea89b20572159450e444de774d [0,1,0,1,0,0|1,0,1]=4 1329 B10R1.3 O=CN1CCC(CC1)CO 85c7636c0351ce49e83341d18a100be6 [0,1,0,1,0,0|1,0,1]=4 1330 B10R1.21 CCOCC=C1CCCC1 c7ecf6e376b55aab1b0498f4c33f1ace [0,1,0,1,0,0|1,0,1]=4 1331 B10R1.37 CCCCOC1CCC1=O 54fa09992c0cf82b2f331559841e5a88 [0,1,0,1,0,0|0,0,2]=4 1332 B10R1.37 CCCOCC1CCC1=O 19da4a17dced4d587116c3b122806666 [0,1,0,1,0,0|0,0,2]=4 1333 B10R1.37 CCOCCC1CCC1=O fecdaedd24e92cffd0bcb6852fce52db [0,1,0,1,0,0|0,0,2]=4 1334 B10R1.37 COCCNC1CCC1=O 61e0a2ac30ce0eb2c99ac3bb09170557 [0,1,0,1,0,0|1,0,1]=4 1335 B10R1.37 COCCOC1CCC1=O b7cf68f8e50ed0f73ae35b4a392be8d2 [0,1,0,1,0,0|1,0,1]=4 1336 B10R1.37 CSCCOC1CCC1=O 17db54454de6a7eed9f072ef27ad27cf [0,1,0,1,0,0|1,0,1]=4 1337 B10R1.37 O=C1CCC1NCCCO c49719a977cf7c804450fef813611fe9 [0,1,0,1,0,0|1,0,1]=4 1338 B10R1.37 O=C1CCC1OCCCF 982dd84168c3f8c5e3e5ba1f08c83369 [0,1,0,1,0,0|1,0,1]=4 1339 B10R1.37 O=C1CCC1OCCCS 6a0decbc67e7cdc4e73f7311f68f45cb [0,1,0,1,0,0|1,0,1]=4 1340 B10R1.459 CCCOCC1(CC1)C=O aebd6b47b63854ef2dd02b9366e0e5ea [0,1,0,1,0,0|0,0,2]=4 1341 B10R2.109 O=CN1CCC2CC2C1 2db05f41517837ccff5ea5089c869488 [0,0,0,2,0,0|1,0,1]=4 1342 B10R2.121 O=CN1CC2C1CCC2 24cc6612b07c8fd5c9f9245a97bc7ac2 [0,0,0,2,0,0|1,0,1]=4 1343 B10R2.121 O=CN1C[C@H]2[C@@H]1CCC2 652292e7a4af76f3cd3b626ea0acfbba [0,0,0,2,0,0|1,0,1]=4 1344 B10R2.99 O=CN1CC2CCC1C2 fb6b7e0ef92e42506c098017125b9993 [0,0,0,2,0,0|1,0,1]=4 1345 B10R2.99 O=CN1C[C@@H]2CC[C@H]1C2 bac69a458f156f15a1ea0f7ccd77ffe5 [0,0,0,2,0,0|1,0,1]=4 1346 B10R2.99 O=CN1C[C@H]2CC[C@@H]1C2 01fb5bef17589312025e69c77444e0a6 [0,0,0,2,0,0|1,0,1]=4 1347 B10R2.93 O=CN1CC2CCC2C1 7b0c64dcb7089babd3da929e11b61c77 [0,0,0,2,0,0|1,0,1]=4 1348 B10R2.403 O=CN1CCC2(C1)CC2 9e5ac4c5fba967bc0bd73a56cf966402 [0,0,0,2,0,0|1,0,1]=4 1349 B10R2.513 O=CN1C2C1CCCC2 0c0fd4316eddea7e8beb4111dd8a3203 [0,0,0,2,0,0|1,0,1]=4