0 B7R0.2 C#CC(C)NC(=O)C 30a91f9e689320cab67e7176279a027a [0,0,0,0,0,0|2,0,2]=4 1 B7R0.2 C#C[C@@H](C)NC(=O)C b5f4cb4c2ca82f0d4e132f2977db08a6 [0,0,0,0,0,0|2,0,2]=4 2 B7R0.2 C#C[C@H](C)NC(=O)C adfc3d71c946a289355ab55f3775ec5f [0,0,0,0,0,0|2,0,2]=4 3 B7R0.2 C=C(Br)CN(C)CC a95e900b3ccec6668bc411630f5decf3 [0,0,0,0,0,0|3,0,0]=3 4 B7R0.2 C=C(C)CN(C)CC f46aa4737385fde5ecca127cfe0fb11b [0,0,0,0,0,0|3,0,0]=3 5 B7R0.2 C=C(Cl)CN(C)CC 85a42652568d865a3db0ed61404dde1c [0,0,0,0,0,0|3,0,0]=3 6 B7R0.2 C=CC(C)NC(=O)C da0f45e746fe5ddfb85b752dba1a7d5c [0,0,0,0,0,0|2,0,2]=4 7 B7R0.2 CC(=O)NC(C)C#N 5c82a898464bc97e12136e75988ac4b5 [0,0,0,0,0,0|3,0,1]=4 8 B7R0.2 CC(=O)NC(C)CO 5b33fe0ccef9f04a2ffcb97aafaea882 [0,0,0,0,0,0|3,0,0]=3 9 B7R0.2 CC(=O)N[C@@H](C)CO 6858caa5d94a6988c3c1bcaa83d0b2b8 [0,0,0,0,0,0|3,0,0]=3 10 B7R0.2 CC(=O)N[C@H](C)CO 0b20f01b94b45fad0762ce944038f07e [0,0,0,0,0,0|3,0,0]=3 11 B7R0.2 CC(O)CN(C)CF c09526189cafd23891f682c66649d125 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.2 CC(O)CN(C)CO 3b7f6558a4b553a3af9a1035d866a39e [0,0,0,0,0,0|3,0,1]=4 13 B7R0.2 CCC(C)NC(=O)C d52a9bb324dcdb60d53e4e9e2013cb50 [0,0,0,0,0,0|2,0,0]=2 14 B7R0.2 CCC(C)NC(C)C 0cb605662148972b343a2865e41d2f95 [0,0,0,0,0,0|3,0,1]=4 15 B7R0.2 CCC(C)OC(C)C 06c7f52afdb28395f9fa9574a364e474 [0,0,0,0,0,0|3,0,1]=4 16 B7R0.2 CCN(C)CC(=O)N 58c4f2962e11e395e9dd8c9fccee33dd [0,0,0,0,0,0|2,0,0]=2 17 B7R0.2 CCN(C)CC(=O)O ed00a192e609f5d5786e1c989c44eb8f [0,0,0,0,0,0|1,0,0]=1 18 B7R0.2 CCN(C)CC(C)C b1801f5d5c3a2fe65e0c5338da1b288f [0,0,0,0,0,0|3,0,1]=4 19 B7R0.2 CCN(C)CC(C)O 22c796f149474196e01f5a861b83c652 [0,0,0,0,0,0|2,0,1]=3 20 B7R0.2 CCN(C)CC(F)F ffb0011f568ae55bb7bb9747777b52af [0,0,0,0,0,0|3,0,1]=4 21 B7R0.2 CCN(C)CN(C)C f99659c98f126cf47210322e6b249111 [0,0,0,0,0,0|4,0,0]=4 22 B7R0.2 CCN(C)C[C@@H](C)O e1fc7c21afedf382169569842ae9d9da [0,0,0,0,0,0|2,0,1]=3 23 B7R0.2 CCN(C)C[C@H](C)O 2fe5de7e3e442679b65eac3f37bae166 [0,0,0,0,0,0|2,0,1]=3 24 B7R0.2 CCN(C)C[N+](=O)[O-] 1747c815c0bddd9b3eea2e8a91b60fbe [0,0,0,0,0,0|2,0,1]=3 25 B7R0.2 CC[C@@H](C)NC(=O)C c6d5d80303dcfd2ae6eb945ac41b31c0 [0,0,0,0,0,0|2,0,0]=2 26 B7R0.2 CC[C@@H](C)NC(C)C fbd46dfde63f10a9f545bd04d72d3565 [0,0,0,0,0,0|3,0,1]=4 27 B7R0.2 CC[C@@H](C)OC(C)C be2816eab25b2a9101da766270106c57 [0,0,0,0,0,0|3,0,1]=4 28 B7R0.2 CC[C@H](C)NC(=O)C 96d2ad332d2a7d6643a2730e644df4f3 [0,0,0,0,0,0|2,0,0]=2 29 B7R0.2 CC[C@H](C)NC(C)C df85b8e0c4ded03d149c43327f4a7c4a [0,0,0,0,0,0|3,0,1]=4 30 B7R0.2 CC[C@H](C)OC(C)C 2c6d159b250df3bb005afd7417a4b5dc [0,0,0,0,0,0|3,0,1]=4 31 B7R0.2 CN(C=O)CC(=O)N 647b1daaec1cafb5c97dc5a4d13d2291 [0,0,0,0,0,0|3,0,1]=4 32 B7R0.2 CN(CF)CC(=O)N 35f09c99eb4485b888503c93a96568a5 [0,0,0,0,0,0|3,0,0]=3 33 B7R0.2 CN(CF)CC(=O)O 7d1eb1d71c500640f6029a70869bff49 [0,0,0,0,0,0|2,0,0]=2 34 B7R0.2 CN(CO)CC(=O)N 731e626c7cf4b35c02c8b97f3321d2b5 [0,0,0,0,0,0|3,0,0]=3 35 B7R0.2 CN(CO)CC(=O)O e8788fe9a5132c43f9e5136dbe3278ce [0,0,0,0,0,0|2,0,0]=2 36 B7R0.2 C[C@H](O)CN(C)CF 5a09021deee6ed4ea8f52ce12dc22c90 [0,0,0,0,0,0|3,0,1]=4 37 B7R0.2 C[C@H](O)CN(C)CO c3ae4b5b307547a59cb2b787e087330e [0,0,0,0,0,0|3,0,1]=4 38 B6R0.1 C#CC(C)NC=O 50c944dc0c2f52246cf2f8b75f249da5 [1,0,0,0,0,0|1,0,2]=4 39 B6R0.1 C#CCN(C)CC df628b2fb59d020a233c7468342e16c7 [1,0,0,0,0,0|2,0,1]=4 40 B6R0.1 C#C[C@@H](C)NC=O 4fee702505a1fdefb270b5b6e9eb7aa3 [1,0,0,0,0,0|1,0,2]=4 41 B6R0.1 C#C[C@H](C)NC=O 55f7e717dc246fc1c154a9332387447d [1,0,0,0,0,0|1,0,2]=4 42 B6R0.1 C=CC(C)NC=O ea3bd8a0f1437d84f5ea96318c16e9bd [1,0,0,0,0,0|1,0,2]=4 43 B6R0.1 C=CCN(C)CC 66590de6b708bb2b2b2945a656dd0b8f [1,0,0,0,0,0|2,0,0]=3 44 B6R0.1 C=CCN(C)CF 7e02e3a96da7141f47b832fca75c32a8 [1,0,0,0,0,0|3,0,0]=4 45 B6R0.1 C=CCN(C)CO e638b434bf874996eb81f2689695f38f [1,0,0,0,0,0|3,0,0]=4 46 B6R0.1 CC(C#N)NC=O bab971dbe2c7155864d30c197f73349b [1,0,0,0,0,0|2,0,1]=4 47 B6R0.1 CC(CO)NC=O 6cb3b07738b3559c75de386eaa588767 [1,0,0,0,0,0|2,0,0]=3 48 B6R0.1 CC(CO)NCO 220515de56991eed80ebf3de2b03eb11 [1,0,0,0,0,0|2,0,1]=4 49 B6R0.1 CCC(C)NC#N c755bc17a86225b89fbcb7b323cbfbb8 [1,0,0,0,0,0|2,0,1]=4 50 B6R0.1 CCC(C)NC=O b39ff0b918608a651b17fb1bcfe748b2 [1,0,0,0,0,0|1,0,0]=2 51 B6R0.1 CCC(C)NCF cd789606d14d277b4095dc11d6d1f629 [1,0,0,0,0,0|2,0,1]=4 52 B6R0.1 CCC(C)NCO 2f150bbe96920869e15d5d5aa816b484 [1,0,0,0,0,0|1,0,1]=3 53 B6R0.1 CCC(C)OCF b1f4704464bbfd0265fa8845c1d734e2 [1,0,0,0,0,0|2,0,1]=4 54 B6R0.1 CCCN(C)CC 063caa89be0fdd356f6455d1751457ac [1,0,0,0,0,0|2,0,1]=4 55 B6R0.1 CCN(C)CC#N 2853a7af5707f71aff1eef2c0f44a019 [1,0,0,0,0,0|2,0,1]=4 56 B6R0.1 CCN(C)CC=O 027065f0dd139518bb2cdfff7d6533ae [1,0,0,0,0,0|1,0,0]=2 57 B6R0.1 CCN(C)CCF 15aa448f2958342e872fe1eff4da2f7c [1,0,0,0,0,0|2,0,1]=4 58 B6R0.1 CCN(C)CCO d3ce6c3bd65198b22911f821b13f3685 [1,0,0,0,0,0|1,0,1]=3 59 B6R0.1 CCN(C)CCS 1ccbd256497b3a342f1d9474525ca49a [1,0,0,0,0,0|1,1,1]=4 60 B6R0.1 CCN(C)COC 2dba1e0fec030895fe26248c793df52e [1,0,0,0,0,0|3,0,0]=4 61 B6R0.1 CCN(C)CSC 613c63b39ee46a6bdda90b076e70e35a [1,0,0,0,0,0|3,0,0]=4 62 B6R0.1 CCNC(C)CC 396d13a5c682c09283d5fcc86ff55a86 [1,0,0,0,0,0|2,0,1]=4 63 B6R0.1 CCN[C@@H](C)CC 8864275bc593322b499f8ffa253a175e [1,0,0,0,0,0|2,0,1]=4 64 B6R0.1 CCN[C@H](C)CC 2ca98ce961a0f1b51c5b9bb18e4cf730 [1,0,0,0,0,0|2,0,1]=4 65 B6R0.1 CCOC(C)CC 56a4de537882754d70714e008cda003f [1,0,0,0,0,0|2,0,1]=4 66 B6R0.1 CCO[C@@H](C)CC 1c34d8425f39e9be808db66bb381a14c [1,0,0,0,0,0|2,0,1]=4 67 B6R0.1 CCO[C@H](C)CC 08a1e8fcc5a32008da3650c30e1472a7 [1,0,0,0,0,0|2,0,1]=4 68 B6R0.1 CC[C@@H](C)NC=O b2daaabeaf297395c554f58ded1a06ac [1,0,0,0,0,0|1,0,0]=2 69 B6R0.1 CC[C@@H](C)NCF 6dbb95a50e3976893bdb1627db012fbb [1,0,0,0,0,0|2,0,1]=4 70 B6R0.1 CC[C@@H](C)NCO ac0974a6f9b0bb6d16f90be7439490a9 [1,0,0,0,0,0|1,0,1]=3 71 B6R0.1 CC[C@@H](C)OCF f4fa7810a1d84f0f9cde4476fd8e3f60 [1,0,0,0,0,0|2,0,1]=4 72 B6R0.1 CC[C@H](C)NC=O de5ee03736ab09026768085a3122631f [1,0,0,0,0,0|1,0,0]=2 73 B6R0.1 CC[C@H](C)NCF 5d430afc33b47de08bdee5a967987e85 [1,0,0,0,0,0|2,0,1]=4 74 B6R0.1 CC[C@H](C)NCO 3a0d2629be7074b261ab0759e7061769 [1,0,0,0,0,0|1,0,1]=3 75 B6R0.1 CC[C@H](C)OCF 7272126d7b60c9c2f9744715a5cbda1c [1,0,0,0,0,0|2,0,1]=4 76 B6R0.1 CN(CF)CCO 45c87519ddef71b395da19084a38f5b6 [1,0,0,0,0,0|2,0,1]=4 77 B6R0.1 CN(CO)CCO 54f662b94257417f82a22aa2c84d65c3 [1,0,0,0,0,0|2,0,1]=4 78 B6R0.1 C[C@@H](CO)NC=O ec3f1323844b2b166f286f44082a1734 [1,0,0,0,0,0|2,0,0]=3 79 B6R0.1 C[C@@H](CO)NCO f2447992c21252c0f96361e913fb5f29 [1,0,0,0,0,0|2,0,1]=4 80 B6R0.1 C[C@H](CO)NC=O 3cbedcbe22de2e07327f619fdeffeaec [1,0,0,0,0,0|2,0,0]=3 81 B6R0.1 C[C@H](CO)NCO 8d1246dd802e302de647e53829f5ca23 [1,0,0,0,0,0|2,0,1]=4 82 B6R0.4 C=C(Br)CNCC 6e3319104262483598a48b6dc3c212f9 [1,0,0,0,0,0|3,0,0]=4 83 B6R0.4 C=C(Br)COCC 4e277d2c9c73644afe7a0bce57cdf0b5 [1,0,0,0,0,0|3,0,0]=4 84 B6R0.4 C=C(C)CNCC ebc18c3c665b43c324efb5852b5613cc [1,0,0,0,0,0|3,0,0]=4 85 B6R0.4 C=C(C)COCC 6d74b37620be58d1bea5b1911ab2feb1 [1,0,0,0,0,0|3,0,0]=4 86 B6R0.4 C=C(Cl)COCC 7e83f9548d27b7a69b77fbea42966073 [1,0,0,0,0,0|3,0,0]=4 87 B6R0.4 C=C(F)COCC 1657b1ef40f20a415ed1946b6e445fbb [1,0,0,0,0,0|3,0,0]=4 88 B6R0.4 C=C(I)COCC 91286c7e570d24c12cb1f7709ecbaf14 [1,0,0,0,0,0|3,0,0]=4 89 B6R0.4 CC(=O)CNCF b7881e88fb8b8e6cf10e5a033e11f317 [1,0,0,0,0,0|3,0,0]=4 90 B6R0.4 CC(=O)CNCO 088e087d20fb510bb88def586900e34f [1,0,0,0,0,0|3,0,0]=4 91 B6R0.4 CC(=O)COCF dfbfbe0c756744937aaeae603856ac60 [1,0,0,0,0,0|3,0,0]=4 92 B6R0.4 CC(=O)NCCBr a50b84b8e00a5eea33926a7cde86e5c2 [1,0,0,0,0,0|3,0,0]=4 93 B6R0.4 CC(=O)NCCF 40474d3cc8ff0aef7c3ef76344b9eebb [1,0,0,0,0,0|3,0,0]=4 94 B6R0.4 CC(=O)NCCI baf3590450994f173452759880fb646a [1,0,0,0,0,0|3,0,0]=4 95 B6R0.4 CC(=O)NCCO c7b03ecf194f0f03f4d08fd319920ef5 [1,0,0,0,0,0|3,0,0]=4 96 B6R0.4 CC(=O)NCCS 3cdd66626928bc1a9bac11e682b344a1 [1,0,0,0,0,0|3,0,0]=4 97 B6R0.4 CCCNC(=O)C 2a730f252c249036b45b0d2d9cd73ca4 [1,0,0,0,0,0|2,0,0]=3 98 B6R0.4 CCNCC(=O)C f174d94c45d739e3b909d0bcb7f774b6 [1,0,0,0,0,0|2,0,0]=3 99 B6R0.4 CCNCC(=O)N 9af72e08b410c4df60bd96241a267974 [1,0,0,0,0,0|2,0,0]=3 100 B6R0.4 CCNCC(=O)O 4ff54ca579c6d0dc364629f4b9806db8 [1,0,0,0,0,0|1,0,0]=2 101 B6R0.4 CCNCC(C)O 23f38b24d1514a42c01693786c45a1e6 [1,0,0,0,0,0|2,0,1]=4 102 B6R0.4 CCNC[C@@H](C)O 72a96453a23c9791f4ab7ea0647d5c76 [1,0,0,0,0,0|2,0,1]=4 103 B6R0.4 CCNC[C@H](C)O 8a893664491d34251811ef315cfcf0f6 [1,0,0,0,0,0|2,0,1]=4 104 B6R0.4 CCOCC(=O)C 810b545b1a0c4af358d406c93928b4de [1,0,0,0,0,0|2,0,0]=3 105 B6R0.4 CCOCC(=O)N 8c3995d7bbe4bbb5793da2590cf6473e [1,0,0,0,0,0|2,0,0]=3 106 B6R0.4 CCOCC(=O)O ebe16b0612391447f19756491b2bd7a3 [1,0,0,0,0,0|1,0,0]=2 107 B6R0.4 CCOCC(=S)N 193178db836031b13efc39b5ff902efa [1,0,0,0,0,0|2,1,0]=4 108 B6R0.4 CCOCS(=O)O 631a28bb34068ba6343c83c466f36b33 [1,0,0,0,0,0|2,0,0]=3 109 B6R0.4 N#CNCC(=O)O 43756775e2c27a3310cd33c2c2160b96 [1,0,0,0,0,0|2,0,1]=4 110 B6R0.4 NC(=O)CNCF 1d1f788bdfbf1bf0db2a27d18231d6bd [1,0,0,0,0,0|3,0,0]=4 111 B6R0.4 NC(=O)CNCO d301de02518fc5358c97c5b15c4b68ec [1,0,0,0,0,0|3,0,0]=4 112 B6R0.4 NC(=O)COCF 5fb009cd2e813c9f1f9e35766b0ec8cb [1,0,0,0,0,0|3,0,0]=4 113 B6R0.4 O=C(O)CNCF d8e91f69db1ad3140a3502718cd0d10f [1,0,0,0,0,0|2,0,0]=3 114 B6R0.4 O=C(O)CNCO 03950869097643d435459ad5a0985e95 [1,0,0,0,0,0|2,0,0]=3 115 B6R0.4 O=C(O)COCF 7c32fa44d83e7ce6c73842137b12fe20 [1,0,0,0,0,0|2,0,0]=3 116 B6R0.4 O=S(O)COCF bc49b5a9355facf362625f551c5693d0 [1,0,0,0,0,0|3,0,0]=4 117 B8R0.2 CC(=O)N(C)C(C)CO 954909c32608c887b20279d0f2f3780c [0,1,0,0,0,0|3,0,0]=4 118 B8R0.2 CC(=O)N(C)[C@@H](C)CO 225dc8a4ffcea4cd61a90a38a4080118 [0,1,0,0,0,0|3,0,0]=4 119 B8R0.2 CC(=O)N(C)[C@H](C)CO de33b62e9836c68164793809e4e8e5b1 [0,1,0,0,0,0|3,0,0]=4 120 B8R0.2 CC(C(=O)N)N(C)CF 3c3f87bed206a80640b27644de62b85a [0,1,0,0,0,0|3,0,0]=4 121 B8R0.2 CC(C(=O)N)N(C)CO ae4ba5bba1f3ebfc5e18a030b582da9e [0,1,0,0,0,0|3,0,0]=4 122 B8R0.2 CC(C(=O)O)N(C)CF a3094bf427f297ebd8902941068ac9f2 [0,1,0,0,0,0|2,0,0]=3 123 B8R0.2 CC(C(=O)O)N(C)CO b0a7b81e88a446de30ff43a7aa3ff0e5 [0,1,0,0,0,0|2,0,0]=3 124 B8R0.2 CCC(C)N(C)C(=O)C 086f7eb815f719734067083abba6aada [0,1,0,0,0,0|2,0,0]=3 125 B8R0.2 CCN(C)C(=O)C(=O)C f60b3512bf731817ed8f594771284a74 [0,1,0,0,0,0|2,0,1]=4 126 B8R0.2 CCN(C)C(=O)C(=O)N 7875f40b4ff30daf1968926d7731bc9e [0,1,0,0,0,0|2,0,1]=4 127 B8R0.2 CCN(C)C(C)C(=O)C b0aebe8e13e2528b49b039e15b578c7c [0,1,0,0,0,0|2,0,0]=3 128 B8R0.2 CCN(C)C(C)C(=O)N c9d5fe87f550d78b666f9d69e7149698 [0,1,0,0,0,0|2,0,0]=3 129 B8R0.2 CCN(C)C(C)C(=O)O 6f2a7033474106426aec9bd9ed3b37aa [0,1,0,0,0,0|1,0,0]=2 130 B8R0.2 CCN(C)C(C)C(=S)N 8c98954ac4fb316d45fe3a223278fa1a [0,1,0,0,0,0|2,1,0]=4 131 B8R0.2 CCN(C)C(F)C(=O)N 38943317264fb5f4bb1b8ecb07aa912e [0,1,0,0,0,0|2,0,0]=3 132 B8R0.2 CCN(C)[C@@H](C)C(=O)N e92486f9a20f42ba27598bb897bbfb89 [0,1,0,0,0,0|2,0,0]=3 133 B8R0.2 CCN(C)[C@@H](C)C(=O)O ccda40b7947e3ec868172b2d11a39e32 [0,1,0,0,0,0|1,0,0]=2 134 B8R0.2 CCN(C)[C@H](C)C(=O)N 00061aa619b17a93e01c3e5051412b52 [0,1,0,0,0,0|2,0,0]=3 135 B8R0.2 CCN(C)[C@H](C)C(=O)O a423cd91a719c568f85e9128b6162ae1 [0,1,0,0,0,0|1,0,0]=2 136 B8R0.2 C[C@@H](C(=O)N)N(C)CF 2f40c584e866979365837219f15e6868 [0,1,0,0,0,0|3,0,0]=4 137 B8R0.2 C[C@@H](C(=O)N)N(C)CO 3a3fef6cb3764aa486ea0f1fb8393e88 [0,1,0,0,0,0|3,0,0]=4 138 B8R0.2 C[C@@H](C(=O)O)N(C)CF 0d6ed7ad4ea7484d5b39a392e405ff32 [0,1,0,0,0,0|2,0,0]=3 139 B8R0.2 C[C@@H](C(=O)O)N(C)CO c3f75a694235527c6388e6d7e2f17c01 [0,1,0,0,0,0|2,0,0]=3 140 B8R0.2 C[C@H](C(=O)O)N(C)CF 61c68bea78cdcd7c2b85cec5a91e35a8 [0,1,0,0,0,0|2,0,0]=3 141 B8R0.2 C[C@H](C(=O)O)N(C)CO 5d794c52438840dfb85878a5327b44ff [0,1,0,0,0,0|2,0,0]=3 142 B8R0.5 C#CCN(C)CC(=O)N 9ec6a92780f5226339adbf2368ca4af7 [0,1,0,0,0,0|2,0,1]=4 143 B8R0.5 C#CCN(C)CC(=O)O 9abb39fbf4cdcac02269d67e50e724b5 [0,1,0,0,0,0|1,0,1]=3 144 B8R0.5 C=C(Br)CN(C)CCC fb2b399db1881507b03f49296dad3a42 [0,1,0,0,0,0|3,0,0]=4 145 B8R0.5 C=C(Br)CN(C)CCF 8c286b53f0d9026a8df3ff47c9eb6c3a [0,1,0,0,0,0|3,0,0]=4 146 B8R0.5 C=C(Br)CN(C)CCO 04f2161f092181bead21494258a7eb25 [0,1,0,0,0,0|3,0,0]=4 147 B8R0.5 C=C(C)CN(C)CCC 67a547626d9fe48bc4d555dd9d8ee25d [0,1,0,0,0,0|3,0,0]=4 148 B8R0.5 C=C(C)CN(C)CCF a4346fde4025c5db2d5e6bbfb7c0c985 [0,1,0,0,0,0|3,0,0]=4 149 B8R0.5 C=C(C)CN(C)CCO 3d91c7b5e7811a5d832abe616ae4a280 [0,1,0,0,0,0|3,0,0]=4 150 B8R0.5 C=C(Cl)CN(C)CCC 40fce807c5ffbcb654536672bed9a3b8 [0,1,0,0,0,0|3,0,0]=4 151 B8R0.5 C=C(Cl)CN(C)CCF 3c3aa684bb42370ebdcb05de868f97d4 [0,1,0,0,0,0|3,0,0]=4 152 B8R0.5 C=C(Cl)CN(C)CCO f4f38b93cefea8a6e2262373359953c3 [0,1,0,0,0,0|3,0,0]=4 153 B8R0.5 C=C(F)CN(C)CCF 43dc4270a38fc198188d19fe92a34481 [0,1,0,0,0,0|3,0,0]=4 154 B8R0.5 C=CCN(C)CC(=O)N f61b92d5e26da491a049c9d34b9e2e8e [0,1,0,0,0,0|2,0,1]=4 155 B8R0.5 C=CCN(C)CC(=O)O 7ee8ca05079b6f72d0f00781a2b17cdf [0,1,0,0,0,0|1,0,1]=3 156 B8R0.5 CC(=O)NC(C)CC#N 4c1eec26fa88af811b86b8c3ab1a2be6 [0,1,0,0,0,0|2,0,1]=4 157 B8R0.5 CC(=O)NC(C)CCO 31015bb8805fb64762d130a6b4b7d734 [0,1,0,0,0,0|2,0,0]=3 158 B8R0.5 CC(=O)N[C@@H](C)CCO 4818866c214b230552dc5531d2d7dacb [0,1,0,0,0,0|2,0,0]=3 159 B8R0.5 CC(=O)N[C@H](C)CCO d4f1175f550aed36e673eb7917598f76 [0,1,0,0,0,0|2,0,0]=3 160 B8R0.5 CC(CC(=O)N)OCF 3e264f2c27636c1a0f540c1f468797f4 [0,1,0,0,0,0|2,0,0]=3 161 B8R0.5 CC(CC(=O)O)NC#N 2707038014831afc2ce40ae6d3c44c2b [0,1,0,0,0,0|1,0,1]=3 162 B8R0.5 CC(CC(=O)O)NCF 84d4be16e4ac304aaa68ed4d36823324 [0,1,0,0,0,0|1,0,0]=2 163 B8R0.5 CC(CC(=O)O)NCO 10996b09f91fab84edb45bd9880e2318 [0,1,0,0,0,0|1,0,0]=2 164 B8R0.5 CC(CC(=O)O)OCF 14e16352da0b978e8e37b50cbc803026 [0,1,0,0,0,0|1,0,0]=2 165 B8R0.5 CC(C[N+](=O)[O-])OCF ebebef16491bc728411436c052fc9756 [0,1,0,0,0,0|2,0,1]=4 166 B8R0.5 CC(O)CC(C)NCF 1a954ad92b2cd85f7c1e8eb7cc709982 [0,1,0,0,0,0|2,0,1]=4 167 B8R0.5 CC(O)CC(C)NCO a3e3cf347616fa2466ad965e211d77eb [0,1,0,0,0,0|2,0,1]=4 168 B8R0.5 CC(O)CN(C)CCF d208e2a32e1219be6f4dc40c04cbf782 [0,1,0,0,0,0|2,0,1]=4 169 B8R0.5 CC(O)CN(C)CCO b8c93809fd363b893059df214df9a71f [0,1,0,0,0,0|2,0,1]=4 170 B8R0.5 CC(O)CN(C)CCS e7d6706e63901057284fa2788897ed93 [0,1,0,0,0,0|2,0,1]=4 171 B8R0.5 CCCC(C)NC(=O)C 1ed0caa6bab6b1d79a8ed0b0c0e539ad [0,1,0,0,0,0|2,0,0]=3 172 B8R0.5 CCCN(C)CC(=O)N eac556bb053ce72a83d81df49c8f321b [0,1,0,0,0,0|2,0,0]=3 173 B8R0.5 CCCN(C)CC(=O)O afce971a9549e09777d29f9620e7b765 [0,1,0,0,0,0|1,0,0]=2 174 B8R0.5 CCCN(C)CC(C)O ba71d19aa94a205bc2a8e63dac164472 [0,1,0,0,0,0|2,0,1]=4 175 B8R0.5 CCCN(C)C[C@@H](C)O e21d8a4c9925e7ebdd999960638ddfd2 [0,1,0,0,0,0|2,0,1]=4 176 B8R0.5 CCCN(C)C[C@H](C)O 8866f4aefe80bbaf9ef0e79e608206ab [0,1,0,0,0,0|2,0,1]=4 177 B8R0.5 CCCN(C)C[N+](=O)[O-] 1da16b4d827595081bb5ff08735265aa [0,1,0,0,0,0|2,0,1]=4 178 B8R0.5 CCC[C@H](C)NC(=O)C 95c9eaebbb0a0de223f5b617f08585d8 [0,1,0,0,0,0|2,0,0]=3 179 B8R0.5 CCNC(C)CC(=O)O 29ac9bd89e468a34801bb550215ba942 [0,1,0,0,0,0|0,0,0]=1 180 B8R0.5 CCNC(C)CC(C)C 865caec34869d14200fe8a23ded15c61 [0,1,0,0,0,0|2,0,1]=4 181 B8R0.5 CCNC(C)CC(C)O 43b202ae8ff1647314607d5a8e6eab62 [0,1,0,0,0,0|1,0,1]=3 182 B8R0.5 CCNC(C)CN(C)C 3647b655ca2afa948df2daf8e7b3863a [0,1,0,0,0,0|3,0,0]=4 183 B8R0.5 CCN[C@@H](C)CC(=O)O 40a529d5929c8901c8f2b9599ed898cd [0,1,0,0,0,0|0,0,0]=1 184 B8R0.5 CCN[C@@H](C)CN(C)C 73dbe197bb194ada6ceef16a3da0165d [0,1,0,0,0,0|3,0,0]=4 185 B8R0.5 CCN[C@H](C)CC(=O)O 2f28d4f7bc57f1ad1bf5a4eebcdf11f3 [0,1,0,0,0,0|0,0,0]=1 186 B8R0.5 CCN[C@H](C)CN(C)C a51baa1074a724bab895601c4ea99cae [0,1,0,0,0,0|3,0,0]=4 187 B8R0.5 CCOC(C)CC(=O)N a247fc098cd9bc50b0c7b9371cf4fcb5 [0,1,0,0,0,0|1,0,0]=2 188 B8R0.5 CCOC(C)CC(=O)O 20f52735b4f115013d658aa30fd851a1 [0,1,0,0,0,0|0,0,0]=1 189 B8R0.5 CCOC(C)CC(C)C 30e2f8e558cfdda4b507d2297dd2dc70 [0,1,0,0,0,0|2,0,1]=4 190 B8R0.5 CCOC(C)CN(C)C 37b413e4bc800fbab3da37dd4e9fe161 [0,1,0,0,0,0|3,0,0]=4 191 B8R0.5 CCOC(C)C[N+](=O)[O-] b27ec23ecb023bda7a5b2b5d22939688 [0,1,0,0,0,0|1,0,1]=3 192 B8R0.5 CCO[C@@H](C)CC(=O)O 2297bbd28bfec2b7a3315f1a1eca242e [0,1,0,0,0,0|0,0,0]=1 193 B8R0.5 CCO[C@@H](C)CC(C)C 1e2bdc5c56411fd3cd17ac1c2858063c [0,1,0,0,0,0|2,0,1]=4 194 B8R0.5 CCO[C@@H](C)CN(C)C ae40d79a21e92f2f1cf9ae60d7945b2b [0,1,0,0,0,0|3,0,0]=4 195 B8R0.5 CCO[C@H](C)CC(=O)O ccc8e46cafa360247330bb81a3001d13 [0,1,0,0,0,0|0,0,0]=1 196 B8R0.5 CCO[C@H](C)CC(C)C 914881db7ee4a9dab17d292ad412afd8 [0,1,0,0,0,0|2,0,1]=4 197 B8R0.5 CCO[C@H](C)CN(C)C 28a6b24d1c425360d0b5ae251533cba1 [0,1,0,0,0,0|3,0,0]=4 198 B8R0.5 CN(CC#N)CC(=O)N ee0a3ed4ddf0c948d3e7483cfa3e23be [0,1,0,0,0,0|2,0,1]=4 199 B8R0.5 CN(CC#N)CC(=O)O bc896e10abdeff2aa8e14b2e3c6e86cb [0,1,0,0,0,0|1,0,1]=3 200 B8R0.5 CN(CC=O)CC(=O)N c5050afd22abe354d373b1a0ce703c9b [0,1,0,0,0,0|2,0,1]=4 201 B8R0.5 CN(CC=O)CC(=O)O 4f16c2423e66def517d0d42510089596 [0,1,0,0,0,0|1,0,1]=3 202 B8R0.5 CN(CCF)CC(=O)N d26c9ff0c6aeb9650633740b8e8fbdd2 [0,1,0,0,0,0|2,0,0]=3 203 B8R0.5 CN(CCF)CC(=O)O 378a586b4ce9b0291e7e9d64e15c1748 [0,1,0,0,0,0|1,0,0]=2 204 B8R0.5 CN(CCF)C[N+](=O)[O-] 0a648882ff2e3202963a570b9a23eec5 [0,1,0,0,0,0|2,0,1]=4 205 B8R0.5 CN(CCO)CC(=O)N 0888a0a37efb8cd042350a61e8c75fb4 [0,1,0,0,0,0|2,0,0]=3 206 B8R0.5 CN(CCO)CC(=O)O e22eedcab85615a7cb9a01481995f5a1 [0,1,0,0,0,0|1,0,0]=2 207 B8R0.5 CN(CCO)C[N+](=O)[O-] 744833b966e88885947b0234a2941619 [0,1,0,0,0,0|2,0,1]=4 208 B8R0.5 CN(CCS)CC(=O)N ac27f0a2a25a3457ae9c334515a984f5 [0,1,0,0,0,0|2,0,0]=3 209 B8R0.5 CN(CCS)CC(=O)O 20a126cdeaa5b2f572a540b4b00dcdb8 [0,1,0,0,0,0|1,0,0]=2 210 B8R0.5 COCC(C)NC(=O)C d3030be71efb57415a6640caba792cb5 [0,1,0,0,0,0|2,0,0]=3 211 B8R0.5 COCN(C)CC(=O)N 883b5fd21ac0fa4c080e391aedf41537 [0,1,0,0,0,0|2,0,0]=3 212 B8R0.5 COCN(C)CC(=O)O 38182438be3a4fb938d35352c6bcaa17 [0,1,0,0,0,0|1,0,0]=2 213 B8R0.5 COCN(C)CC(C)O 236ef8cf66ea95220e886cd11f898eee [0,1,0,0,0,0|2,0,1]=4 214 B8R0.5 COCN(C)C[C@H](C)O d0cec2a0e9e49d3fd200a1f1b3460073 [0,1,0,0,0,0|2,0,1]=4 215 B8R0.5 COC[C@@H](C)NC(=O)C e26de4ebd7327dac480ea010b3a6df2f [0,1,0,0,0,0|2,0,0]=3 216 B8R0.5 COC[C@H](C)NC(=O)C 4d6a771b34650f584286aeb4b67fe92b [0,1,0,0,0,0|2,0,0]=3 217 B8R0.5 CSCN(C)CC(=O)N 95b0cce82a1be92513ca60f76f2c4e94 [0,1,0,0,0,0|2,0,0]=3 218 B8R0.5 CSCN(C)CC(=O)O f4126c72edd8ab40e4f0e1149e0c0772 [0,1,0,0,0,0|1,0,0]=2 219 B8R0.5 CSCN(C)CC(C)O 19b09d20f60ba10a7233c42a0094d940 [0,1,0,0,0,0|2,0,1]=4 220 B8R0.5 CSCN(C)C[C@H](C)O a1cd0a54d282bd0dcdd24b2e9143dd2d [0,1,0,0,0,0|2,0,1]=4 221 B8R0.5 C[C@@H](CC(=O)O)NCF 7b4409b263377324cee992cead4d4496 [0,1,0,0,0,0|1,0,0]=2 222 B8R0.5 C[C@@H](CC(=O)O)NCO 6f9af837429cbf13d74a82abb33116db [0,1,0,0,0,0|1,0,0]=2 223 B8R0.5 C[C@@H](CC(=O)O)OCF 3a1dfbb8c5aec4e4079809a87b6b3981 [0,1,0,0,0,0|1,0,0]=2 224 B8R0.5 C[C@@H](O)CN(C)CCF 126ff326a556bc086395534b8f58a986 [0,1,0,0,0,0|2,0,1]=4 225 B8R0.5 C[C@@H](O)CN(C)CCO b2075f300e9096bf9f56060a06fe5fff [0,1,0,0,0,0|2,0,1]=4 226 B8R0.5 C[C@H](CC(=O)O)NCF 6a82f1327e74ba81c2a6e57eb4cb9aac [0,1,0,0,0,0|1,0,0]=2 227 B8R0.5 C[C@H](CC(=O)O)NCO 3ee6882c6b18b0aec7272fad595282f5 [0,1,0,0,0,0|1,0,0]=2 228 B8R0.5 C[C@H](CC(=O)O)OCF 913e08b306bc95c6771408b42aad5ed2 [0,1,0,0,0,0|1,0,0]=2 229 B8R0.5 C[C@H](O)CN(C)CCF 0035923f0b284ef55440b2a2ec1d53f8 [0,1,0,0,0,0|2,0,1]=4 230 B8R0.5 C[C@H](O)CN(C)CCO 3ac89c90dc792061538bdb13c697b5b7 [0,1,0,0,0,0|2,0,1]=4 231 B8R0.5 C[C@H](O)CN(C)CCS 4eb7ed53de9d466688e0eafcb5798f80 [0,1,0,0,0,0|2,0,1]=4 232 B8R0.16 C=C(C)CN(CC)CC 5e7edabf5a8714e74a2bb1ad7dd94499 [0,1,0,0,0,0|3,0,0]=4 233 B8R0.16 C=C(C)CN(CC)CF fb462ba98ce1838dd4d16ae3abcf2592 [0,1,0,0,0,0|3,0,0]=4 234 B8R0.16 C=C(C)CN(CC)CO d3e5e60a1b260bb44f4da36f7d5b093a [0,1,0,0,0,0|3,0,0]=4 235 B8R0.16 CC(=O)NC(CO)CO b933289767d5f896480a48145d3e5dd9 [0,1,0,0,0,0|3,0,0]=4 236 B8R0.16 CCC(CC)NC(=O)C 4ed89f720f0f05324cf79f8a98baf869 [0,1,0,0,0,0|2,0,0]=3 237 B8R0.16 CCC(CO)NC(=O)C 0fc969f502a685ac3a30dff22859fa62 [0,1,0,0,0,0|2,0,0]=3 238 B8R0.16 CCN(CC)CC(=O)O 6fed7892c18c8ce9f89dfe191b146fca [0,1,0,0,0,0|1,0,0]=2 239 B8R0.16 CCN(CC)CC(C)O d8bc58b8f382f5371f0e94bb242901d6 [0,1,0,0,0,0|2,0,1]=4 240 B8R0.16 CCN(CC)C[C@H](C)O e8ae75fa00192b49e2affddcedaf538e [0,1,0,0,0,0|2,0,1]=4 241 B8R0.16 CCN(CF)CC(=O)O 1572f10e4b030a4a402c19f513bf28bb [0,1,0,0,0,0|1,0,0]=2 242 B8R0.16 CCN(CF)CC(C)O b42e3cb8d43d72a360d85cc8de4205f1 [0,1,0,0,0,0|2,0,1]=4 243 B8R0.16 CCN(CF)C[C@H](C)O c4e347000f8a76e4029d2cbec68d72c2 [0,1,0,0,0,0|2,0,1]=4 244 B8R0.16 CCN(CO)CC(=O)O af04d4435f9e87502f4960e4fa163dc7 [0,1,0,0,0,0|1,0,0]=2 245 B8R0.16 CCN(CO)CC(C)O 0648cddbdd177d68fe137b4e015914f3 [0,1,0,0,0,0|2,0,1]=4 246 B8R0.16 CCN(CO)C[C@H](C)O e524c4415f69604a18e716f7cb9197fa [0,1,0,0,0,0|2,0,1]=4 247 B8R0.16 CC[C@@H](CO)NC(=O)C ec21a63ea250126e0e8e11da71f403ff [0,1,0,0,0,0|2,0,0]=3 248 B8R0.16 CC[C@H](CO)NC(=O)C 6d8228e87e113704ba8a910f796088e1 [0,1,0,0,0,0|2,0,0]=3 249 B8R0.19 C#CC(=O)NC(C)CC 61d9b7eb83f4ff7eb7086f9d7e1ae285 [0,1,0,0,0,0|2,0,0]=3 250 B8R0.19 C#CC(=O)NC(C)CO ef2349063c35b76cf4d00bd3f49935ef [0,1,0,0,0,0|3,0,0]=4 251 B8R0.19 C#CC(=O)N[C@@H](C)CC e4430e1df3d27e1f60bfd6ac8cb2107b [0,1,0,0,0,0|2,0,0]=3 252 B8R0.19 C#CC(=O)N[C@@H](C)CO 53eee74018b9e276710cf6173744a777 [0,1,0,0,0,0|3,0,0]=4 253 B8R0.19 C#CC(=O)N[C@H](C)CC 4b809239b5091186dfbcfe36ab818a64 [0,1,0,0,0,0|2,0,0]=3 254 B8R0.19 C#CC(=O)N[C@H](C)CO 825248ab113484f971eda1437fa878f2 [0,1,0,0,0,0|3,0,0]=4 255 B8R0.19 C#CC(C)NC(=O)CO 702ffb71c324a35e34d91444846fafe2 [0,1,0,0,0,0|1,0,2]=4 256 B8R0.19 C#C[C@@H](C)NC(=O)CO 78f287368a403bf2071949db9cf15f95 [0,1,0,0,0,0|1,0,2]=4 257 B8R0.19 C#C[C@H](C)NC(=O)CO 2415c234d694c139fd6864b147fc33dd [0,1,0,0,0,0|1,0,2]=4 258 B8R0.19 C=C(C#N)CN(C)CC a4fc91dae1b5b1129e212edf18ed0f3b [0,1,0,0,0,0|3,0,0]=4 259 B8R0.19 C=C(C=O)OC(C)CC c5f7d9036a8fdea0d25979e46bb39add [0,1,0,0,0,0|2,0,0]=3 260 B8R0.19 C=C(CC)CN(C)CC a5edac56bd516c3e08abe80274b2ef4e [0,1,0,0,0,0|3,0,0]=4 261 B8R0.19 C=C(CN(C)CC)OC ae7aed41eaced6b8d6d4f4656a97dade [0,1,0,0,0,0|2,0,0]=3 262 B8R0.19 C=C(CO)CN(C)CC 9c16b8a0e80d8cd55610766797cfa55c [0,1,0,0,0,0|2,0,0]=3 263 B8R0.19 C=CC(=O)NC(C)CC 618b63daf38e12edf0af1cf418a0bd56 [0,1,0,0,0,0|2,0,0]=3 264 B8R0.19 C=CC(=O)NC(C)CO 7d704e5b0d02912153bbac9ab1524b4a [0,1,0,0,0,0|3,0,0]=4 265 B8R0.19 C=CC(=O)N[C@@H](C)CC a3ffc6e9f98d3fec0068c30de1c1aa9d [0,1,0,0,0,0|2,0,0]=3 266 B8R0.19 C=CC(=O)N[C@@H](C)CO d3eebdfcf0b68fe67805ed6261019c02 [0,1,0,0,0,0|3,0,0]=4 267 B8R0.19 C=CC(=O)N[C@H](C)CC 7381476a5c4cd38996f0fa157a298c50 [0,1,0,0,0,0|2,0,0]=3 268 B8R0.19 C=CC(=O)N[C@H](C)CO b32e46cc4855adf1cdc7b98fc72ab8f3 [0,1,0,0,0,0|3,0,0]=4 269 B8R0.19 C=CC(C)NC(=O)CO bfff0c86eaaef97d8840737c1dae3696 [0,1,0,0,0,0|1,0,2]=4 270 B8R0.19 CC(C#N)NC(=O)CO 1966565fed6c98aafc0894510067c50f [0,1,0,0,0,0|2,0,1]=4 271 B8R0.19 CC(CO)CN(C)C=O 1651f97b326ac36e19f9ffe26a720260 [0,1,0,0,0,0|3,0,0]=4 272 B8R0.19 CC(CO)CN(C)CO 88f6462de4aacc7ccc10f96b517f63b5 [0,1,0,0,0,0|3,0,0]=4 273 B8R0.19 CC(CO)NC(=O)C=O 1c60e6f2c21701253617f70f64f6f106 [0,1,0,0,0,0|2,0,1]=4 274 B8R0.19 CC(CO)NC(=O)CF ef2266eb5061b2bffbd30285b120264a [0,1,0,0,0,0|3,0,0]=4 275 B8R0.19 CC(CO)NC(=O)CO 36e7f0a9d41f765505ec00dee787948b [0,1,0,0,0,0|2,0,0]=3 276 B8R0.19 CC(CO)NC(=O)CS 4ca68b24b40823bba6f492cc34b6d41b [0,1,0,0,0,0|2,1,0]=4 277 B8R0.19 CCC(=O)CN(C)CC 5ff470863ab78226aff558b26acaa6bb [0,1,0,0,0,0|2,0,0]=3 278 B8R0.19 CCC(=O)NC(C)CC 276f63d9911911bef583b63399d6babf [0,1,0,0,0,0|2,0,0]=3 279 B8R0.19 CCC(=O)NC(C)CO 31f73ee0dabaaa5a17015c929f45f2fd [0,1,0,0,0,0|3,0,0]=4 280 B8R0.19 CCC(=O)N[C@@H](C)CC 5015556f6119dada9330f459ef8b4a95 [0,1,0,0,0,0|2,0,0]=3 281 B8R0.19 CCC(=O)N[C@@H](C)CO a3bcc6db0615cc40ae6703cd20d3dc45 [0,1,0,0,0,0|3,0,0]=4 282 B8R0.19 CCC(=O)N[C@H](C)CC 0aeecce7ca86d9a6cf7c4003d6b8deb5 [0,1,0,0,0,0|2,0,0]=3 283 B8R0.19 CCC(=O)N[C@H](C)CO 3449d5b097ace6785d86df28155e11e4 [0,1,0,0,0,0|3,0,0]=4 284 B8R0.19 CCC(C)CN(C)CC c97a2f07dd5fecc0e91af558e8842f65 [0,1,0,0,0,0|3,0,0]=4 285 B8R0.19 CCC(C)NC(=O)C=O d87e951102d767f8f5aa3b902ef92349 [0,1,0,0,0,0|1,0,1]=3 286 B8R0.19 CCC(C)NC(=O)CF be99e999222b335d1cb75f36b6d9cd45 [0,1,0,0,0,0|2,0,0]=3 287 B8R0.19 CCC(C)NC(=O)CO 33a44afa4449469b04b268f3719a3e59 [0,1,0,0,0,0|1,0,0]=2 288 B8R0.19 CCC(C)NC(=O)CS 2bbecd1472ce4a0c07af9c3693119c31 [0,1,0,0,0,0|1,1,0]=3 289 B8R0.19 CCC(C)NC(C)C=O 610b4a8ffb3807f31c76d2eb3d0b9780 [0,1,0,0,0,0|2,0,1]=4 290 B8R0.19 CCC(C)NC(C)CO 39c372ea4cef1456332b0e4a891f2be4 [0,1,0,0,0,0|2,0,1]=4 291 B8R0.19 CCC(C)N[C@@H](C)CO 03a0460ae5de8db8276fc6c4f3d9cea4 [0,1,0,0,0,0|2,0,1]=4 292 B8R0.19 CCC(C)N[C@H](C)C=O bcb94071dd29361c15a01b7c88596d57 [0,1,0,0,0,0|2,0,1]=4 293 B8R0.19 CCC(C)N[C@H](C)CO 9839a5c86ff60244cdc275d1b4d9331f [0,1,0,0,0,0|2,0,1]=4 294 B8R0.19 CCC(C)OC(C)C=O eff298f26322e5014e51cb58e37ec95a [0,1,0,0,0,0|2,0,1]=4 295 B8R0.19 CCC(C)O[C@H](C)C=O 8b0db61f6f95e4e0ee500a8429036305 [0,1,0,0,0,0|2,0,1]=4 296 B8R0.19 CCC(O)CN(C)C=O a5ca11d122e7bb722666ea345a9e6e66 [0,1,0,0,0,0|3,0,0]=4 297 B8R0.19 CCC(O)CN(C)CC 05ba2ce1cbf52722b11091eb58aa8124 [0,1,0,0,0,0|2,0,1]=4 298 B8R0.19 CCC(O)CN(C)CO 54fe76ed8fcd6451ff39e55c2b1e0de7 [0,1,0,0,0,0|3,0,0]=4 299 B8R0.19 CCN(C)C/C(=C/Cl)/Cl 35026ec2ef88364e5f2edb0f392ee1ff [0,1,0,0,0,0|3,0,0]=4 300 B8R0.19 CCN(C)CC(=O)CO cfedb43af4bce24aac2f06a8534d30e0 [0,1,0,0,0,0|1,0,0]=2 301 B8R0.19 CCN(C)CC(=O)NC 8baa1dde5886fc0147e3d3c2a9f34306 [0,1,0,0,0,0|2,0,0]=3 302 B8R0.19 CCN(C)CC(=O)OC dc6eaad4d2fa330c4e11c97ae3abe5a3 [0,1,0,0,0,0|1,0,0]=2 303 B8R0.19 CCN(C)CC(C)CO 57aed0ddb41a49ac36f9f8539801655e [0,1,0,0,0,0|2,0,1]=4 304 B8R0.19 CCN(C)CC(C)OC 377b6e41a65d04757b988ceba2b54f82 [0,1,0,0,0,0|2,0,1]=4 305 B8R0.19 CCN(C)CC(O)CF 9b5f95856fc2428b6d2e975cfa34b30b [0,1,0,0,0,0|2,0,1]=4 306 B8R0.19 CCN(C)CC(O)CO 1d1312ada3c341da8de27cc3789abca2 [0,1,0,0,0,0|1,0,2]=4 307 B8R0.19 CCN(C)C[C@@H](C)CO ddade9d6e3ba337d6b393a00c773647d [0,1,0,0,0,0|2,0,1]=4 308 B8R0.19 CCN(C)C[C@@H](C)OC 423ec57342e946c8b4839b0ec5409baa [0,1,0,0,0,0|2,0,1]=4 309 B8R0.19 CCN(C)C[C@@H](O)CO e64e4131d671816539b2429b245cd316 [0,1,0,0,0,0|1,0,2]=4 310 B8R0.19 CCN(C)C[C@H](C)CO 0a9476f9cc602f73744eac4366c36b7c [0,1,0,0,0,0|2,0,1]=4 311 B8R0.19 CCN(C)C[C@H](C)OC fbb444e22eeeab9bc96df09d063788d3 [0,1,0,0,0,0|2,0,1]=4 312 B8R0.19 CCN(C)C[C@H](O)CO f45fa40fd7de9da18f9df806f59986f2 [0,1,0,0,0,0|1,0,2]=4 313 B8R0.19 CC[C@@H](C)CN(C)CC c7c9b5c0068d5d12f050f43bd2f96d97 [0,1,0,0,0,0|3,0,0]=4 314 B8R0.19 CC[C@@H](C)NC(=O)C=O 21ac8ac32e78a362dc133e8e3bbda567 [0,1,0,0,0,0|1,0,1]=3 315 B8R0.19 CC[C@@H](C)NC(=O)CF 972ccf96eab46daa18ae78e952074e33 [0,1,0,0,0,0|2,0,0]=3 316 B8R0.19 CC[C@@H](C)NC(=O)CO 102bc53795a33daa61b0e6c2cdbc40e6 [0,1,0,0,0,0|1,0,0]=2 317 B8R0.19 CC[C@@H](C)NC(=O)CS 6576ffdd87c3ad0b66c846698b8c9218 [0,1,0,0,0,0|1,1,0]=3 318 B8R0.19 CC[C@@H](C)NC(C)C=O abf2de4d64d8367bf152827fa19c8747 [0,1,0,0,0,0|2,0,1]=4 319 B8R0.19 CC[C@@H](C)NC(C)CO 18ed6fc25b8c14c4191fbfb8a29f3353 [0,1,0,0,0,0|2,0,1]=4 320 B8R0.19 CC[C@@H](C)N[C@@H](C)CO 007782dc3ac7f491d3f6b8d8f3339b58 [0,1,0,0,0,0|2,0,1]=4 321 B8R0.19 CC[C@@H](C)N[C@H](C)C=O 3342a1648b9263897ca0c454c43aa5e6 [0,1,0,0,0,0|2,0,1]=4 322 B8R0.19 CC[C@@H](C)N[C@H](C)CO b5aae793b89cbba911f055e04d55acb2 [0,1,0,0,0,0|2,0,1]=4 323 B8R0.19 CC[C@@H](C)OC(C)C=O 665da496f78ef9cbb93bd2fbabb6c4bb [0,1,0,0,0,0|2,0,1]=4 324 B8R0.19 CC[C@@H](C)O[C@H](C)C=O 89b33ea7698450df463669e4946abea4 [0,1,0,0,0,0|2,0,1]=4 325 B8R0.19 CC[C@H](C)CN(C)CC a2f007d5d2fc9c89853c614ebf5a2522 [0,1,0,0,0,0|3,0,0]=4 326 B8R0.19 CC[C@H](C)NC(=O)C=O e638670223a406eb6167bccd4c1dfde1 [0,1,0,0,0,0|1,0,1]=3 327 B8R0.19 CC[C@H](C)NC(=O)CF 4effc7db6392db0aa027693c9704097d [0,1,0,0,0,0|2,0,0]=3 328 B8R0.19 CC[C@H](C)NC(=O)CO 7070ce3ef500a05442ee4538ea055e46 [0,1,0,0,0,0|1,0,0]=2 329 B8R0.19 CC[C@H](C)NC(=O)CS 035bd81fae7cc99474ceaac0a841b71d [0,1,0,0,0,0|1,1,0]=3 330 B8R0.19 CC[C@H](C)NC(C)C=O 018c527e97f5ffc308f69037c7d3a009 [0,1,0,0,0,0|2,0,1]=4 331 B8R0.19 CC[C@H](C)NC(C)CO 3726c8f35150bd5080044acffa8a570c [0,1,0,0,0,0|2,0,1]=4 332 B8R0.19 CC[C@H](C)N[C@@H](C)CO 762e9a16ea4b3bc73b0f3048e55d1b5d [0,1,0,0,0,0|2,0,1]=4 333 B8R0.19 CC[C@H](C)N[C@H](C)C=O d64bf9f3a5fe53c581afe2fb82ccfd54 [0,1,0,0,0,0|2,0,1]=4 334 B8R0.19 CC[C@H](C)N[C@H](C)CO 3fb6e84edfa80d94f40bae64bba9a957 [0,1,0,0,0,0|2,0,1]=4 335 B8R0.19 CC[C@H](C)OC(C)C=O 0ca2a7fbf13c00f26ded9cafaaef3a1d [0,1,0,0,0,0|2,0,1]=4 336 B8R0.19 CC[C@H](C)O[C@H](C)C=O 65f006b95602312ad77964961ea5b1e5 [0,1,0,0,0,0|2,0,1]=4 337 B8R0.19 CNC(=O)CN(C)CF c4335c7de1ec7a5bdf4619e54da80079 [0,1,0,0,0,0|3,0,0]=4 338 B8R0.19 CNC(=O)CN(C)CO 5e5aacc592b2dd5b7a781dd38b53445b [0,1,0,0,0,0|3,0,0]=4 339 B8R0.19 COC(=O)CN(C)C=O 943cc5729a7d321dfa7dcb2f4fa86c17 [0,1,0,0,0,0|2,0,1]=4 340 B8R0.19 COC(=O)CN(C)CF 315bad3552c61e9bc012d524d408a643 [0,1,0,0,0,0|2,0,0]=3 341 B8R0.19 COC(=O)CN(C)CO ead5047548ab9512878dca6e9fed3e38 [0,1,0,0,0,0|2,0,0]=3 342 B8R0.19 C[C@@H](CO)NC(=O)C=O 7fc1349ef4b9354cd9836d7dba2b3f46 [0,1,0,0,0,0|2,0,1]=4 343 B8R0.19 C[C@@H](CO)NC(=O)CF 2c1d0a1ab5fcd3bc348406e1eae8d857 [0,1,0,0,0,0|3,0,0]=4 344 B8R0.19 C[C@@H](CO)NC(=O)CO 4ef5922646eca2409cc0528bbe495536 [0,1,0,0,0,0|2,0,0]=3 345 B8R0.19 C[C@@H](CO)NC(=O)CS ecb25931c5ecf30a1072b0ef0c850951 [0,1,0,0,0,0|2,1,0]=4 346 B8R0.19 C[C@H](CO)NC(=O)C=O b148bc237154c303bdab4997b908c1ee [0,1,0,0,0,0|2,0,1]=4 347 B8R0.19 C[C@H](CO)NC(=O)CF 47adba76c977441bf582f65bebd39947 [0,1,0,0,0,0|3,0,0]=4 348 B8R0.19 C[C@H](CO)NC(=O)CO 02a86c975d92184b3a8afd5bdd788d80 [0,1,0,0,0,0|2,0,0]=3 349 B8R0.19 C[C@H](CO)NC(=O)CS ecf3d50d57e6bb41773d96b1c96ed61c [0,1,0,0,0,0|2,1,0]=4 350 B8R0.23 C=C(Br)CN(C)C(C)C 3f7e31a92c12d20ec7a273e7b73ed655 [0,1,0,0,0,0|3,0,0]=4 351 B8R0.23 C=C(C)CN(C)C(C)C 5ce3bf8335906065652aa3e2b299f4f5 [0,1,0,0,0,0|3,0,0]=4 352 B8R0.23 C=C(Cl)CN(C)C(C)C 500d730e6e828a70fc3011a810f7905a [0,1,0,0,0,0|3,0,0]=4 353 B8R0.23 CC(=O)N(C)CC(=O)N 6f58f2f5ad7b07ef07711fc466f59108 [0,1,0,0,0,0|2,0,1]=4 354 B8R0.23 CC(=O)NC(C)C(C)C 44e61c71c404e93b61e4ebb2d17acd25 [0,1,0,0,0,0|2,0,0]=3 355 B8R0.23 CC(=O)NC(C)C(C)O 82d78b22fd9c1b1cb9a6f73c5b23c29f [0,1,0,0,0,0|2,0,0]=3 356 B8R0.23 CC(=O)N[C@@H](C)C(C)C 020b2d58d09d222117d5a013059e1c42 [0,1,0,0,0,0|2,0,0]=3 357 B8R0.23 CC(=O)N[C@@H](C)C(F)F 22488b68f94b27687795c9433c1222cc [0,1,0,0,0,0|3,0,0]=4 358 B8R0.23 CC(=O)N[C@H](C)C(C)C 1a8a59449f9523fa08b3f0d029907e07 [0,1,0,0,0,0|2,0,0]=3 359 B8R0.23 CC(=O)N[C@H](C)C(F)F 39323a7f6823bde98b326479b7aa9573 [0,1,0,0,0,0|3,0,0]=4 360 B8R0.23 CC(C)N(C)CC(=O)N 40fedc251db3e73f4c6c403ff754fd20 [0,1,0,0,0,0|2,0,0]=3 361 B8R0.23 CC(C)N(C)CC(=O)O 402f1d7c3b958af1fceb64bdcde4405c [0,1,0,0,0,0|1,0,0]=2 362 B8R0.23 CC(C)N(C)C[C@@H](C)O edda2e38f0c2b068751a472716b6316d [0,1,0,0,0,0|2,0,1]=4 363 B8R0.23 CC(C)N(C)C[C@H](C)O 6c78ca3105da9d74005d52bf31383b62 [0,1,0,0,0,0|2,0,1]=4 364 B8R0.23 CC(C)N(C)C[N+](=O)[O-] ab389b01c728eaf6b35cdad1e0c3f6cf [0,1,0,0,0,0|2,0,1]=4 365 B8R0.23 CC(O)CN(C)C(C)C 95a92a6cab6529312851036d37141b0c [0,1,0,0,0,0|2,0,1]=4 366 B8R0.24 CCN(C)CC(C)(C)O 3a82767057043d9df3fecda73f227fdf [0,1,0,0,0,0|2,0,1]=4 367 B8R0.24 CCN(C)CS(=O)(=O)C 8b03fecdc46398064987fc89f87828a9 [0,1,0,0,0,0|2,0,1]=4 368 B8R0.24 CCN(C)CS(=O)(=O)S 22230c07353683a467b7d971abcaf63b [0,1,0,0,0,0|2,0,1]=4 369 B8R0.34 CC(=O)NC(C)(C)CF a18ff32a5fc0bc819ab72e44d96d3946 [0,1,0,0,0,0|3,0,0]=4 370 B8R0.34 CC(=O)NC(C)(C)CO 79003794ec6500404906022922bddeef [0,1,0,0,0,0|3,0,0]=4 371 B8R0.34 CCC(C)(C)NC(=O)C 840c3fecba24f983e5795d9efa511b8c [0,1,0,0,0,0|2,0,0]=3 372 B8R1.1 CCN1CCC(C1)O 1fbe07547593a6faa177084d503fc6f1 [0,0,0,1,0,0|2,0,1]=4 373 B8R1.1 CCN1CC[C@@H](C1)O 70cbbe96f459a233588b5761b6688faa [0,0,0,1,0,0|2,0,1]=4 374 B8R1.1 CCN1CC[C@H](C1)O 8caeefff584b981372b55b1e6e9f82dc [0,0,0,1,0,0|2,0,1]=4 375 B8R1.1 CCN1CNC(=O)C1 58009d6dfded7497e427ac45a5ff5413 [0,0,0,1,0,0|2,0,0]=3 376 B8R1.1 O=C1CN(CN1)CF f13f56dc757cd85272f424d9ac53fbce [0,0,0,1,0,0|3,0,0]=4 377 B8R1.1 O=C1CN(CN1)CO e561a9f6a1ffe109b2b8eed70763223f [0,0,0,1,0,0|3,0,0]=4 378 B8R1.20 CC(=O)NC1CC1C 1768a28e3842ccc949f84e026e8d58f3 [0,0,0,1,0,0|2,0,0]=3 379 B8R1.20 CC(=O)N[C@@H]1C[C@H]1F bc7a6eb1a99ce556c18fcaf7f0c75c37 [0,0,0,1,0,0|3,0,0]=4 380 B8R1.20 CC(=O)N[C@H]1C[C@@H]1F 576115c90eccc628d4e941f7a7852f6c [0,0,0,1,0,0|3,0,0]=4 381 B8R1.20 CC(=O)N[C@H]1C[C@H]1F 8cb83b6d110bbd78098fefdd41f3f45a [0,0,0,1,0,0|3,0,0]=4 382 B8R1.34 C=C(Br)CN1CCC1 7d3a102b87bb1acf8da9022a99ebcbd5 [0,0,0,1,0,0|3,0,0]=4 383 B8R1.34 C=C(C)CN1CCC1 19d6aea172318893485802428f6f2b52 [0,0,0,1,0,0|3,0,0]=4 384 B8R1.34 C=C(Cl)CN1CCC1 6c2deac25cc4e1ee5b95bcb9cd622604 [0,0,0,1,0,0|3,0,0]=4 385 B8R1.34 C=C(F)CN1CCC1 fe164e55c21cafabdc640e829c7e1a4f [0,0,0,1,0,0|3,0,0]=4 386 B8R1.34 CC(=O)NC1CCC1 46894fd3aa8761205eba8795d61a04cf [0,0,0,1,0,0|2,0,0]=3 387 B8R1.34 CC(=O)NC1COC1 434b9f924b049f8d9fb83819938927c2 [0,0,0,1,0,0|3,0,0]=4 388 B8R1.34 CC(O)CN1CCC1 c968b76b6db8bde6dbcca9aa6b0299d6 [0,0,0,1,0,0|2,0,1]=4 389 B8R1.34 C[C@@H](O)CN1CCC1 b5f2cf9878abeb4a8a834874c79174e7 [0,0,0,1,0,0|2,0,1]=4 390 B8R1.34 C[C@H](O)CN1CCC1 199f11a3ece69c3aaaa8b0f1f376d79b [0,0,0,1,0,0|2,0,1]=4 391 B8R1.34 NC(=O)CN1CCC1 6c3508be38699fc0f43e1dd694ce2a15 [0,0,0,1,0,0|2,0,0]=3 392 B8R1.34 O=C(O)CN1CCC1 ae8e836e7c2a4bf3a61b53e9068f6f2f [0,0,0,1,0,0|1,0,0]=2 393 B8R1.34 O=[N+]([O-])CN1CCC1 18e2c74ccfcdc6627c3c54edac6e5c7b [0,0,0,1,0,0|2,0,1]=4 394 B8R1.53 CCN1CC(C1)(C)O 61cbf2748eb0f902c8f332d7ca75d4ca [0,0,0,1,0,0|2,0,1]=4 395 B6R0.3 CCN(C)C(=O)C ad9227383f4996d412a5ced11e9c5417 [0,0,0,0,1,0|2,0,0]=3 396 B8R0.9 C#CC(C)NCC(=O)C 2ad4abc709ed22d0c1fc1e2c701880d0 [0,0,0,0,0,1|1,0,2]=4 397 B8R0.9 C#CC(C)NCC(=O)N 32d3ca8a304fcc6b77ac118eb613c4d0 [0,0,0,0,0,1|1,0,2]=4 398 B8R0.9 C#CC(C)NCC(=O)O 6d3e097d7e417cba1ca3cc5354bf3682 [0,0,0,0,0,1|0,0,2]=3 399 B8R0.9 C#CC(C)OCC(=O)C 882d251e5156962e635e367fb9e2389a [0,0,0,0,0,1|1,0,2]=4 400 B8R0.9 C#CC(C)OCC(=O)N 6651eb1a1e92c823417176ec5e477313 [0,0,0,0,0,1|1,0,2]=4 401 B8R0.9 C#CC(C)OCC(=O)O 86945981ae8eaaa778f83ec3ae4ff391 [0,0,0,0,0,1|0,0,2]=3 402 B8R0.9 C#CC(C)OCS(=O)O d1e6a1bc456adb5be98946540c51cc60 [0,0,0,0,0,1|1,0,2]=4 403 B8R0.9 C#C[C@@H](C)NCC(=O)N ae23c8b7683fb792d58192169f61f02d [0,0,0,0,0,1|1,0,2]=4 404 B8R0.9 C#C[C@@H](C)NCC(=O)O 870b1440fbecf6ad620d6ff4e4eac50b [0,0,0,0,0,1|0,0,2]=3 405 B8R0.9 C#C[C@@H](C)OCC(=O)N c25236b627e20c497b67314d1c7aadee [0,0,0,0,0,1|1,0,2]=4 406 B8R0.9 C#C[C@@H](C)OCC(=O)O 9bbfddfb8eea4f6aea8d08313b189ed8 [0,0,0,0,0,1|0,0,2]=3 407 B8R0.9 C#C[C@H](C)NCC(=O)N 79963d7d1eb88702311e6f8108ddfc3d [0,0,0,0,0,1|1,0,2]=4 408 B8R0.9 C#C[C@H](C)NCC(=O)O 3c98bce4a0db3f45a27121a2c37598a6 [0,0,0,0,0,1|0,0,2]=3 409 B8R0.9 C#C[C@H](C)OCC(=O)N d36d678d56ba5311696ce65072d8c107 [0,0,0,0,0,1|1,0,2]=4 410 B8R0.9 C#C[C@H](C)OCC(=O)O 33b89dc76124892fb33f6382d6c567d7 [0,0,0,0,0,1|0,0,2]=3 411 B8R0.9 C=C(Br)CNC(C)CC e82847dcad9ed2bd533fd2563c3b519d [0,0,0,0,0,1|2,0,0]=3 412 B8R0.9 C=C(Br)CNC(C)CO a9395843621306550785050d7c834975 [0,0,0,0,0,1|3,0,0]=4 413 B8R0.9 C=C(Br)CN[C@@H](C)CC 37f7a7e42f3e467987064f3f419e144d [0,0,0,0,0,1|2,0,0]=3 414 B8R0.9 C=C(Br)CN[C@@H](C)CO a9a538986d98a9e55f3f998c54cc247b [0,0,0,0,0,1|3,0,0]=4 415 B8R0.9 C=C(Br)CN[C@H](C)CC 1b5c6508d8f52572aaaac189914383ff [0,0,0,0,0,1|2,0,0]=3 416 B8R0.9 C=C(Br)CN[C@H](C)CO 7d1e722c71de1993138febf0f8977869 [0,0,0,0,0,1|3,0,0]=4 417 B8R0.9 C=C(Br)COC(C)CC 49feeff7986d6ae4fb296a8afe6d8ffc [0,0,0,0,0,1|2,0,0]=3 418 B8R0.9 C=C(Br)COC(C)CF 76719ac36e465c1f9f038a14b92bba73 [0,0,0,0,0,1|3,0,0]=4 419 B8R0.9 C=C(Br)COC(C)CS c64954e10279732b62f99e9cef7fc533 [0,0,0,0,0,1|3,0,0]=4 420 B8R0.9 C=C(Br)CO[C@@H](C)CC 868ef2581d68bb1b094a2fa1f8b58132 [0,0,0,0,0,1|2,0,0]=3 421 B8R0.9 C=C(Br)CO[C@H](C)CC 896e023f3f172d1a0521ca41c722cbcb [0,0,0,0,0,1|2,0,0]=3 422 B8R0.9 C=C(Br)CO[C@H](C)CS aa3dd9d11093d11d56d549f38593c281 [0,0,0,0,0,1|3,0,0]=4 423 B8R0.9 C=C(C)CCN(C)CC 975bc598c990d4455049b666e0eec143 [0,0,0,0,0,1|3,0,0]=4 424 B8R0.9 C=C(C)CNC(C)CC 256f62cec490bafed043741999c25df4 [0,0,0,0,0,1|2,0,0]=3 425 B8R0.9 C=C(C)CNC(C)CO 5159a8bb82cabf2648e9cdde51d9f87d [0,0,0,0,0,1|3,0,0]=4 426 B8R0.9 C=C(C)CN[C@@H](C)CC d26c3d64a9f189169a5866d4e2b497b9 [0,0,0,0,0,1|2,0,0]=3 427 B8R0.9 C=C(C)CN[C@@H](C)CO f4d1778cd45c27cf148f0822304507c8 [0,0,0,0,0,1|3,0,0]=4 428 B8R0.9 C=C(C)CN[C@H](C)CC 63a0b508416fa3ab231e5f743622aa6e [0,0,0,0,0,1|2,0,0]=3 429 B8R0.9 C=C(C)CN[C@H](C)CO f1c10bccf9821522bb3892f2794d0864 [0,0,0,0,0,1|3,0,0]=4 430 B8R0.9 C=C(C)COC(C)CC 4482bd721211f848f89897698cdef93d [0,0,0,0,0,1|2,0,0]=3 431 B8R0.9 C=C(C)COC(C)CF ba015a797381b5c516846336cd7396a7 [0,0,0,0,0,1|3,0,0]=4 432 B8R0.9 C=C(C)COC(C)CS b01434085727d0e876ca2f7f806d8f57 [0,0,0,0,0,1|3,0,0]=4 433 B8R0.9 C=C(C)CO[C@@H](C)CC 1f8fa1d6bc957d679b02c8c39dd68048 [0,0,0,0,0,1|2,0,0]=3 434 B8R0.9 C=C(C)CO[C@H](C)CC 4903f87f8690f044163b36d5c736143f [0,0,0,0,0,1|2,0,0]=3 435 B8R0.9 C=C(C)CO[C@H](C)CS ddea732e335cb41581925717666dd076 [0,0,0,0,0,1|3,0,0]=4 436 B8R0.9 C=C(Cl)CNC(C)CC 076dd5595da9764c1f8638621b66326f [0,0,0,0,0,1|2,0,0]=3 437 B8R0.9 C=C(Cl)CNC(C)CO 2dc80d01902a7d5e8dafab7a9437a51b [0,0,0,0,0,1|3,0,0]=4 438 B8R0.9 C=C(Cl)CN[C@@H](C)CC 6844b9915d30cf390d84dd923074ff78 [0,0,0,0,0,1|2,0,0]=3 439 B8R0.9 C=C(Cl)CN[C@@H](C)CO f36a795b66d6bf78b67e64f966438328 [0,0,0,0,0,1|3,0,0]=4 440 B8R0.9 C=C(Cl)CN[C@H](C)CC 00f99e20e2c66def762893e8ac89e470 [0,0,0,0,0,1|2,0,0]=3 441 B8R0.9 C=C(Cl)CN[C@H](C)CO f8ab1a19cf270f4d27a5391240b16b7f [0,0,0,0,0,1|3,0,0]=4 442 B8R0.9 C=C(Cl)COC(C)CC 683db6dee4558a7fd0cf1ddd08de7466 [0,0,0,0,0,1|2,0,0]=3 443 B8R0.9 C=C(Cl)COC(C)CF 28ee613950c3e99b06c6d0c2267d0156 [0,0,0,0,0,1|3,0,0]=4 444 B8R0.9 C=C(Cl)COC(C)CS b1c25e35a49465adaafb251b6dea29ee [0,0,0,0,0,1|3,0,0]=4 445 B8R0.9 C=C(Cl)CO[C@@H](C)CC f1b2ffe2d8a3606ba8db6452fbde499c [0,0,0,0,0,1|2,0,0]=3 446 B8R0.9 C=C(Cl)CO[C@H](C)CC e33ef1408b617f755d53e1b85c1dd1a5 [0,0,0,0,0,1|2,0,0]=3 447 B8R0.9 C=C(Cl)CO[C@H](C)CS 07912e4cc4f9809896d80327b9629e45 [0,0,0,0,0,1|3,0,0]=4 448 B8R0.9 C=C(F)CNC(C)CO 526836e1f2860b0f9f9375a2daf92e9c [0,0,0,0,0,1|3,0,0]=4 449 B8R0.9 C=C(F)CN[C@@H](C)CO 6fc2183cd10b292910560f06e58fef39 [0,0,0,0,0,1|3,0,0]=4 450 B8R0.9 C=C(F)CN[C@H](C)CO 6f97a60c010f3bc80a761604a71ba20d [0,0,0,0,0,1|3,0,0]=4 451 B8R0.9 C=C(I)COC(C)CC 1c02165e4082ec06ba2c7744789ae92c [0,0,0,0,0,1|2,0,0]=3 452 B8R0.9 C=CC(C)NCC(=O)C b2014bf11d5705e4d318fa019758c231 [0,0,0,0,0,1|1,0,2]=4 453 B8R0.9 C=CC(C)NCC(=O)N 8e99b62ce7b0cacfac123da3e0d44453 [0,0,0,0,0,1|1,0,2]=4 454 B8R0.9 C=CC(C)NCC(=O)O 7295ae78f031d02442986d01915b1589 [0,0,0,0,0,1|0,0,2]=3 455 B8R0.9 C=CC(C)OCC(=O)C 9ad41a13855017a691d90b159b9e2ebc [0,0,0,0,0,1|1,0,2]=4 456 B8R0.9 C=CC(C)OCC(=O)N 0d06a7ddf76614144a3227f608d154b8 [0,0,0,0,0,1|1,0,2]=4 457 B8R0.9 C=CC(C)OCC(=O)O a247bec38dd53f48038da06d8390c9f2 [0,0,0,0,0,1|0,0,2]=3 458 B8R0.9 C=CC(C)OCS(=O)O 12c96805dce8caf3e1fcf3a0ad025e66 [0,0,0,0,0,1|1,0,2]=4 459 B8R0.9 C=C[C@H](C)OCC(=O)N ba49805e8ed0d5d0e00a52526e184ffd [0,0,0,0,0,1|1,0,2]=4 460 B8R0.9 C=C[C@H](C)OCC(=O)O 11d6db631afaf24abf76538c811f1efa [0,0,0,0,0,1|0,0,2]=3 461 B8R0.9 CC(=O)CNC(C)C=O 5305abebdd5439cbe27a612adc8c23ab [0,0,0,0,0,1|2,0,1]=4 462 B8R0.9 CC(=O)CNC(C)CO 7f456ce2665c50a288606a55fcadb654 [0,0,0,0,0,1|2,0,0]=3 463 B8R0.9 CC(=O)CN[C@@H](C)CO 3490504cc82c16f891707783a3f5d03b [0,0,0,0,0,1|2,0,0]=3 464 B8R0.9 CC(=O)CN[C@H](C)C=O aeb82f57e8a877f800a721396ffa0f59 [0,0,0,0,0,1|2,0,1]=4 465 B8R0.9 CC(=O)CN[C@H](C)CO b856683376ccfcef5ca680b8cb827c55 [0,0,0,0,0,1|2,0,0]=3 466 B8R0.9 CC(=O)COC(C)C=O b91d02ad7a67994d76fa088d267acff2 [0,0,0,0,0,1|2,0,1]=4 467 B8R0.9 CC(=O)CO[C@H](C)C=O 6df7154fde8ca8fb45e199e7b6ad0f88 [0,0,0,0,0,1|2,0,1]=4 468 B8R0.9 CC(=O)NCC(Br)CBr 026233203db163de359d5c31f32507c5 [0,0,0,0,0,1|3,0,0]=4 469 B8R0.9 CC(=O)NCC(C)C#N 70b6e41d7a36e25b863c12e3e2ab9f7c [0,0,0,0,0,1|2,0,1]=4 470 B8R0.9 CC(=O)NCC(C)CO 5107eece73873b4763584dc1449ad61c [0,0,0,0,0,1|2,0,0]=3 471 B8R0.9 CC(=O)NCC(F)CO b8843bcee854bfdd401231e90b011422 [0,0,0,0,0,1|3,0,0]=4 472 B8R0.9 CC(=O)NCC(O)CO a7a306466b1599337a98d4a78b5d781e [0,0,0,0,0,1|3,0,0]=4 473 B8R0.9 CC(=O)NC[C@@H](F)CO 964c0a882da1253a8b823c85e90b43d9 [0,0,0,0,0,1|3,0,0]=4 474 B8R0.9 CC(=O)NC[C@@H](O)CO a8483dbc09c1c7f138b3ed243987530b [0,0,0,0,0,1|3,0,0]=4 475 B8R0.9 CC(=O)NC[C@H](C)CO 5409bde0c2b60b9f7b568586e701b259 [0,0,0,0,0,1|2,0,0]=3 476 B8R0.9 CC(=O)NC[C@H](F)CO 938a8d1e230afccbf699e7334f08d345 [0,0,0,0,0,1|3,0,0]=4 477 B8R0.9 CC(=O)NC[C@H](O)CO 4c725599a6cf504375db5135be307edf [0,0,0,0,0,1|3,0,0]=4 478 B8R0.9 CC(C#N)NCC(=O)N d29bd277beb2ae89e361147ba0b29db1 [0,0,0,0,0,1|2,0,1]=4 479 B8R0.9 CC(C#N)NCC(=O)O b4dc74a9f9a0e75fffde2f481c0af544 [0,0,0,0,0,1|1,0,1]=3 480 B8R0.9 CC(C#N)OCS(=O)O 406c753176235576bb71e11c0904b6bc [0,0,0,0,0,1|2,0,1]=4 481 B8R0.9 CC(C=O)NCC(=O)N 8e22627cfffb50e4ce2f26bd34026793 [0,0,0,0,0,1|2,0,1]=4 482 B8R0.9 CC(C=O)NCC(=O)O 002ce333b4dccb41c4d993d9c09ef2b3 [0,0,0,0,0,1|1,0,1]=3 483 B8R0.9 CC(C=O)OCC(=O)N e8fdf3bf6f6dfcc63a5ed65bb70bb389 [0,0,0,0,0,1|2,0,1]=4 484 B8R0.9 CC(C=O)OCC(=O)O 564a75409a0d42515a0d6296982e94e6 [0,0,0,0,0,1|1,0,1]=3 485 B8R0.9 CC(C=O)OCS(=O)O 9f51c4b3c988e5d0280d7682a1bfd66e [0,0,0,0,0,1|2,0,1]=4 486 B8R0.9 CC(CF)OCC(=O)N 85ec4187286fdad5a9553ca5e7cee35f [0,0,0,0,0,1|2,0,0]=3 487 B8R0.9 CC(CF)OCC(=O)O 72064f294e73f6a982bc7e430390395e [0,0,0,0,0,1|1,0,0]=2 488 B8R0.9 CC(CF)OC[N+](=O)[O-] 4a6af2c1f13b65251d8b949275a6b1de [0,0,0,0,0,1|2,0,1]=4 489 B8R0.9 CC(CO)NCC(=O)N ca275a4ad15d32e500ba974468999137 [0,0,0,0,0,1|2,0,0]=3 490 B8R0.9 CC(CO)NCC(=O)O 3fa1442f69c9dfa3ad5830b54dce922d [0,0,0,0,0,1|1,0,0]=2 491 B8R0.9 CC(CO)NC[C@@H](C)O b3b457ca8971b770f5960d70ecaa3b4d [0,0,0,0,0,1|2,0,1]=4 492 B8R0.9 CC(CO)NC[C@H](C)O 4b77979cdca58e53e46d0a0730b80eb6 [0,0,0,0,0,1|2,0,1]=4 493 B8R0.9 CC(CO)NC[N+](=O)[O-] c8cef2932297a128bb58d0293856a208 [0,0,0,0,0,1|2,0,1]=4 494 B8R0.9 CC(CS)OCC(=O)N b11e299a771877421c46b123080a3ea9 [0,0,0,0,0,1|2,0,0]=3 495 B8R0.9 CC(CS)OCC(=O)O 6f586a0cfc007fa60414bad735acd25c [0,0,0,0,0,1|1,0,0]=2 496 B8R0.9 CC(CS)OC[N+](=O)[O-] 11c3904c8647864dccf53d192e938581 [0,0,0,0,0,1|2,0,1]=4 497 B8R0.9 CC(O)CNC(C)CO a1b9fd4e4c8e5407d8f4c38ea7432000 [0,0,0,0,0,1|2,0,1]=4 498 B8R0.9 CC(O)CN[C@@H](C)CO fa8ddd2915181b209ca8cd0f4cac931d [0,0,0,0,0,1|2,0,1]=4 499 B8R0.9 CC(O)CN[C@H](C)CO 0a4874882b4a2730c218e76ea399d233 [0,0,0,0,0,1|2,0,1]=4 500 B8R0.9 CCC(=O)NCC(=O)C 5911502c3a8395822fc4c0959647e135 [0,0,0,0,0,1|2,0,1]=4 501 B8R0.9 CCC(=O)NCC(=O)N 07cfd3edf39ace2eb27c9b7f36ff92b5 [0,0,0,0,0,1|2,0,1]=4 502 B8R0.9 CCC(C)CNC(=O)C aa3f1455f544ac3656d43724f45ee4b6 [0,0,0,0,0,1|1,0,0]=2 503 B8R0.9 CCC(C)CNC(C)C 9b22fec9421f72c4c7069f08eeceb961 [0,0,0,0,0,1|2,0,1]=4 504 B8R0.9 CCC(C)COC(C)C 89140aa94488bac2672b51951396900c [0,0,0,0,0,1|2,0,1]=4 505 B8R0.9 CCC(C)NCC(=O)C 6436401da3e43365ad6648f7d16996be [0,0,0,0,0,1|1,0,0]=2 506 B8R0.9 CCC(C)NCC(=O)N 000867cd72bf7abf807440f1d3bec59b [0,0,0,0,0,1|1,0,0]=2 507 B8R0.9 CCC(C)NCC(=O)O f2952a77ab3e8bd898813643bd6d2028 [0,0,0,0,0,1|0,0,0]=1 508 B8R0.9 CCC(C)NCC(C)C 0af4d6f3dad4a1fd6ba7feec2c98edc9 [0,0,0,0,0,1|2,0,1]=4 509 B8R0.9 CCC(C)NCC(C)O 04be39588a5f09c70c74f1ca60cd63ac [0,0,0,0,0,1|1,0,1]=3 510 B8R0.9 CCC(C)NCC(F)F ac878db22ce4d6d74bf195ccbdb3ebf3 [0,0,0,0,0,1|2,0,1]=4 511 B8R0.9 CCC(C)NCN(C)C e4bdd6c609d2932713349d4a6854bfbc [0,0,0,0,0,1|3,0,0]=4 512 B8R0.9 CCC(C)NC[C@@H](C)O 6e798d5c3d31a8f8773bcdb1d14bb58f [0,0,0,0,0,1|1,0,1]=3 513 B8R0.9 CCC(C)NC[C@H](C)O b6ed82170374565ef8a62802ade9580c [0,0,0,0,0,1|1,0,1]=3 514 B8R0.9 CCC(C)NC[N+](=O)[O-] e9f660b74a6c0107f128f338922566a2 [0,0,0,0,0,1|1,0,1]=3 515 B8R0.9 CCC(C)OCC(=O)C 51585707b16cf92a5a0e33fe644c9725 [0,0,0,0,0,1|1,0,0]=2 516 B8R0.9 CCC(C)OCC(=O)N 1b913184d403fb69b64ed9e9c743a425 [0,0,0,0,0,1|1,0,0]=2 517 B8R0.9 CCC(C)OCC(=O)O ba461bfe27072cdbfb8d74924722a4e4 [0,0,0,0,0,1|0,0,0]=1 518 B8R0.9 CCC(C)OCC(=S)N 6b597837cee3e8ac97ffdee12a28c691 [0,0,0,0,0,1|1,1,0]=3 519 B8R0.9 CCC(C)OCC(C)C 94adce536ef43774d73b8b91df56b54a [0,0,0,0,0,1|2,0,1]=4 520 B8R0.9 CCC(C)OCC(C)F 86be792ac47322b60f5884dee7e7f674 [0,0,0,0,0,1|2,0,1]=4 521 B8R0.9 CCC(C)OCC(C)S 5ab58589f526e3be72d839617a185ef8 [0,0,0,0,0,1|1,1,1]=4 522 B8R0.9 CCC(C)OCC(F)F 955e73bf4420f2dcfbe49184c77ba6b7 [0,0,0,0,0,1|2,0,1]=4 523 B8R0.9 CCC(C)OCN(C)C a7e5fe9e74042b38f34d05eca25d0bbd [0,0,0,0,0,1|3,0,0]=4 524 B8R0.9 CCC(C)OCS(=O)O 218f2e14527146233901e95c42e5bea0 [0,0,0,0,0,1|1,0,0]=2 525 B8R0.9 CCC(C)OC[C@@H](C)F 500b158e44a340e901d363fe297442a0 [0,0,0,0,0,1|2,0,1]=4 526 B8R0.9 CCC(C)OC[C@H](C)F dabe59364c55cabe8959691cbb4cbce5 [0,0,0,0,0,1|2,0,1]=4 527 B8R0.9 CCC(C)OC[N+](=O)[O-] ce29daa7a1531741c15d172651ff45bc [0,0,0,0,0,1|1,0,1]=3 528 B8R0.9 CCC(O)CNC(=O)C 303ca77168267846269f8e2248e6c650 [0,0,0,0,0,1|2,0,0]=3 529 B8R0.9 CCN(C)C/C=C(/C)\I 945539a0be2d2b92cfa3d742d9a77c1d [0,0,0,0,0,1|3,0,0]=4 530 B8R0.9 CCN(C)C/C=C(\C)/Cl 5505efc6eb792f0e0e3d3d503392c5e2 [0,0,0,0,0,1|3,0,0]=4 531 B8R0.9 CCN(C)CC=C(C)C c0858b3ee9aa449ac1738f4ea9e9cac4 [0,0,0,0,0,1|3,0,0]=4 532 B8R0.9 CCN(C)CC=C(C)Cl 458299661b7d0fc1677eea27dd2b871d [0,0,0,0,0,1|3,0,0]=4 533 B8R0.9 CCN(C)CC=C(C)I 1af4c35d498622d3ba87dd7d32a0ed2e [0,0,0,0,0,1|3,0,0]=4 534 B8R0.9 CCN(C)CC=C(Cl)Cl f9126f3f367a14a36d9361f259744c02 [0,0,0,0,0,1|3,0,0]=4 535 B8R0.9 CCN(C)CCC(=O)C 704b8017c1fe42d466a2c16771fe60b9 [0,0,0,0,0,1|2,0,0]=3 536 B8R0.9 CCN(C)CCC(=O)N 8598f908b554962aaf272d88582a793e [0,0,0,0,0,1|2,0,0]=3 537 B8R0.9 CCN(C)CCC(=O)O 2d55640deefd272dbf27378182c87c56 [0,0,0,0,0,1|1,0,0]=2 538 B8R0.9 CCN(C)CCC(C)O 4308bf1a991d7ca66cadc45942e7cdad [0,0,0,0,0,1|2,0,1]=4 539 B8R0.9 CCN(C)CCS(=O)C 181957332795259e7c2d453ef9f3db35 [0,0,0,0,0,1|3,0,0]=4 540 B8R0.9 CCN(C)COC(=O)C 662418b9fd851b02bfa0c21ae20e504d [0,0,0,0,0,1|2,0,0]=3 541 B8R0.9 CCN(C)CSC(=O)N adc277bb406ecaf954503ab4cdfcb5b9 [0,0,0,0,0,1|2,0,0]=3 542 B8R0.9 CC[C@@H](C)COC(C)C dc0c1657b56896a2f1684dba0e5f4146 [0,0,0,0,0,1|2,0,1]=4 543 B8R0.9 CC[C@@H](C)NCC(=O)N 00c2922a9a0e085fef41a6936ba22077 [0,0,0,0,0,1|1,0,0]=2 544 B8R0.9 CC[C@@H](C)NCC(=O)O 5c12fd5b6d0cdca7f2b2238c17851dd2 [0,0,0,0,0,1|0,0,0]=1 545 B8R0.9 CC[C@@H](C)NCC(C)C a85721f9bf2f20f81d144de1a37e6fff [0,0,0,0,0,1|2,0,1]=4 546 B8R0.9 CC[C@@H](C)NCC(C)O 2677141b66bad4e2c96cd57b714806ea [0,0,0,0,0,1|1,0,1]=3 547 B8R0.9 CC[C@@H](C)NCC(F)F bee16bbbdf6b5b63b78aca07dde20c02 [0,0,0,0,0,1|2,0,1]=4 548 B8R0.9 CC[C@@H](C)NCN(C)C da3df67a534efc7b51d000d1782526e6 [0,0,0,0,0,1|3,0,0]=4 549 B8R0.9 CC[C@@H](C)NC[C@@H](C)O 259bc8325537e1de1a944df75fdf21f1 [0,0,0,0,0,1|1,0,1]=3 550 B8R0.9 CC[C@@H](C)NC[C@H](C)O 939311d357bc0680fabba2ce4e70d859 [0,0,0,0,0,1|1,0,1]=3 551 B8R0.9 CC[C@@H](C)NC[N+](=O)[O-] 196855ed8a578e4d6ce39740ba6a0275 [0,0,0,0,0,1|1,0,1]=3 552 B8R0.9 CC[C@@H](C)OCC(=O)N 177a1fefad08e7123933fff20860c103 [0,0,0,0,0,1|1,0,0]=2 553 B8R0.9 CC[C@@H](C)OCC(=O)O fcbe44d01b8fa575a40781f8929bf942 [0,0,0,0,0,1|0,0,0]=1 554 B8R0.9 CC[C@@H](C)OCC(C)C 555334e47789bc366cc5b9b7c24f502e [0,0,0,0,0,1|2,0,1]=4 555 B8R0.9 CC[C@@H](C)OCC(F)F b1f425258bf76de6acc436243fa0496e [0,0,0,0,0,1|2,0,1]=4 556 B8R0.9 CC[C@@H](C)OCN(C)C 8cb60f33f7a6d9ee1c3ef80f0ce6df60 [0,0,0,0,0,1|3,0,0]=4 557 B8R0.9 CC[C@@H](C)OC[N+](=O)[O-] 3415ab0ca8c4567cbd4a2ab0de4e9f06 [0,0,0,0,0,1|1,0,1]=3 558 B8R0.9 CC[C@@H](O)CNC(=O)C 214f1ff21aca62cdd2be0dae45336745 [0,0,0,0,0,1|2,0,0]=3 559 B8R0.9 CC[C@H](C)CNC(=O)C 7308e3222c110d542936eb43984d990d [0,0,0,0,0,1|1,0,0]=2 560 B8R0.9 CC[C@H](C)CNC(C)C 51bac89f8a94c583d3620c5691a65724 [0,0,0,0,0,1|2,0,1]=4 561 B8R0.9 CC[C@H](C)COC(C)C 4c1bf27a91b2a1be4e163836e33843e7 [0,0,0,0,0,1|2,0,1]=4 562 B8R0.9 CC[C@H](C)NCC(=O)N f4cbd027635400a1bd56158094969969 [0,0,0,0,0,1|1,0,0]=2 563 B8R0.9 CC[C@H](C)NCC(=O)O d0392c98c4a58fa7920a948e7c8055d4 [0,0,0,0,0,1|0,0,0]=1 564 B8R0.9 CC[C@H](C)NCC(C)C 3e34629dbba78b6d192ded3bac89ba6f [0,0,0,0,0,1|2,0,1]=4 565 B8R0.9 CC[C@H](C)NCC(C)O 99099c99fd14ec2545d713f92de4a778 [0,0,0,0,0,1|1,0,1]=3 566 B8R0.9 CC[C@H](C)NCC(F)F f678cd1e2b3efe8b59a18e52fc23c78f [0,0,0,0,0,1|2,0,1]=4 567 B8R0.9 CC[C@H](C)NCN(C)C 724d126cc1064a663cdc73c4e9d0523d [0,0,0,0,0,1|3,0,0]=4 568 B8R0.9 CC[C@H](C)NC[C@@H](C)O 12a96eae09dd452a73c94b544346a630 [0,0,0,0,0,1|1,0,1]=3 569 B8R0.9 CC[C@H](C)NC[C@H](C)O 4c33e4d27654f70efbcc25d8010eeae9 [0,0,0,0,0,1|1,0,1]=3 570 B8R0.9 CC[C@H](C)NC[N+](=O)[O-] 235d75636034ba6aeae1eb82d8162dd7 [0,0,0,0,0,1|1,0,1]=3 571 B8R0.9 CC[C@H](C)OCC(=O)N a50cd0f8b1faba93c04bb41f0f47043f [0,0,0,0,0,1|1,0,0]=2 572 B8R0.9 CC[C@H](C)OCC(=O)O 8b17e83f890f84f235b698dd6e78f10d [0,0,0,0,0,1|0,0,0]=1 573 B8R0.9 CC[C@H](C)OCC(C)C 5cf0f20f2e3b8b673a5127012ceee597 [0,0,0,0,0,1|2,0,1]=4 574 B8R0.9 CC[C@H](C)OCC(F)F 73d6aa3f1d9ff151ffb59ee0b5f0d246 [0,0,0,0,0,1|2,0,1]=4 575 B8R0.9 CC[C@H](C)OCN(C)C 2bfce71e0693bec63b19a91f66cb8392 [0,0,0,0,0,1|3,0,0]=4 576 B8R0.9 CC[C@H](C)OC[N+](=O)[O-] 877aace2ab2b46fdfe559ad10cf92335 [0,0,0,0,0,1|1,0,1]=3 577 B8R0.9 CN(CF)CCC(=O)N 6d094d2271b3869e64c635a327791e7d [0,0,0,0,0,1|3,0,0]=4 578 B8R0.9 CN(CF)CCC(=O)O 2d013e31aee2f0b22eda4a0cee146222 [0,0,0,0,0,1|2,0,0]=3 579 B8R0.9 CN(CO)CCC(=O)N e23409c848954f75cfbaa958caecdeb6 [0,0,0,0,0,1|3,0,0]=4 580 B8R0.9 CN(CO)CCC(=O)O a563a8e06bffade26f5d2de4c2323adb [0,0,0,0,0,1|2,0,0]=3 581 B8R0.9 CO[C@@H](C)CNC(=O)C 0cf2684fa855f95ea59e4d00d3adab12 [0,0,0,0,0,1|2,0,0]=3 582 B8R0.9 CO[C@H](C)CNC(=O)C 8d64b64f82d28ad11a8f0edbe07358fd [0,0,0,0,0,1|2,0,0]=3 583 B8R0.9 C[C@@H](CO)NCC(=O)N 1720c78da7cf8f54c6473f0f0ad3915f [0,0,0,0,0,1|2,0,0]=3 584 B8R0.9 C[C@@H](CO)NCC(=O)O a4ded20e76f16f8cb0ed35de8a1798b1 [0,0,0,0,0,1|1,0,0]=2 585 B8R0.9 C[C@@H](CO)NC[N+](=O)[O-] 3480edc0ee7db13a1161878bc1afe8a5 [0,0,0,0,0,1|2,0,1]=4 586 B8R0.9 C[C@@H](O)CN[C@@H](C)CO 3ae1deb582924f94cf5f62861ba15598 [0,0,0,0,0,1|2,0,1]=4 587 B8R0.9 C[C@H](C=O)NCC(=O)N ef543a8173a46829d7a3deea97b641bf [0,0,0,0,0,1|2,0,1]=4 588 B8R0.9 C[C@H](C=O)NCC(=O)O da0ba3cdacb20d5b725c1d49bf4457c6 [0,0,0,0,0,1|1,0,1]=3 589 B8R0.9 C[C@H](C=O)OCC(=O)N 0891ae8d42b8c64aeeb2a884817c9c4b [0,0,0,0,0,1|2,0,1]=4 590 B8R0.9 C[C@H](C=O)OCC(=O)O 23da9f85b0c8b6dd61bf484a83ea2877 [0,0,0,0,0,1|1,0,1]=3 591 B8R0.9 C[C@H](C=O)OCS(=O)O 8401cc1464dfb196cf10debf69a3f25d [0,0,0,0,0,1|2,0,1]=4 592 B8R0.9 C[C@H](CO)NCC(=O)N 280db7eb09d450dda3894db03e34aff2 [0,0,0,0,0,1|2,0,0]=3 593 B8R0.9 C[C@H](CO)NCC(=O)O 3604c50bbfd16fc53504ebc03416b43b [0,0,0,0,0,1|1,0,0]=2 594 B8R0.9 C[C@H](CO)NC[C@@H](C)O 0c791e5e7d94d2a38d5f859dad7628f0 [0,0,0,0,0,1|2,0,1]=4 595 B8R0.9 C[C@H](CO)NC[N+](=O)[O-] 765df81bbf0a0b13e5d5d509e2eb070f [0,0,0,0,0,1|2,0,1]=4 596 B8R0.9 C[C@H](CS)OCC(=O)N 99b35c1160d6521244a3a6571fb38a94 [0,0,0,0,0,1|2,0,0]=3 597 B8R0.9 C[C@H](CS)OCC(=O)O ec11162dd59d106eaabeedeed690abec [0,0,0,0,0,1|1,0,0]=2 598 B8R0.9 C[C@H](CS)OC[N+](=O)[O-] 9944617e0e706dcd95690ed996f66ada [0,0,0,0,0,1|2,0,1]=4 599 B8R0.9 C[C@H](O)CN[C@@H](C)CO ccedc2ee6039e5ae689a515db1821b9d [0,0,0,0,0,1|2,0,1]=4 600 B8R0.9 C[C@H](O)CN[C@H](C)CO 16e70066eda8e6ba0018098e6ed94053 [0,0,0,0,0,1|2,0,1]=4 601 B5R0.2 CCCNC=O 394eea314e4a7e284e23571b2081e74b [2,0,0,0,0,0|1,0,0]=3 602 B5R0.2 CCCNCO d60b753d66bdce688dd2adf0f18abf34 [2,0,0,0,0,0|1,0,1]=4 603 B5R0.2 CCNCCO 2fc34530a6c959b43319124309163fa3 [2,0,0,0,0,0|1,0,1]=4 604 B5R0.2 O=CNCCBr 7c28f652da8d817ffdc4b1e301878e6d [2,0,0,0,0,0|2,0,0]=4 605 B5R0.2 O=CNCCF cc6ab20072548fa955497a25033be1e2 [2,0,0,0,0,0|2,0,0]=4 606 B5R0.2 O=CNCCI 782f0f8ecb3f6f21bf51449dd497a309 [2,0,0,0,0,0|2,0,0]=4 607 B5R0.2 O=CNCCO 0b79256f67d9aeba37165bf9fc8ffac5 [2,0,0,0,0,0|2,0,0]=4 608 B5R0.2 O=CNCCS 22fad8cac4457d75d73ab95d2ca38298 [2,0,0,0,0,0|2,0,0]=4 609 B5R0.3 CCN(C)C=O 60ddb02da2ac3e0bbf46f02c328ae40d [2,0,0,0,0,0|1,0,0]=3 610 B5R0.3 CCN(C)CC ab5b03184b17818ff0d4295949ca4956 [2,0,0,0,0,0|1,0,1]=4 611 B5R0.3 CCN(C)CF f1609b6f0307b235e83ada8bb1f6ec70 [2,0,0,0,0,0|2,0,0]=4 612 B5R0.3 CCN(C)CO 992ae963459eb3513b2ca42228fd2ef7 [2,0,0,0,0,0|1,0,0]=3 613 B7R0.3 C#CC(C)NCC=O ee5942f89b23fd86f41ead0eb91f1f2e [1,1,0,0,0,0|0,0,2]=4 614 B7R0.3 C#CC(C)OCC=O ba88f9e6c584cf37d447c8f942df3466 [1,1,0,0,0,0|0,0,2]=4 615 B7R0.3 C#CCNC(C)CC 1c8cf786a7bf62a91e9eb3f09e0e4cb9 [1,1,0,0,0,0|1,0,1]=4 616 B7R0.3 C#CCN[C@@H](C)CC 48b5b4e4c3419c4d390c7be2cfb833e7 [1,1,0,0,0,0|1,0,1]=4 617 B7R0.3 C#CCN[C@H](C)CC 301aa888349cf4ee28848f6c9d611572 [1,1,0,0,0,0|1,0,1]=4 618 B7R0.3 C#CCOC(C)CC 59388fb49cbbdba7f912f977834cecae [1,1,0,0,0,0|1,0,1]=4 619 B7R0.3 C#CCO[C@@H](C)CC 0638932b66273b5968485ec5247ca338 [1,1,0,0,0,0|1,0,1]=4 620 B7R0.3 C#CCO[C@H](C)CC 846e054615825e240b725005682063ae [1,1,0,0,0,0|1,0,1]=4 621 B7R0.3 C#C[C@@H](C)NCC=O 5e75d1c6c4c57369266bed642bd09c8c [1,1,0,0,0,0|0,0,2]=4 622 B7R0.3 C#C[C@@H](C)OCC=O e5dc09536c65fde58fa0a450d6db7a37 [1,1,0,0,0,0|0,0,2]=4 623 B7R0.3 C#C[C@H](C)NCC=O a08e4dd67e9c6ea8e5647895c6d0c01d [1,1,0,0,0,0|0,0,2]=4 624 B7R0.3 C#C[C@H](C)OCC=O 0416c8a6869357496f6fa27d6441617b [1,1,0,0,0,0|0,0,2]=4 625 B7R0.3 C/C=C/CN(C)CC a833def0c5a9483904429a6d4fa647bf [1,1,0,0,0,0|2,0,0]=4 626 B7R0.3 C/C=C\CN(C)CC 0d52835f1d4ec546901139cc9ef0efe3 [1,1,0,0,0,0|2,0,0]=4 627 B7R0.3 C=CC(C)NCC=O 39b14e3f69e0eb05b9593b7c40c09aad [1,1,0,0,0,0|0,0,2]=4 628 B7R0.3 C=CC(C)OCC=O cb8ab1e26c946580cb2eacb238eceadb [1,1,0,0,0,0|0,0,2]=4 629 B7R0.3 C=CCCN(C)CC 224a5773b1b84beacfc8f44066799c60 [1,1,0,0,0,0|2,0,0]=4 630 B7R0.3 C=CCNC(C)CC d45d48be61d418ef3d95cad9c5582bbe [1,1,0,0,0,0|1,0,0]=3 631 B7R0.3 C=CCNC(C)CO a948e20f9bd4754ec87302b6fdce81b3 [1,1,0,0,0,0|2,0,0]=4 632 B7R0.3 C=CCN[C@@H](C)CC c610fd310f1909b965f637191eeb2b15 [1,1,0,0,0,0|1,0,0]=3 633 B7R0.3 C=CCN[C@@H](C)CO e3ac2dff9fa8b94ad1bb6f4b16ad0799 [1,1,0,0,0,0|2,0,0]=4 634 B7R0.3 C=CCN[C@H](C)CC 0c789cf00460bd8cdb23c51009c4742c [1,1,0,0,0,0|1,0,0]=3 635 B7R0.3 C=CCN[C@H](C)CO 45438ab57072f0e042c82a4659374125 [1,1,0,0,0,0|2,0,0]=4 636 B7R0.3 C=CCOC(C)CC 787a9267d8fe014db706087d78f6c857 [1,1,0,0,0,0|1,0,0]=3 637 B7R0.3 C=CCOC(C)CF fb11bf0cefab4ea0e38b93cfcee01743 [1,1,0,0,0,0|2,0,0]=4 638 B7R0.3 C=CCOC(C)CS 0ddb9af989e9e9c33b24b66863a996b5 [1,1,0,0,0,0|2,0,0]=4 639 B7R0.3 C=CCO[C@@H](C)CC b304fc3faf864b09563f01310febaac7 [1,1,0,0,0,0|1,0,0]=3 640 B7R0.3 C=CCO[C@H](C)CC 15018d65de2076ec221d9660c184c296 [1,1,0,0,0,0|1,0,0]=3 641 B7R0.3 C=CCO[C@H](C)CS fd43ed19bf853317b3a063b2977abf8d [1,1,0,0,0,0|2,0,0]=4 642 B7R0.3 C=C[C@H](C)OCC=O 1b1ed3039c6605fda21f2d5059ac888e [1,1,0,0,0,0|0,0,2]=4 643 B7R0.3 CC(C#N)NCC=O 69c055aa64463f8147e8c2a5cf4caa1a [1,1,0,0,0,0|1,0,1]=4 644 B7R0.3 CC(C=O)OCC=O 216dc0b62aef64aacebb34095641e5d6 [1,1,0,0,0,0|1,0,1]=4 645 B7R0.3 CC(CF)OCC=O 41897813684ca2355d787ae430508b45 [1,1,0,0,0,0|1,0,0]=3 646 B7R0.3 CC(CO)CNC=O 24fbd7aa61fab8c89f8d9333e1a09567 [1,1,0,0,0,0|1,0,0]=3 647 B7R0.3 CC(CO)CNCO 21fb23aa708a9b1afe928be1d7d3777a [1,1,0,0,0,0|1,0,1]=4 648 B7R0.3 CC(CO)NCC=O abc80e1c9772f639d76c5de7d6ae2b6e [1,1,0,0,0,0|1,0,0]=3 649 B7R0.3 CC(CO)NCCO 5cd093cef9425d970f2779cfd472d185 [1,1,0,0,0,0|1,0,1]=4 650 B7R0.3 CC(CS)OCC=O 4070359928b4f2d4ef682a3d0e169b5c [1,1,0,0,0,0|1,0,0]=3 651 B7R0.3 CCC(C)CNC#N 2745cea8547630c0663889b1b93db18f [1,1,0,0,0,0|1,0,1]=4 652 B7R0.3 CCC(C)CNC=O ebd419a28eb79e00a55acb30bf712ff2 [1,1,0,0,0,0|0,0,0]=2 653 B7R0.3 CCC(C)CNCF b50ea40d2446dde4a785720e8c9ab76e [1,1,0,0,0,0|1,0,1]=4 654 B7R0.3 CCC(C)CNCO a95514de2db5be0c68571e33ca613f6e [1,1,0,0,0,0|0,0,1]=3 655 B7R0.3 CCC(C)COCF d83d0a95392ef09a2490e51164140783 [1,1,0,0,0,0|1,0,1]=4 656 B7R0.3 CCC(C)NCC#N 9dccc3b7b0f5034900215eb41b1410b6 [1,1,0,0,0,0|1,0,1]=4 657 B7R0.3 CCC(C)NCC=O e7aeaed45b54a2e3fad4afa638418830 [1,1,0,0,0,0|0,0,0]=2 658 B7R0.3 CCC(C)NCCBr a824f3363a2868a7206559546a3484f0 [1,1,0,0,0,0|1,0,1]=4 659 B7R0.3 CCC(C)NCCF 2a8d3394dec4d41ce38c860bf4ab17dd [1,1,0,0,0,0|1,0,1]=4 660 B7R0.3 CCC(C)NCCI 6c2db2487fbf25506eed8cabe391bbb0 [1,1,0,0,0,0|1,0,1]=4 661 B7R0.3 CCC(C)NCCO 513c7a6bd13dc3bbf026a87954b89604 [1,1,0,0,0,0|0,0,1]=3 662 B7R0.3 CCC(C)NCCS 7a8d315a94e5493fa661ae8da8c0d7d5 [1,1,0,0,0,0|0,1,1]=4 663 B7R0.3 CCC(C)NCOC 7706fa764743624f662862fda01b7a28 [1,1,0,0,0,0|1,0,1]=4 664 B7R0.3 CCC(C)NCSC c04eb7da5ed0a2a03e68485c2016666a [1,1,0,0,0,0|2,0,0]=4 665 B7R0.3 CCC(C)OCC#N 50ba24c28a608cb499d346735f93665e [1,1,0,0,0,0|1,0,1]=4 666 B7R0.3 CCC(C)OCC=O 3048fa7b9eb03a623d9ab002261defa2 [1,1,0,0,0,0|0,0,0]=2 667 B7R0.3 CCC(C)OCCF b50b83f4cc04a33902077c0b3a238cbc [1,1,0,0,0,0|1,0,1]=4 668 B7R0.3 CCC(C)OCCS 0b195719e1e4b78092bc0c0213134f4f [1,1,0,0,0,0|0,1,1]=4 669 B7R0.3 CCC(C)OCOC 7b2a5b8cb8aef52b76ee0f9de192d2d0 [1,1,0,0,0,0|1,0,1]=4 670 B7R0.3 CCC(C)OCSC a5a0b25f047959799e9ece96fa20b187 [1,1,0,0,0,0|2,0,0]=4 671 B7R0.3 CCC(O)CNC=O 3e7e1c1d57179570b5ce8a6f87ec4444 [1,1,0,0,0,0|1,0,0]=3 672 B7R0.3 CCC(O)CNCO 979e1feff1eac75f1747d85e3216f621 [1,1,0,0,0,0|1,0,1]=4 673 B7R0.3 CCCNC(C)CC 943eb030d61b8e5bd9a7ef7a782a9e18 [1,1,0,0,0,0|1,0,1]=4 674 B7R0.3 CCCN[C@@H](C)CC 9b5d6f86dd01bda6e2759939f83bc7a8 [1,1,0,0,0,0|1,0,1]=4 675 B7R0.3 CCCN[C@H](C)CC 1516fdad8637f0b3c763f64cc7a7beb7 [1,1,0,0,0,0|1,0,1]=4 676 B7R0.3 CCCOC(C)CC 98a624a488dc392a35e8b0b44aac3f30 [1,1,0,0,0,0|1,0,1]=4 677 B7R0.3 CCCO[C@@H](C)CC af9e77ade15ce19a7659cd0cba0e805a [1,1,0,0,0,0|1,0,1]=4 678 B7R0.3 CCCO[C@H](C)CC aceb38a7b284bb9c5e1ae0a6fb45caa0 [1,1,0,0,0,0|1,0,1]=4 679 B7R0.3 CCN(C)C/C=C/Cl 823585dad91397251f5e992cc63297db [1,1,0,0,0,0|2,0,0]=4 680 B7R0.3 CCN(C)C/C=C\Cl c5e2db65672dae81ab8ccdee907a4957 [1,1,0,0,0,0|2,0,0]=4 681 B7R0.3 CCN(C)C/C=C\O 60deab8000357700021216d9934790c2 [1,1,0,0,0,0|1,0,0]=3 682 B7R0.3 CCN(C)CCC=O 7943cc4d9a1ab8d439ad27cf7b079146 [1,1,0,0,0,0|1,0,0]=3 683 B7R0.3 CCN(C)CCCO b1a93de8904fff1ed54369ee01ff1bc7 [1,1,0,0,0,0|1,0,1]=4 684 B7R0.3 CCN(C)CCOC 4abfef839ac1a01d5b0d90f7c9bd6930 [1,1,0,0,0,0|1,0,1]=4 685 B7R0.3 CCN(C)CCON dca6e8ee84d04b2409e73b61f0963e17 [1,1,0,0,0,0|1,0,1]=4 686 B7R0.3 CCNCC(C)CC 1a6ded6349edd095188d6a9fb8900c29 [1,1,0,0,0,0|1,0,1]=4 687 B7R0.3 CCNC[C@@H](C)CC 79edf92db75b8292301b7cbe642600de [1,1,0,0,0,0|1,0,1]=4 688 B7R0.3 CCOCC(C)CC b48ffd68a9924a596413f28a1f26cd9a [1,1,0,0,0,0|1,0,1]=4 689 B7R0.3 CCOC[C@@H](C)CC 24d1c149f27d56a7b1370d3d84a93c4a [1,1,0,0,0,0|1,0,1]=4 690 B7R0.3 CCOC[C@H](C)CC e4857d3b038c108c7619c84891e8a2f7 [1,1,0,0,0,0|1,0,1]=4 691 B7R0.3 CC[C@@H](C)CNC#N c544182635f262c6345531d07f549545 [1,1,0,0,0,0|1,0,1]=4 692 B7R0.3 CC[C@@H](C)COCF 27ee9a97e87757a57bbd2473b47c8a0b [1,1,0,0,0,0|1,0,1]=4 693 B7R0.3 CC[C@@H](C)NCC#N 349bbcd477486d683d830b5721177924 [1,1,0,0,0,0|1,0,1]=4 694 B7R0.3 CC[C@@H](C)NCC=O 728ce0e6b12a20079c33ab77be7d6271 [1,1,0,0,0,0|0,0,0]=2 695 B7R0.3 CC[C@@H](C)NCCF 93d07692499e3b9aec2552214e2ff53f [1,1,0,0,0,0|1,0,1]=4 696 B7R0.3 CC[C@@H](C)NCCO 72cce7ce1a4c2aadd49ed6fa51eb30e5 [1,1,0,0,0,0|0,0,1]=3 697 B7R0.3 CC[C@@H](C)NCCS 34946916ab9d46b94332e25fb6d97f4b [1,1,0,0,0,0|0,1,1]=4 698 B7R0.3 CC[C@@H](C)NCOC 6f18e43812c50f5929ea1f0282d55276 [1,1,0,0,0,0|1,0,1]=4 699 B7R0.3 CC[C@@H](C)NCSC b2ccc0121f9ed49266567b6f15a655a0 [1,1,0,0,0,0|2,0,0]=4 700 B7R0.3 CC[C@@H](C)OCC#N 967f2c3fca95251181598ab565d2caef [1,1,0,0,0,0|1,0,1]=4 701 B7R0.3 CC[C@@H](C)OCC=O fcdaaaea8501897d08b7daa2ec02db5c [1,1,0,0,0,0|0,0,0]=2 702 B7R0.3 CC[C@@H](C)OCCF 9a9e445f08d44c81e417052c615c3334 [1,1,0,0,0,0|1,0,1]=4 703 B7R0.3 CC[C@@H](C)OCCS c58b0dc1d2db79db526d0ab1218bffc7 [1,1,0,0,0,0|0,1,1]=4 704 B7R0.3 CC[C@@H](C)OCOC 5dd2de1ba91f6cde19e7a670f775c35c [1,1,0,0,0,0|1,0,1]=4 705 B7R0.3 CC[C@@H](C)OCSC 07780bc57acd6b7b99e87c445c42d82f [1,1,0,0,0,0|2,0,0]=4 706 B7R0.3 CC[C@@H](O)CNC=O 35e0b928eef0050ada3a4c2a6cc4db4c [1,1,0,0,0,0|1,0,0]=3 707 B7R0.3 CC[C@@H](O)CNCO 3c3de5c9d0ff6c16983c8a1b36ce8a94 [1,1,0,0,0,0|1,0,1]=4 708 B7R0.3 CC[C@H](C)CNC#N 2d01ca5f7fbda4ac4ea7b7d65717717e [1,1,0,0,0,0|1,0,1]=4 709 B7R0.3 CC[C@H](C)CNC=O 8ddf4a7afc076d1492904a4e2d1a92ee [1,1,0,0,0,0|0,0,0]=2 710 B7R0.3 CC[C@H](C)CNCF d271465589c016cce21e3753bb72dfde [1,1,0,0,0,0|1,0,1]=4 711 B7R0.3 CC[C@H](C)CNCO 0fe58ceb43d0411047b54aeefa27fcda [1,1,0,0,0,0|0,0,1]=3 712 B7R0.3 CC[C@H](C)COCF 4d1b50442964dee0f36120907b5bf9ca [1,1,0,0,0,0|1,0,1]=4 713 B7R0.3 CC[C@H](C)NCC#N 79fe87b82bd2f5a7dcac84c0d29fce58 [1,1,0,0,0,0|1,0,1]=4 714 B7R0.3 CC[C@H](C)NCC=O b6d86a7489e7187a7b6be26ba88b7b85 [1,1,0,0,0,0|0,0,0]=2 715 B7R0.3 CC[C@H](C)NCCF c11007e79ee49cb1e974e79b53eb68c8 [1,1,0,0,0,0|1,0,1]=4 716 B7R0.3 CC[C@H](C)NCCO 14df35d641eb74814d616543d777742c [1,1,0,0,0,0|0,0,1]=3 717 B7R0.3 CC[C@H](C)NCCS e1691e0903c1eea23ce2232b4f4ff483 [1,1,0,0,0,0|0,1,1]=4 718 B7R0.3 CC[C@H](C)NCOC 487baefd593a366fd401fe5a0b33d07a [1,1,0,0,0,0|1,0,1]=4 719 B7R0.3 CC[C@H](C)NCSC b4999c020810a33e4d86f949175dda2d [1,1,0,0,0,0|2,0,0]=4 720 B7R0.3 CC[C@H](C)OCC#N ea9aeb285d0ece3233263861719aeec4 [1,1,0,0,0,0|1,0,1]=4 721 B7R0.3 CC[C@H](C)OCC=O 1749dffdbae3c22c50ca54c1db5fd2b4 [1,1,0,0,0,0|0,0,0]=2 722 B7R0.3 CC[C@H](C)OCCF b495df4c5acd12e724246ab7aab5bcc3 [1,1,0,0,0,0|1,0,1]=4 723 B7R0.3 CC[C@H](C)OCCS d78ff3c7dda26d3bc7cef65283cd3558 [1,1,0,0,0,0|0,1,1]=4 724 B7R0.3 CC[C@H](C)OCOC 841bb4da5d82dffee5f6f29fdb10c40b [1,1,0,0,0,0|1,0,1]=4 725 B7R0.3 CC[C@H](C)OCSC 879c6380126ff9fd0bdc6f15a431ea23 [1,1,0,0,0,0|2,0,0]=4 726 B7R0.3 CO[C@@H](C)CNC=O cbdf409ea735afb7a574d69375fb28db [1,1,0,0,0,0|1,0,0]=3 727 B7R0.3 CO[C@@H](C)CNCO ff28fd2c886f6ee1545aaf943963c99e [1,1,0,0,0,0|1,0,1]=4 728 B7R0.3 CO[C@H](C)CNC=O 943b01dc3bd1c6157c7dfb62f870e0a6 [1,1,0,0,0,0|1,0,0]=3 729 B7R0.3 CO[C@H](C)CNCO ef2aaae2be2c576592de749a4d18a6e8 [1,1,0,0,0,0|1,0,1]=4 730 B7R0.3 C[C@@H](CO)NCC=O 20c7bf02d372e36cba042ac5b28907f5 [1,1,0,0,0,0|1,0,0]=3 731 B7R0.3 C[C@@H](CO)NCCO f533b151726db8df114b2e138c242e75 [1,1,0,0,0,0|1,0,1]=4 732 B7R0.3 C[C@H](CO)CNC=O 32037413a41facbb9dd3661f525eb476 [1,1,0,0,0,0|1,0,0]=3 733 B7R0.3 C[C@H](CO)CNCO e7c0a7e8a9580f5a7445a0921a5a0780 [1,1,0,0,0,0|1,0,1]=4 734 B7R0.3 C[C@H](CO)NCC=O 1a3e3f6cab470e0221e0a223d10de41c [1,1,0,0,0,0|1,0,0]=3 735 B7R0.3 C[C@H](CO)NCCO 57e737113b903a53b0864be81471f1e6 [1,1,0,0,0,0|1,0,1]=4 736 B7R0.3 C[C@H](CS)OCC=O 54b8c633a4f5d8e7a615987326df81f2 [1,1,0,0,0,0|1,0,0]=3 737 B7R0.3 O=CNCC(Br)CBr 93597cc22f25c51d1dc8b5845ef56682 [1,1,0,0,0,0|2,0,0]=4 738 B7R0.3 O=CNCC(F)CO 20b10b91868850c2fa4696a502438329 [1,1,0,0,0,0|2,0,0]=4 739 B7R0.3 O=CNCC(O)CO f07ee978b5361099ae5463db2d8284c6 [1,1,0,0,0,0|2,0,0]=4 740 B7R0.3 O=CNC[C@@H](F)CO fe3e6de1ebe35bf08c36352dbce26e10 [1,1,0,0,0,0|2,0,0]=4 741 B7R0.3 O=CNC[C@@H](O)CO 4afeec0bbb868f60f0a97c37149bb7ed [1,1,0,0,0,0|2,0,0]=4 742 B7R0.3 O=CNC[C@H](F)CO 22ed73e19a0bc3d8fec3d0ab621da9c9 [1,1,0,0,0,0|2,0,0]=4 743 B7R0.3 O=CNC[C@H](O)CO bac710e216d9ff7e3114b1f469852b76 [1,1,0,0,0,0|2,0,0]=4 744 B7R0.5 C=CCN(C)C(C)C 96de01368c533ec0e3507154958af2ed [1,1,0,0,0,0|2,0,0]=4 745 B7R0.5 CC(C)C(C)NC=O 4e819ff0160e7ed0f2ff22f1b3980c8f [1,1,0,0,0,0|1,0,0]=3 746 B7R0.5 CC(C)C(C)NCO 3e5c534ac08ff52ad797b9ecde6db54e [1,1,0,0,0,0|1,0,1]=4 747 B7R0.5 CC(C)N(C)CC=O dce9ec45ecad4267effdc3296bdfc642 [1,1,0,0,0,0|1,0,0]=3 748 B7R0.5 CC(C)N(C)CCO 81a28f5ee4f12e11b2d2f617ef1d3581 [1,1,0,0,0,0|1,0,1]=4 749 B7R0.5 CC(C)[C@@H](C)NC=O 83a0d0bfb3b7ec5a070ad221a7115b67 [1,1,0,0,0,0|1,0,0]=3 750 B7R0.5 CC(C)[C@@H](C)NCO dae9283d092fb775f557bbf40fd5342a [1,1,0,0,0,0|1,0,1]=4 751 B7R0.5 CC(C)[C@H](C)NC=O bcc2ba4727ee5d240548f8fc29a1480b [1,1,0,0,0,0|1,0,0]=3 752 B7R0.5 CC(C)[C@H](C)NCO 8adad5810c92a16d836b9deea9f0a802 [1,1,0,0,0,0|1,0,1]=4 753 B7R0.5 CC(O)C(C)NC=O 260810e8bba0286df97574f1b44d4d22 [1,1,0,0,0,0|1,0,0]=3 754 B7R0.5 CC(O)C(C)NCO f5ad7a8ea3ea402c77cd7eb338910db7 [1,1,0,0,0,0|1,0,1]=4 755 B7R0.5 C[C@@H](NC=O)C(F)F 7a46175a666eebcaecea38c10d41c5f2 [1,1,0,0,0,0|2,0,0]=4 756 B7R0.5 C[C@H](NC=O)C(F)F 5e0cefc125bbd8fa20819b1d21e2b0ce [1,1,0,0,0,0|2,0,0]=4 757 B7R0.7 C#CCC(C)OCC c1f6c314cdd73a7fa8ad58ddb797863b [1,1,0,0,0,0|1,0,1]=4 758 B7R0.7 C#CCN(C)CC=O dff01d702c39ab67a4f96703b4d65557 [1,1,0,0,0,0|1,0,1]=4 759 B7R0.7 C/C=C/C(C)OCC 2ab4f7797f6c67b991e2e31923687bf2 [1,1,0,0,0,0|1,0,1]=4 760 B7R0.7 C=CCC(C)OCC e661cd10cce572a7601633678f7f6510 [1,1,0,0,0,0|1,0,0]=3 761 B7R0.7 C=CCC(C)OCF 2ea57e9504db84bdaa251cea2b6d235a [1,1,0,0,0,0|2,0,0]=4 762 B7R0.7 C=CCN(C)CC=O 0a0a0470779380dc482d888ec7270821 [1,1,0,0,0,0|1,0,1]=4 763 B7R0.7 C=CCN(C)CCC 4db190253ad01fc85a9136b104142548 [1,1,0,0,0,0|2,0,0]=4 764 B7R0.7 C=CCN(C)CCF b31bc09de38c09b7eacc67cab349dd8e [1,1,0,0,0,0|2,0,0]=4 765 B7R0.7 C=CCN(C)CCO 979ac659399c5cc5526a5ffaafb300dd [1,1,0,0,0,0|2,0,0]=4 766 B7R0.7 C=CCN(C)CCS 39ef2c909095bde90a27bd83d01eb339 [1,1,0,0,0,0|2,0,0]=4 767 B7R0.7 C=CCN(C)COC 36534bf3b31eb577cc61ba87a9d55a6b [1,1,0,0,0,0|2,0,0]=4 768 B7R0.7 C=CCN(C)CSC f1be06c214da72bca84cecc462a1a3ad [1,1,0,0,0,0|2,0,0]=4 769 B7R0.7 C=CC[C@@H](C)OCC 077d825b2d79fe5b7d34cfc8a591b694 [1,1,0,0,0,0|1,0,0]=3 770 B7R0.7 C=CC[C@@H](C)OCF 51977b3390daf4ec7d8c8b67e41f6ec4 [1,1,0,0,0,0|2,0,0]=4 771 B7R0.7 C=CC[C@H](C)OCC 67560b27043d123cb27b1dfe36dce4bb [1,1,0,0,0,0|1,0,0]=3 772 B7R0.7 C=CC[C@H](C)OCF e1a26aac47576e318dc06827e291df9a [1,1,0,0,0,0|2,0,0]=4 773 B7R0.7 CC(CC#N)NC=O dfc1f8290024fbf8549fe517f54abe5f [1,1,0,0,0,0|1,0,1]=4 774 B7R0.7 CC(CCO)NC=O 892cc7a0d08c79535b8216399ec9a52d [1,1,0,0,0,0|1,0,0]=3 775 B7R0.7 CC(CCO)NCF e6f0c96e8564a4ffab447e5924afc7ff [1,1,0,0,0,0|1,0,1]=4 776 B7R0.7 CC(CCO)NCO dcf0cce30bbba94ae1bdb2661837885d [1,1,0,0,0,0|1,0,1]=4 777 B7R0.7 CC=CC(C)OCC 5361522f2e573115d5b96113c76c93d1 [1,1,0,0,0,0|1,0,1]=4 778 B7R0.7 CCCC(C)NC=O 3b3fdc3aff176c80def2c27de1055661 [1,1,0,0,0,0|1,0,0]=3 779 B7R0.7 CCCC(C)NCC 30687af6c4de8dad0ff98831d5157fbe [1,1,0,0,0,0|1,0,1]=4 780 B7R0.7 CCCC(C)NCO a80a7e4a0f1d75fc2436d616e073099f [1,1,0,0,0,0|1,0,1]=4 781 B7R0.7 CCCC(C)OCC f8a13dff786165aad9d4cfd77470c868 [1,1,0,0,0,0|1,0,1]=4 782 B7R0.7 CCCN(C)CC=O 1c62a002dac50aaed88f0fc6ab9f5e8c [1,1,0,0,0,0|1,0,0]=3 783 B7R0.7 CCCN(C)CCO 78d0d1ebbc45bccd6d086b71283c0541 [1,1,0,0,0,0|1,0,1]=4 784 B7R0.7 CCC[C@@H](C)OCC ad566fabe40b68a5eff8830d607c6d5f [1,1,0,0,0,0|1,0,1]=4 785 B7R0.7 CCC[C@H](C)NC=O d7593154c1a9fc5db070af269735e419 [1,1,0,0,0,0|1,0,0]=3 786 B7R0.7 CCC[C@H](C)NCC 753d5a7572fe2b9f2fd164a2491a308c [1,1,0,0,0,0|1,0,1]=4 787 B7R0.7 CCC[C@H](C)NCO b51a8cc4d30d5ddff8232517fc6ea6d0 [1,1,0,0,0,0|1,0,1]=4 788 B7R0.7 CCC[C@H](C)OCC 1fee3bcf808f20e21cce64abf5182523 [1,1,0,0,0,0|1,0,1]=4 789 B7R0.7 CCNC(C)CC#N 896c231cd495c6357e72819fab470c66 [1,1,0,0,0,0|1,0,1]=4 790 B7R0.7 CCNC(C)CCO 6d74a4cbe1e8603263eb7a06e9e0b8fd [1,1,0,0,0,0|0,0,1]=3 791 B7R0.7 CCNC(C)COC af3d09b9c16b18b44031a6b489b2fd56 [1,1,0,0,0,0|2,0,0]=4 792 B7R0.7 CCN[C@@H](C)CCO 120d76e4d5f3a5851fb1fd775a67dcd3 [1,1,0,0,0,0|0,0,1]=3 793 B7R0.7 CCN[C@@H](C)COC 3587673ce83b198299c531f233570bde [1,1,0,0,0,0|2,0,0]=4 794 B7R0.7 CCN[C@H](C)CCO d88e997127477e2d2a92514b9d55e900 [1,1,0,0,0,0|0,0,1]=3 795 B7R0.7 CCN[C@H](C)COC 769259f23e0c7be858a9664721e9e588 [1,1,0,0,0,0|2,0,0]=4 796 B7R0.7 CCOC(C)CC#N 74c7ff950e02e978c381dad00f0222ea [1,1,0,0,0,0|1,0,1]=4 797 B7R0.7 CCOC(C)COC fe243350564a7dc6ae1ae7113d5524f6 [1,1,0,0,0,0|2,0,0]=4 798 B7R0.7 CCOC(C)CSC e325c79726bf48130f9e676fa3908dca [1,1,0,0,0,0|2,0,0]=4 799 B7R0.7 CCO[C@@H](C)CC#N 79f640333f75719e0019c555e2ed7c25 [1,1,0,0,0,0|1,0,1]=4 800 B7R0.7 CCO[C@@H](C)COC f439908527642fb0fb69029fa9f8bc89 [1,1,0,0,0,0|2,0,0]=4 801 B7R0.7 CCO[C@H](C)CC#N 853352ce16f989e76716e5f2635f2407 [1,1,0,0,0,0|1,0,1]=4 802 B7R0.7 CCO[C@H](C)COC 9a86a7ea1ccd0f751a8074ffc2bb4277 [1,1,0,0,0,0|2,0,0]=4 803 B7R0.7 CN(CC#N)CC=O 12ba89d8d84c8f98fbf202698aed3177 [1,1,0,0,0,0|1,0,1]=4 804 B7R0.7 CN(CC=O)CCF e000d0184f9f374c5d6d2759945d9138 [1,1,0,0,0,0|1,0,0]=3 805 B7R0.7 CN(CC=O)CCO c9392a8ee79c46afd21599c8df016274 [1,1,0,0,0,0|1,0,0]=3 806 B7R0.7 CN(CCO)CCF 423bb7df0641cc2b0b9f40d044f22314 [1,1,0,0,0,0|1,0,1]=4 807 B7R0.7 CN(CCO)CCO ef0e337ef14d25ff6ba8a3c07f6d7053 [1,1,0,0,0,0|1,0,1]=4 808 B7R0.7 CN(CCO)CCS 8f9521937335f69fe4f66a692ec136fa [1,1,0,0,0,0|1,0,1]=4 809 B7R0.7 COCC(C)NC=O 45a0b649e4600219d555cc1f9498bdc8 [1,1,0,0,0,0|1,0,0]=3 810 B7R0.7 COCC(C)NCO 6c5d5187b65d28bd76ca5cd109efad49 [1,1,0,0,0,0|1,0,1]=4 811 B7R0.7 COCN(C)CCO 5aba17f9d68b8c1f364bdcdaa93aa01e [1,1,0,0,0,0|1,0,1]=4 812 B7R0.7 COC[C@@H](C)NC=O d1500602ed7da53624fa7ed4337a50c3 [1,1,0,0,0,0|1,0,0]=3 813 B7R0.7 COC[C@@H](C)NCO 5b123b6ebd0e85051da558c3ea88e6ed [1,1,0,0,0,0|1,0,1]=4 814 B7R0.7 COC[C@H](C)NC=O 9ace0af38b8cac4dc5e5d6d9564d36a8 [1,1,0,0,0,0|1,0,0]=3 815 B7R0.7 COC[C@H](C)NCO d58653f64afc5f3d3534e35a74eeeaa8 [1,1,0,0,0,0|1,0,1]=4 816 B7R0.7 CSCN(C)CCO 7ed81f2aa884158a210c057b422414ea [1,1,0,0,0,0|1,0,1]=4 817 B7R0.7 C[C@@H](CCO)NC=O eb95ec52954fcdf5dbae515a1b580040 [1,1,0,0,0,0|1,0,0]=3 818 B7R0.7 C[C@@H](CCO)NCF 35f1d2cdbf2c5b52cb9e37f48197b555 [1,1,0,0,0,0|1,0,1]=4 819 B7R0.7 C[C@@H](CCO)NCO d1bf1253e6c406f96778567e6d5de8e7 [1,1,0,0,0,0|1,0,1]=4 820 B7R0.7 C[C@H](CCO)NC=O b74e456417922c93cc7901b1f7160ec1 [1,1,0,0,0,0|1,0,0]=3 821 B7R0.7 C[C@H](CCO)NCF dcb503816f0fded4b6581421c9c4b10d [1,1,0,0,0,0|1,0,1]=4 822 B7R0.7 C[C@H](CCO)NCO ccd004333d3de23c28e090d6ff4977aa [1,1,0,0,0,0|1,0,1]=4 823 B7R0.10 C=CC(C)N(C)CC 4e19c64cea3fd4c093ea40cd82bb7bd4 [1,1,0,0,0,0|2,0,0]=4 824 B7R0.10 CC(CO)N(C)C=O 4659927dd4489ef42e67e78276d3b1b4 [1,1,0,0,0,0|2,0,0]=4 825 B7R0.10 CCC(C)N(C)C=O aaa2a77e867aed83923621e3629d674e [1,1,0,0,0,0|1,0,0]=3 826 B7R0.10 CCC(C)N(C)CO 1b36e6675b647f3c2b421b00c5b597a7 [1,1,0,0,0,0|1,0,1]=4 827 B7R0.10 CCN(C)C(=O)C=O db5732fec82020b1e06387d47e0f63dc [1,1,0,0,0,0|1,0,1]=4 828 B7R0.10 CCN(C)C(C)C=O 3a064273f8f7f25930c79a89d95b0e17 [1,1,0,0,0,0|1,0,0]=3 829 B7R0.10 CCN(C)C(C)CO bebabfe649434d11c02db23f8c999491 [1,1,0,0,0,0|1,0,1]=4 830 B7R0.10 CCN(C)[C@@H](C)CO 0928581d52d4c504aa98f7d51aa86889 [1,1,0,0,0,0|1,0,1]=4 831 B7R0.10 CCN(C)[C@H](C)C=O 193bc5a546dbc7ad240f6d8ae5d9f8d3 [1,1,0,0,0,0|1,0,0]=3 832 B7R0.10 CCN(C)[C@H](C)CO 9f8b649df632bf19345f656ecd33a6ed [1,1,0,0,0,0|1,0,1]=4 833 B7R0.10 C[C@@H](CO)N(C)C=O b94b965b512745cf284fdc052a9474ae [1,1,0,0,0,0|2,0,0]=4 834 B7R0.10 C[C@H](CO)N(C)C=O c4c1d9e89c0731cbc76ea32ef421fbca [1,1,0,0,0,0|2,0,0]=4 835 B7R0.11 CC(C)(CF)NC=O ff7fc0b5fb780004ba739902f541960d [1,1,0,0,0,0|2,0,0]=4 836 B7R0.11 CC(C)(CO)NC=O b948c4623b1c99369aaa53f2724551dc [1,1,0,0,0,0|2,0,0]=4 837 B7R0.11 CCC(C)(C)NC=O 467bc47a116e7d37bf8e07bc1f187838 [1,1,0,0,0,0|1,0,0]=3 838 B7R0.11 CCC(C)(C)NCO 5370363c3b1f98f0757110805d0db933 [1,1,0,0,0,0|1,0,1]=4 839 B7R0.12 CCC(CC)NC=O 4175bd0bc40e9e83245363507b336b46 [1,1,0,0,0,0|1,0,0]=3 840 B7R0.12 CCC(CC)NCO 63242e3a6c349fa4dc8099f989675ea6 [1,1,0,0,0,0|1,0,1]=4 841 B7R0.12 CCC(CO)NC=O 742cd9cb7df8523077fcd6bd9de1d480 [1,1,0,0,0,0|1,0,0]=3 842 B7R0.12 CCC(CO)NCO 3c794c1fdc16d6ba628977ba610b2f38 [1,1,0,0,0,0|1,0,1]=4 843 B7R0.12 CCN(CC)CCO 3ebc0ce6d105088470f67e45ca611640 [1,1,0,0,0,0|1,0,1]=4 844 B7R0.12 CCN(CF)CCO 94620f9ce7407b818d47be3cba0eb6a5 [1,1,0,0,0,0|1,0,1]=4 845 B7R0.12 CCN(CO)CCO 7d4857243f6d87024376644d456f8437 [1,1,0,0,0,0|1,0,1]=4 846 B7R0.12 CC[C@@H](CO)NC=O 637c953e48cb45b4be088640a9f26fb2 [1,1,0,0,0,0|1,0,0]=3 847 B7R0.12 CC[C@@H](CO)NCO c3ea7a2fb8cac1d4f9b9352f27d46e24 [1,1,0,0,0,0|1,0,1]=4 848 B7R0.12 CC[C@H](CO)NC=O c5c2fc5e70a5e94955887b0f6db6a1a2 [1,1,0,0,0,0|1,0,0]=3 849 B7R0.12 CC[C@H](CO)NCO 31d6dbcb1b8a1065d54c94ad93fd2f0d [1,1,0,0,0,0|1,0,1]=4 850 B7R0.12 O=CNC(CO)CO cf9304986c9a1419edf6773dbe4f0207 [1,1,0,0,0,0|2,0,0]=4 851 B7R0.9 CC(=O)NC(C)(C)C a1c7999946c2b3954cecc4a7e85b6160 [1,1,0,0,0,0|2,0,0]=4 852 B7R0.16 CC(=O)N(C)C(C)C 68e786e7c5c4f60e8b7c36108316ab9e [1,1,0,0,0,0|2,0,0]=4 853 B7R0.4 C#CCNCC(=O)O 343eb4150e1f97e741a1efc40a4c68ea [1,1,0,0,0,0|0,0,2]=4 854 B7R0.4 C#CCOCC(=O)O 3bcfd2fb505271f199367374d77863ed [1,1,0,0,0,0|0,0,2]=4 855 B7R0.4 C=C(Br)CCOCC cc4fc6a1af0a8e14aface9bf14962130 [1,1,0,0,0,0|2,0,0]=4 856 B7R0.4 C=C(Br)CNCCC fa829c84ae21852cc8a84c5b2b04c392 [1,1,0,0,0,0|2,0,0]=4 857 B7R0.4 C=C(Br)COCCC 5863f2e2fc458f31ad6edaa914f592f2 [1,1,0,0,0,0|2,0,0]=4 858 B7R0.4 C=C(C)CCNCC 496668f773ae381b7253fe5c2e31b849 [1,1,0,0,0,0|2,0,0]=4 859 B7R0.4 C=C(C)CCOCC be6e22e1c69b2a68ed5204ad177f8dbf [1,1,0,0,0,0|2,0,0]=4 860 B7R0.4 C=C(C)CNCCC 9338ac3992e47efae82e0b1fb1732dd0 [1,1,0,0,0,0|2,0,0]=4 861 B7R0.4 C=C(C)COCCC 76f9760152185d12d96d255aaf2df59a [1,1,0,0,0,0|2,0,0]=4 862 B7R0.4 C=C(Cl)CNCCC e211f531740b4a6af99c40dd77a72224 [1,1,0,0,0,0|2,0,0]=4 863 B7R0.4 C=C(Cl)COCCC 8abcd6ae9b62bc4ff24e78f1b1637d62 [1,1,0,0,0,0|2,0,0]=4 864 B7R0.4 C=C(F)CNCCC 4667877133a3f36f4c10609c396b250b [1,1,0,0,0,0|2,0,0]=4 865 B7R0.4 C=C(F)COCCC 16c2ba6933f26fb577f08eb88fa11a89 [1,1,0,0,0,0|2,0,0]=4 866 B7R0.4 C=C(I)COCCC 0f8c92f8408141dde0e1a21bfdcf65bf [1,1,0,0,0,0|2,0,0]=4 867 B7R0.4 C=CCNCC(=O)O 6133d6411223a422a790fc62a49552d6 [1,1,0,0,0,0|0,0,2]=4 868 B7R0.4 C=CCOCC(=O)O 7136a2a50022493c85115a32aa055df0 [1,1,0,0,0,0|0,0,2]=4 869 B7R0.4 CC(=O)CCOCF 82d7d90cce95d3fcb1e3ec26261601b7 [1,1,0,0,0,0|2,0,0]=4 870 B7R0.4 CC(=O)CNCCF 037d57d4c47ace4be0a5087eec27dc1a [1,1,0,0,0,0|2,0,0]=4 871 B7R0.4 CC(=O)CNCCO 86398d1823d67bf69cb8819c5f41ae7a [1,1,0,0,0,0|2,0,0]=4 872 B7R0.4 CC(=O)CNCCS 7ce62300907f9ccd0384e405866d6aaa [1,1,0,0,0,0|2,0,0]=4 873 B7R0.4 CC(=O)COCCF 44a64beb94b3f52bac0afdbbbb0c27fe [1,1,0,0,0,0|2,0,0]=4 874 B7R0.4 CC(=O)COCCS aaf6880c5768e2a52385922f009f4e73 [1,1,0,0,0,0|2,0,0]=4 875 B7R0.4 CC(=O)NCCCCl a50262f9e3620db3f540afde4066de77 [1,1,0,0,0,0|2,0,0]=4 876 B7R0.4 CC(=O)NCCCO cd01194a1a55a891decb932ba2d96e97 [1,1,0,0,0,0|2,0,0]=4 877 B7R0.4 CCCCNC(=O)C 0949c76abd7904d01e0aead7cd919e16 [1,1,0,0,0,0|1,0,0]=3 878 B7R0.4 CCCNCC(=O)C 99413200ab301de7320a2958deb213a6 [1,1,0,0,0,0|1,0,0]=3 879 B7R0.4 CCCNCC(=O)N c6bdb30f5ce304ac84a3a29975920160 [1,1,0,0,0,0|1,0,0]=3 880 B7R0.4 CCCNCC(=O)O 1172f6559bfe8e46309ea809f909cc38 [1,1,0,0,0,0|0,0,0]=2 881 B7R0.4 CCCNCC(C)O daf3f68aedcfe9daf2326198322724f7 [1,1,0,0,0,0|1,0,1]=4 882 B7R0.4 CCCNC[C@@H](C)O 69c59cd948a0a2ada3b8c8ccb896baca [1,1,0,0,0,0|1,0,1]=4 883 B7R0.4 CCCNC[C@H](C)O 72915868db71c51258a7b619113cc692 [1,1,0,0,0,0|1,0,1]=4 884 B7R0.4 CCCNC[N+](=O)[O-] 419587d101301b41277d69884923c893 [1,1,0,0,0,0|1,0,1]=4 885 B7R0.4 CCCOCC(=O)C 96075066d7d27bc87eaacf968c44bcad [1,1,0,0,0,0|1,0,0]=3 886 B7R0.4 CCCOCC(=O)N 96a8c77dd39980465075569d7697e39d [1,1,0,0,0,0|1,0,0]=3 887 B7R0.4 CCCOCC(=O)O 23aff310a77cf1d0723d729060ccc5ab [1,1,0,0,0,0|0,0,0]=2 888 B7R0.4 CCCOCC(=S)N de4cf6b87e1a0924ce6659273b2f578f [1,1,0,0,0,0|1,1,0]=4 889 B7R0.4 CCCOCS(=O)O 0f12db2563a680e281a3900efd4625e1 [1,1,0,0,0,0|1,0,0]=3 890 B7R0.4 CCCOC[N+](=O)[O-] 57fc1d5897b3bb3312e1a8c9c07caf8c [1,1,0,0,0,0|1,0,1]=4 891 B7R0.4 CCNCCC(=O)N 41bbba81e733b9d1286775aca2565c1c [1,1,0,0,0,0|1,0,0]=3 892 B7R0.4 CCNCCC(=O)O 88c0515bc1747e6ea081f59eb14f48f3 [1,1,0,0,0,0|0,0,0]=2 893 B7R0.4 CCNCCC(=S)N 76a84de3aae7ce57b9732b2228d88da8 [1,1,0,0,0,0|1,1,0]=4 894 B7R0.4 CCNCCC(C)O 5c499b0d9d47b4ec3e33a3826caf6cf9 [1,1,0,0,0,0|1,0,1]=4 895 B7R0.4 CCNCCS(=O)C 6adfbd2d8fb4ec32091a9ce07fb581f6 [1,1,0,0,0,0|2,0,0]=4 896 B7R0.4 CCNCCS(=O)O 128b1e77080fe0113eae546bdfad2510 [1,1,0,0,0,0|1,0,0]=3 897 B7R0.4 CCNCC[C@@H](C)O 813fcf5ff2ae94275024925d2e59da87 [1,1,0,0,0,0|1,0,1]=4 898 B7R0.4 CCNCC[C@H](C)O ad44c8835227c03e0dd7a910fcfe11b6 [1,1,0,0,0,0|1,0,1]=4 899 B7R0.4 CCOCCC(=O)C cbf951a39aabdc9cae79b2b81520e5d8 [1,1,0,0,0,0|1,0,0]=3 900 B7R0.4 CCOCCC(=O)N 6008011299c8bcf06da6d1d485db82cf [1,1,0,0,0,0|1,0,0]=3 901 B7R0.4 CCOCCC(=O)O b43dd4fe6d8527741fde301ee2762516 [1,1,0,0,0,0|0,0,0]=2 902 B7R0.4 CCOCCS(=O)C 8e6e406da58bf76b276c249a0b39af9d [1,1,0,0,0,0|2,0,0]=4 903 B7R0.4 CCOCC[N+](=O)[O-] 8e5e0c25af9383a49962ecbafeaf1cdb [1,1,0,0,0,0|1,0,1]=4 904 B7R0.4 CCOCNC(=O)C b051a792d6529617bfbfb0a9edc5ad16 [1,1,0,0,0,0|2,0,0]=4 905 B7R0.4 CCOCNC(=O)N 7f110a3bce734439d6da5de9a8afdb1c [1,1,0,0,0,0|2,0,0]=4 906 B7R0.4 COCCNC(=O)C e9eb3353d96003a03a149314e2f5662c [1,1,0,0,0,0|2,0,0]=4 907 B7R0.4 COCNCC(=O)C 1d22e2faae89557d184e6b77c70e18b9 [1,1,0,0,0,0|2,0,0]=4 908 B7R0.4 COCNCC(=O)N 5eb60c0a5f3dc108975679a2e84d9e64 [1,1,0,0,0,0|2,0,0]=4 909 B7R0.4 COCNCC(=O)O 63e693e6a6943d7d076b731aa43d021d [1,1,0,0,0,0|1,0,0]=3 910 B7R0.4 COCOCC(=O)C 6ffd083eff8647662229227253b2a8dc [1,1,0,0,0,0|2,0,0]=4 911 B7R0.4 COCOCC(=O)N a86a9c95c6a98739f4d98d0cd39ad842 [1,1,0,0,0,0|2,0,0]=4 912 B7R0.4 COCOCC(=O)O a468e60279d972337d82cd5f7b4a85c0 [1,1,0,0,0,0|1,0,0]=3 913 B7R0.4 COCOCS(=O)O 5b78f1d6000a1c6ff13d9dbfa3cb959d [1,1,0,0,0,0|2,0,0]=4 914 B7R0.4 CSCCNC(=O)C d94327ff4326745067a7a93e58177af9 [1,1,0,0,0,0|2,0,0]=4 915 B7R0.4 CSCNCC(=O)C 45bb082b9a0036036408483af8cc43e5 [1,1,0,0,0,0|2,0,0]=4 916 B7R0.4 CSCNCC(=O)N 25bde4292d4cdcaec203d3d8eb65b798 [1,1,0,0,0,0|2,0,0]=4 917 B7R0.4 CSCNCC(=O)O 5c5440b473179a79f0a0bde7f261b934 [1,1,0,0,0,0|1,0,0]=3 918 B7R0.4 CSCOCC(=O)C a99e30955cce4bbe9c0c1e4d13a22534 [1,1,0,0,0,0|2,0,0]=4 919 B7R0.4 CSCOCC(=O)N 26834a3c15e8ab4b1f28f8e0ba47eea5 [1,1,0,0,0,0|2,0,0]=4 920 B7R0.4 CSCOCC(=O)O bc53fc5d2082b4879e00ca1b9daacd0d [1,1,0,0,0,0|1,0,0]=3 921 B7R0.4 CSCOCS(=O)O 10c14278cf265246d24f329a9e0b0189 [1,1,0,0,0,0|2,0,0]=4 922 B7R0.4 N#CCNCC(=O)O 809e9a9d58d178eb22e9b3ea8c029b46 [1,1,0,0,0,0|1,0,1]=4 923 B7R0.4 N#CCOCC(=O)O f440efea3522112d8965a680edd84309 [1,1,0,0,0,0|1,0,1]=4 924 B7R0.4 N#CNCCC(=O)O aa8f36504cb81f27d3e027833d30b74a [1,1,0,0,0,0|1,0,1]=4 925 B7R0.4 NC(=O)CCNCF 20ec4b7c637071ae24e3cdf4bbdc4bb7 [1,1,0,0,0,0|2,0,0]=4 926 B7R0.4 NC(=O)CCNCO 8d6a6b05e8f134f68517fe004903b837 [1,1,0,0,0,0|2,0,0]=4 927 B7R0.4 NC(=O)CCOCF 7d212825caf98dd8861bf8614019cc84 [1,1,0,0,0,0|2,0,0]=4 928 B7R0.4 NC(=O)CNCCBr efd5ac610f3bf0af030019a2a0ff4ee3 [1,1,0,0,0,0|2,0,0]=4 929 B7R0.4 NC(=O)CNCCF 88409f29ce1f997fc9276ae451d20bd9 [1,1,0,0,0,0|2,0,0]=4 930 B7R0.4 NC(=O)CNCCI 0c80ee12c3f6bb203c2aa04fa4e00ea0 [1,1,0,0,0,0|2,0,0]=4 931 B7R0.4 NC(=O)CNCCO 02184e14b25877b3290e4ad2b4992b8c [1,1,0,0,0,0|2,0,0]=4 932 B7R0.4 NC(=O)CNCCS eabeface6d5825fa54ff76a59eda8562 [1,1,0,0,0,0|2,0,0]=4 933 B7R0.4 NC(=O)COCCF d469c79637b991c6fca3d07cba643bba [1,1,0,0,0,0|2,0,0]=4 934 B7R0.4 NC(=O)COCCS cb3082506d52145df233a7d6870ad15a [1,1,0,0,0,0|2,0,0]=4 935 B7R0.4 O=C(O)CCNCF 05f9560a9c5090f2158d127e76253bb5 [1,1,0,0,0,0|1,0,0]=3 936 B7R0.4 O=C(O)CCNCO 4eda81a5ddb9ef19630be70331f35e71 [1,1,0,0,0,0|1,0,0]=3 937 B7R0.4 O=C(O)CCOCF 47a2f1a64d70f1fd70ee05dd145bf666 [1,1,0,0,0,0|1,0,0]=3 938 B7R0.4 O=C(O)CNCCBr 8130f29cad0df7ca3ee5b483ea3f0ae7 [1,1,0,0,0,0|1,0,0]=3 939 B7R0.4 O=C(O)CNCCF 6ae595578428cb8e8437866b629b8546 [1,1,0,0,0,0|1,0,0]=3 940 B7R0.4 O=C(O)CNCCI b126f2904311dc397f067e9011020ab9 [1,1,0,0,0,0|1,0,0]=3 941 B7R0.4 O=C(O)CNCCO 8a2a254c2a92a8e0b0d875df2fbb7a98 [1,1,0,0,0,0|1,0,0]=3 942 B7R0.4 O=C(O)CNCCS a3afb9ba49fa1ab4342d38d48d1d7ee5 [1,1,0,0,0,0|1,0,0]=3 943 B7R0.4 O=C(O)COCCF 0bf6b93a21a854bfb19752b49752a6aa [1,1,0,0,0,0|1,0,0]=3 944 B7R0.4 O=C(O)COCCS d255bc31bb2be8a37fe42b47fabd36dd [1,1,0,0,0,0|1,0,0]=3 945 B7R0.4 O=CCNCC(=O)O 08ed280de66551066677a6ffd3df2c93 [1,1,0,0,0,0|1,0,1]=4 946 B7R0.4 O=CCOCC(=O)O af4627a358303a05a36059ce17b001ba [1,1,0,0,0,0|1,0,1]=4 947 B7R0.4 O=S(O)CCNCF 5944b9373ff00d58b6529129c165d8a2 [1,1,0,0,0,0|2,0,0]=4 948 B7R0.4 O=S(O)CCNCO fb9e10441f05965bf0dcfe0aab296669 [1,1,0,0,0,0|2,0,0]=4 949 B7R0.4 O=S(O)COCCF c36497384bf0c1557cb58aa4b3a78d7a [1,1,0,0,0,0|2,0,0]=4 950 B7R0.4 O=S(O)COCCS 210a74b93542982df908b08eade068db [1,1,0,0,0,0|2,0,0]=4 951 B7R0.6 CC(=O)CNC(C)C afe0e5afa4a4991702b8d7ba141d2521 [1,1,0,0,0,0|2,0,0]=4 952 B7R0.6 CC(=O)COC(C)C 8e58824c7076e094538494c263248304 [1,1,0,0,0,0|2,0,0]=4 953 B7R0.6 CC(=O)NCC(C)C 133e349c691ad200ad773179becc5ae8 [1,1,0,0,0,0|2,0,0]=4 954 B7R0.6 CC(=O)NCC(C)O 0ffb7326836e65b1a201fca72ad947e5 [1,1,0,0,0,0|2,0,0]=4 955 B7R0.6 CC(=O)NC[C@@H](C)O f988b940337d1dc00ccd246da11ece9f [1,1,0,0,0,0|2,0,0]=4 956 B7R0.6 CC(=O)NC[C@H](C)O 1a6130441852f98535cb020ca3c20f02 [1,1,0,0,0,0|2,0,0]=4 957 B7R0.6 CC(C)NCC(=O)N fce70d443053108c75f9dd76e148c70e [1,1,0,0,0,0|2,0,0]=4 958 B7R0.6 CC(C)NCC(=O)O 43feb4147baaae13baaa9c5f09499603 [1,1,0,0,0,0|1,0,0]=3 959 B7R0.6 CC(C)OCC(=O)N 2925a3543d892638d60eb7349262c8f3 [1,1,0,0,0,0|2,0,0]=4 960 B7R0.6 CC(C)OCC(=O)O 4f99bad05a342ea59eb9c6b2912ac68e [1,1,0,0,0,0|1,0,0]=3 961 B7R0.6 CC(C)OCS(=O)O dcec0ddacfe27b8d3be4af6ba949ffc8 [1,1,0,0,0,0|2,0,0]=4 962 B7R0.8 CCNCS(=O)(=O)O bbcfc5d6d557b34dea0908a35a8ee7e3 [1,1,0,0,0,0|2,0,0]=4 963 B9R0.7 C=C(Br)CNC(C)C(C)C bcaf8acd05ffd083ce1dcee86411a852 [0,1,0,0,0,1|2,0,0]=4 964 B9R0.7 C=C(Br)CNC(C)C(C)O 69fe6ab27d6deac9c132f29082730301 [0,1,0,0,0,1|2,0,0]=4 965 B9R0.7 C=C(Br)CN[C@@H](C)C(C)C cf1d40de8e3c518969d873906b144370 [0,1,0,0,0,1|2,0,0]=4 966 B9R0.7 C=C(Br)CN[C@H](C)C(C)C f224bcaadb0a66d64f8c5fcc177602b5 [0,1,0,0,0,1|2,0,0]=4 967 B9R0.7 C=C(Br)COC(C)C(C)C 553bb29a0f6cfd88896e4db98c0a3b14 [0,1,0,0,0,1|2,0,0]=4 968 B9R0.7 C=C(Br)COC(C)C(C)S 6bfe1fbb2835bb3c42a12b807f28fcc9 [0,1,0,0,0,1|2,0,0]=4 969 B9R0.7 C=C(Br)CO[C@@H](C)C(C)C a7301f99117fabb68612acf3dd81f999 [0,1,0,0,0,1|2,0,0]=4 970 B9R0.7 C=C(Br)CO[C@H](C)C(C)C 99d482f42759c2a0416107df034bb1dc [0,1,0,0,0,1|2,0,0]=4 971 B9R0.7 C=C(C)CNC(C)C(C)C ed97aa100e7870a826c1b82a74bfd021 [0,1,0,0,0,1|2,0,0]=4 972 B9R0.7 C=C(C)CNC(C)C(C)O ac51ea709e3f9918c73bb9c6b3473d9b [0,1,0,0,0,1|2,0,0]=4 973 B9R0.7 C=C(C)CN[C@@H](C)C(C)C 32575650cc5b3ce46f11149c561f66a5 [0,1,0,0,0,1|2,0,0]=4 974 B9R0.7 C=C(C)CN[C@H](C)C(C)C 7d6e482dea52371db63c1d27e21e6394 [0,1,0,0,0,1|2,0,0]=4 975 B9R0.7 C=C(C)COC(C)C(C)C a82fd731a384af44821b942737441e91 [0,1,0,0,0,1|2,0,0]=4 976 B9R0.7 C=C(C)COC(C)C(C)S d676d1f02fa2c0265479abeaa3cf68d6 [0,1,0,0,0,1|2,0,0]=4 977 B9R0.7 C=C(C)CO[C@@H](C)C(C)C cdf02811be989a2c781e180a1682d1ae [0,1,0,0,0,1|2,0,0]=4 978 B9R0.7 C=C(C)CO[C@H](C)C(C)C fa68a3054bf1ef1472a92ad5ee3edb80 [0,1,0,0,0,1|2,0,0]=4 979 B9R0.7 C=C(Cl)CNC(C)C(C)C afbeba5cdd7488aaec4f56d1cec6aefd [0,1,0,0,0,1|2,0,0]=4 980 B9R0.7 C=C(Cl)CNC(C)C(C)O dc5b4b33792d739fdd0a50ce808120bf [0,1,0,0,0,1|2,0,0]=4 981 B9R0.7 C=C(Cl)CN[C@@H](C)C(C)C a7e67cba2052df638af7b75bd210f822 [0,1,0,0,0,1|2,0,0]=4 982 B9R0.7 C=C(Cl)CN[C@H](C)C(C)C f76e2089c6dd6a2c6efc77cde67df77f [0,1,0,0,0,1|2,0,0]=4 983 B9R0.7 C=C(Cl)COC(C)C(C)C 3001776a0bbd39da2a60b6054e902b9b [0,1,0,0,0,1|2,0,0]=4 984 B9R0.7 C=C(Cl)COC(C)C(C)S 3c2bf4c41c10f27d63ebf40f8b9ae8f1 [0,1,0,0,0,1|2,0,0]=4 985 B9R0.7 C=C(Cl)CO[C@@H](C)C(C)C bd0afc1c4cb474d710b4ab9ffc233b7c [0,1,0,0,0,1|2,0,0]=4 986 B9R0.7 C=C(Cl)CO[C@H](C)C(C)C 12c49c051e4c1c4da437605211965da9 [0,1,0,0,0,1|2,0,0]=4 987 B9R0.7 C=C(F)CNC(C)C(C)C 409e63149589333ff415c746db9d9829 [0,1,0,0,0,1|2,0,0]=4 988 B9R0.7 C=C(F)CNC(C)C(C)O 94d64f229e1d3a97c376207973c75889 [0,1,0,0,0,1|2,0,0]=4 989 B9R0.7 C=C(F)CN[C@@H](C)C(C)C 28fdfa3c16dcb4620c732c51fd5cfe8b [0,1,0,0,0,1|2,0,0]=4 990 B9R0.7 C=C(F)CN[C@H](C)C(C)C a87dfe7521615c1f0093b484bb0287df [0,1,0,0,0,1|2,0,0]=4 991 B9R0.7 C=C(F)COC(C)C(C)S 8d5ab25e39ce9205156573fe5b1403e7 [0,1,0,0,0,1|2,0,0]=4 992 B9R0.7 C=C(I)COC(C)C(C)C d15eda407b77341d90d811e8785e819b [0,1,0,0,0,1|2,0,0]=4 993 B9R0.7 CC(=O)C(C)NCC(=O)N 4669ff9f06ec48bd99983da9d189670a [0,1,0,0,0,1|1,0,1]=4 994 B9R0.7 CC(=O)C(C)NCC(=O)O 71016da385f2899dc86054b0d9f13d55 [0,1,0,0,0,1|0,0,1]=3 995 B9R0.7 CC(=O)C(C)OCC(=O)N e3f17b1ba0618e1108930c4adaf65c06 [0,1,0,0,0,1|1,0,1]=4 996 B9R0.7 CC(=O)C(C)OCC(=O)O 3f4f655e2a9645b79486aa39f2af2bc2 [0,1,0,0,0,1|0,0,1]=3 997 B9R0.7 CC(=O)C(C)OCS(=O)O 28df88acd0226f183cbbb5939bee131c [0,1,0,0,0,1|1,0,1]=4 998 B9R0.7 CC(=O)CCN(C)C(C)C 953e9eb410ac9c63c02a43039dc6096e [0,1,0,0,0,1|2,0,0]=4 999 B9R0.7 CC(=O)CNC(C)C(=O)C e1f8e9de84603761e1d79968f5b5a7bd [0,1,0,0,0,1|1,0,1]=4 1000 B9R0.7 CC(=O)CNC(C)C(C)C 49d344dd635df977b0c6dee157c4688f [0,1,0,0,0,1|1,0,0]=3 1001 B9R0.7 CC(=O)COC(C)C(=O)C 247ac15271039fbba907fd165b3eb5ca [0,1,0,0,0,1|1,0,1]=4 1002 B9R0.7 CC(=O)COC(C)C(C)C 26f6e721def9fa22bc31decfa670c9f4 [0,1,0,0,0,1|1,0,0]=3 1003 B9R0.7 CC(=O)NCC(C)N(C)C 985e7b721e2dd08706acb6db4f58999a [0,1,0,0,0,1|2,0,0]=4 1004 B9R0.7 CC(=O)NCC(O)C(C)C 9eb894e521c6def6d6887ec5adad728c [0,1,0,0,0,1|2,0,0]=4 1005 B9R0.7 CC(=O)OCN(C)C(C)C d1ebe6c410268e0baa452260763bf686 [0,1,0,0,0,1|2,0,0]=4 1006 B9R0.7 CC(C)C(C)NCC(=O)N 29ed07977c474be87c0f6b20e5b20a1e [0,1,0,0,0,1|1,0,0]=3 1007 B9R0.7 CC(C)C(C)NCC(=O)O 91d49b00bc2f98925645db40aaffec23 [0,1,0,0,0,1|0,0,0]=2 1008 B9R0.7 CC(C)C(C)NC[C@@H](C)O 7b1c4e7001e44c1fdbc92acff117ed25 [0,1,0,0,0,1|1,0,1]=4 1009 B9R0.7 CC(C)C(C)NC[C@H](C)O 1feb99aa9834cff3da645bd8bf526b26 [0,1,0,0,0,1|1,0,1]=4 1010 B9R0.7 CC(C)C(C)NC[N+](=O)[O-] cdf8bcf7f54f64a4fd4d73fe819b3ea8 [0,1,0,0,0,1|1,0,1]=4 1011 B9R0.7 CC(C)C(C)OCC(=O)N 19f85b2c4636dac9a2e7b5a079f3133e [0,1,0,0,0,1|1,0,0]=3 1012 B9R0.7 CC(C)C(C)OCC(=O)O 5453f2b0fdd958a9ddf47053a2bbc46a [0,1,0,0,0,1|0,0,0]=2 1013 B9R0.7 CC(C)C(C)OCC(=S)N 185d7e5ca7d5cdfa1c150c45e532a9ac [0,1,0,0,0,1|1,1,0]=4 1014 B9R0.7 CC(C)C(C)OCS(=O)O 7646e27cd56e6ff28d9b085da3996564 [0,1,0,0,0,1|1,0,0]=3 1015 B9R0.7 CC(C)C(C)OC[N+](=O)[O-] 6c5e849e047043eff080b9dc07165c65 [0,1,0,0,0,1|1,0,1]=4 1016 B9R0.7 CC(C)N(C)CCC(=O)N 8256a8ae89777524df51537a764a076a [0,1,0,0,0,1|2,0,0]=4 1017 B9R0.7 CC(C)N(C)CCC(=O)O 9a4c4fa3008269d113851da06265fa69 [0,1,0,0,0,1|1,0,0]=3 1018 B9R0.7 CC(C)[C@@H](C)NCC(=O)N 9220e196f63e8a0e26317093c632072b [0,1,0,0,0,1|1,0,0]=3 1019 B9R0.7 CC(C)[C@@H](C)NCC(=O)O b819017e8dd0621ca989217241b6bdfb [0,1,0,0,0,1|0,0,0]=2 1020 B9R0.7 CC(C)[C@@H](C)NC[C@@H](C)O 7582842dfc997c252aba4f67aac34b2c [0,1,0,0,0,1|1,0,1]=4 1021 B9R0.7 CC(C)[C@@H](C)NC[C@H](C)O 25ff93f2d4e60956ef71f3fddb8d9db1 [0,1,0,0,0,1|1,0,1]=4 1022 B9R0.7 CC(C)[C@@H](C)NC[N+](=O)[O-] 6d14b89c316fd7d9a66426467f550408 [0,1,0,0,0,1|1,0,1]=4 1023 B9R0.7 CC(C)[C@@H](C)OCC(=O)N fe13bff61341db544e36d636b1021567 [0,1,0,0,0,1|1,0,0]=3 1024 B9R0.7 CC(C)[C@@H](C)OCC(=O)O 2c14ad2eaa4565aa59675b4818dba2b0 [0,1,0,0,0,1|0,0,0]=2 1025 B9R0.7 CC(C)[C@@H](C)OC[N+](=O)[O-] e72713ade7d779f262c7c6a470e65ecb [0,1,0,0,0,1|1,0,1]=4 1026 B9R0.7 CC(C)[C@H](C)NCC(=O)N 0470ce1c169866c2b6bb7b0f1c4fa837 [0,1,0,0,0,1|1,0,0]=3 1027 B9R0.7 CC(C)[C@H](C)NCC(=O)O 8157acac1e55fcb782ad50d024aa8bbc [0,1,0,0,0,1|0,0,0]=2 1028 B9R0.7 CC(C)[C@H](C)NC[C@@H](C)O da0a50c8f5c6db547339a821a872d328 [0,1,0,0,0,1|1,0,1]=4 1029 B9R0.7 CC(C)[C@H](C)NC[C@H](C)O dc73a40b357784d2098656474e845ebf [0,1,0,0,0,1|1,0,1]=4 1030 B9R0.7 CC(C)[C@H](C)NC[N+](=O)[O-] 7e825c0a9d2f19530dd69fde02ba55fd [0,1,0,0,0,1|1,0,1]=4 1031 B9R0.7 CC(C)[C@H](C)OCC(=O)N 8404fea7b9dd14a61bd0a4841aa3bb72 [0,1,0,0,0,1|1,0,0]=3 1032 B9R0.7 CC(C)[C@H](C)OCC(=O)O f61a165279ed49217ae1638fda607d49 [0,1,0,0,0,1|0,0,0]=2 1033 B9R0.7 CC(C)[C@H](C)OC[N+](=O)[O-] ecd17d011cf48bd35ed5bfe6a9835881 [0,1,0,0,0,1|1,0,1]=4 1034 B9R0.7 CC(NCC(=O)O)C(=O)N 89c37092ee2f8b0e63268d273d0228ff [0,1,0,0,0,1|1,0,1]=4 1035 B9R0.7 CC(NCC(=O)O)C(=O)O 987b2499311f8742f9deea3b5e39f6e6 [0,1,0,0,0,1|1,0,1]=4 1036 B9R0.7 CC(O)C(C)NCC(=O)N 7496509e19670bdc224e84ca74f1c1f7 [0,1,0,0,0,1|1,0,0]=3 1037 B9R0.7 CC(O)C(C)NCC(=O)O 6fd6b2ea1088c99dba5e071db522af6e [0,1,0,0,0,1|0,0,0]=2 1038 B9R0.7 CC(O)C(C)NC[C@@H](C)O 5e3ffccd0cf90accbb8c5bce07f107d0 [0,1,0,0,0,1|1,0,1]=4 1039 B9R0.7 CC(O)C(C)NC[C@H](C)O 8d3aad84c7ccc9fd8b70b2a3d527386c [0,1,0,0,0,1|1,0,1]=4 1040 B9R0.7 CC(O)C(C)NC[N+](=O)[O-] 29b2e0b24c1f3b884812647374843fab [0,1,0,0,0,1|1,0,1]=4 1041 B9R0.7 CC(O)CNC(C)C(C)C 052c86a6c658fafeb40cef5f437f9f42 [0,1,0,0,0,1|1,0,1]=4 1042 B9R0.7 CC(O)CNC(C)C(C)O d86e4eafca14f548d85dde151156931e [0,1,0,0,0,1|1,0,1]=4 1043 B9R0.7 CC(O)CN[C@@H](C)C(C)C 2891d895b63d59840e8bb02acbf32cf3 [0,1,0,0,0,1|1,0,1]=4 1044 B9R0.7 CC(O)CN[C@H](C)C(C)C 9614b7c81ab1b21fed447be2bbb5ddb1 [0,1,0,0,0,1|1,0,1]=4 1045 B9R0.7 CC(OCC(=O)N)C(F)F 3d1b53ec671aa3c00bebdba0f2104666 [0,1,0,0,0,1|2,0,0]=4 1046 B9R0.7 CC(OCC(=O)O)C(=O)N db28e9b2c87c1d0947641fc2652da557 [0,1,0,0,0,1|1,0,1]=4 1047 B9R0.7 CC(OCC(=O)O)C(=O)O 703dd626490aec635a09876bfd310d6e [0,1,0,0,0,1|1,0,1]=4 1048 B9R0.7 CC(OCC(=O)O)C(F)F aa7277d54702b7135f99188aff0085ff [0,1,0,0,0,1|1,0,0]=3 1049 B9R0.7 CC(S)C(C)OCC(=O)N e54b95b00c0da3ace09de2f308d0efaa [0,1,0,0,0,1|1,0,0]=3 1050 B9R0.7 CC(S)C(C)OCC(=O)O 1c77a3f15c2b77600079151ecb5a4c83 [0,1,0,0,0,1|0,0,0]=2 1051 B9R0.7 CC(S)C(C)OC[N+](=O)[O-] 48ccfa8340741c54b8b7ddc91a2010ad [0,1,0,0,0,1|1,0,1]=4 1052 B9R0.7 C[C@@H](NCC(=O)N)C(F)F 377e6c5fbbd9427e0b727dafcee4d79a [0,1,0,0,0,1|2,0,0]=4 1053 B9R0.7 C[C@@H](NCC(=O)O)C(=O)N bfe024e754ce1f221307332ca4690333 [0,1,0,0,0,1|1,0,1]=4 1054 B9R0.7 C[C@@H](NCC(=O)O)C(=O)O 415a0334860aefb2a3620bf8fdc363b7 [0,1,0,0,0,1|1,0,1]=4 1055 B9R0.7 C[C@@H](NCC(=O)O)C(F)F d6c0d1283b99f71a9cedcfe517756b54 [0,1,0,0,0,1|1,0,0]=3 1056 B9R0.7 C[C@@H](OCC(=O)O)C(=O)N 0df6cadb7afb5df43c33d22fe1ce57b8 [0,1,0,0,0,1|1,0,1]=4 1057 B9R0.7 C[C@@H](OCC(=O)O)C(=O)O 4a8d16a0c243ab4716ea82e35fa33547 [0,1,0,0,0,1|1,0,1]=4 1058 B9R0.7 C[C@H](NCC(=O)N)C(F)F ef8aa0a0b28db993a15023eb4e139f41 [0,1,0,0,0,1|2,0,0]=4 1059 B9R0.7 C[C@H](NCC(=O)O)C(=O)N a9a64082f6699f672e6c1e7ab7305b25 [0,1,0,0,0,1|1,0,1]=4 1060 B9R0.7 C[C@H](NCC(=O)O)C(=O)O f9625cec5eb0d5af5124541dcd344e57 [0,1,0,0,0,1|1,0,1]=4 1061 B9R0.7 C[C@H](NCC(=O)O)C(F)F ee792477aa9ffbfb10c972e3ed44479d [0,1,0,0,0,1|1,0,0]=3 1062 B9R0.7 C[C@H](OCC(=O)O)C(=O)N 9f3566138f221d3fa100bde817697c75 [0,1,0,0,0,1|1,0,1]=4 1063 B9R0.7 C[C@H](OCC(=O)O)C(=O)O fee1967c0e07a40963d81dc0d0074185 [0,1,0,0,0,1|1,0,1]=4 1064 B9R0.21 CC(CO)NCS(=O)(=O)O 8197939b72a4c097cdc9ed2f7d69344a [0,1,0,0,0,1|2,0,0]=4 1065 B9R0.21 CCC(C)NCC(C)(C)O aba34fafe35994e0d517ee431ffd9a9f [0,1,0,0,0,1|1,0,1]=4 1066 B9R0.21 CCC(C)NCS(=O)(=O)C 3fd81c3b014bf943eece125bf138298d [0,1,0,0,0,1|1,0,1]=4 1067 B9R0.21 CCC(C)NCS(=O)(=O)O 3843f5387ccbb99cb2ec3de58423578c [0,1,0,0,0,1|1,0,0]=3 1068 B9R0.21 CCC(C)OCC(C)(C)O a9ea2b1e14c4931bb196c9059da7380e [0,1,0,0,0,1|1,0,1]=4 1069 B9R0.21 CCC(C)OCS(=O)(=O)C 279f4b6425793c09d9dce61008ffb77a [0,1,0,0,0,1|1,0,1]=4 1070 B9R0.21 CCN(C)CCS(=O)(=O)O b45c23bee2273f4ed0f973d66db875e9 [0,1,0,0,0,1|2,0,0]=4 1071 B9R0.21 CC[C@@H](C)NCC(C)(C)O 966229d52d67d58a4739436737b6261a [0,1,0,0,0,1|1,0,1]=4 1072 B9R0.21 CC[C@@H](C)NCS(=O)(=O)C c8a5577f64165b07a2e9d0b98572c607 [0,1,0,0,0,1|1,0,1]=4 1073 B9R0.21 CC[C@@H](C)NCS(=O)(=O)O 3381b6ca29c85622de98a7a50aed3ceb [0,1,0,0,0,1|1,0,0]=3 1074 B9R0.21 CC[C@@H](C)OCC(C)(C)O ca51c114d8dbc7005ea491e687a9c300 [0,1,0,0,0,1|1,0,1]=4 1075 B9R0.21 CC[C@@H](C)OCS(=O)(=O)C bc93b1d490f52a548565ea8bbb6afdc6 [0,1,0,0,0,1|1,0,1]=4 1076 B9R0.21 CC[C@H](C)NCC(C)(C)O 25791454de8f27753e9f9b905d3678ca [0,1,0,0,0,1|1,0,1]=4 1077 B9R0.21 CC[C@H](C)NCS(=O)(=O)C 2687bf29b85238188829c8b70c8131ce [0,1,0,0,0,1|1,0,1]=4 1078 B9R0.21 CC[C@H](C)NCS(=O)(=O)O c7549dfb5a5ac8f636d10dd80863d40f [0,1,0,0,0,1|1,0,0]=3 1079 B9R0.21 CC[C@H](C)OCC(C)(C)O 68592e8d00916883495ce7132be519d1 [0,1,0,0,0,1|1,0,1]=4 1080 B9R0.21 CC[C@H](C)OCS(=O)(=O)C e41381f2869dea8fa1d5f8aa917e4b67 [0,1,0,0,0,1|1,0,1]=4 1081 B9R0.21 C[C@@H](CO)NCS(=O)(=O)O 6f31beee6c48b84e60491bce62a19acd [0,1,0,0,0,1|2,0,0]=4 1082 B9R0.21 C[C@H](CO)NCS(=O)(=O)O a61c6a232bb2db9ef80a47b8eecd9406 [0,1,0,0,0,1|2,0,0]=4 1083 B9R0.23 C#CC(C)N(C)CC(=O)O 4442316597ae57199614f7bda7b15e0b [0,1,0,0,0,1|0,0,2]=4 1084 B9R0.23 C=C(Br)CN(C)C(C)CC f205f817066203a92f501ead3a887119 [0,1,0,0,0,1|2,0,0]=4 1085 B9R0.23 C=C(C)CN(C)C(C)CC becd68437d1c97a8d1e22a45ea9cb3ed [0,1,0,0,0,1|2,0,0]=4 1086 B9R0.23 C=C(Cl)CN(C)C(C)CC 91beb97a0fb2d317c70b8377075178d9 [0,1,0,0,0,1|2,0,0]=4 1087 B9R0.23 C=CC(C)N(C)CC(=O)O b2867095761bc509a710df8f75377588 [0,1,0,0,0,1|0,0,2]=4 1088 B9R0.23 CC(C=O)N(C)CC(=O)O 42e8595385f1708c885bb9847ad49685 [0,1,0,0,0,1|1,0,1]=4 1089 B9R0.23 CC(CC(=O)O)N(C)CF 86c04df1cbc3118a36f6456c0382068b [0,1,0,0,0,1|2,0,0]=4 1090 B9R0.23 CC(CC(=O)O)N(C)CO c6b41a1684495ec12e16617ae033a720 [0,1,0,0,0,1|2,0,0]=4 1091 B9R0.23 CC(CO)N(C)CC(=O)N cad093e999c5e5d0adecbc6ab26512a2 [0,1,0,0,0,1|2,0,0]=4 1092 B9R0.23 CC(CO)N(C)CC(=O)O 9e070eef5f318fe46c235cf3ef744af9 [0,1,0,0,0,1|1,0,0]=3 1093 B9R0.23 CCC(C)C(C)NC(=O)C c6415ea83b7186fa422502fb21dba14b [0,1,0,0,0,1|1,0,0]=3 1094 B9R0.23 CCC(C)N(C)CC(=O)N bde7733eb8ed4c41132bbdb1311c2abf [0,1,0,0,0,1|1,0,0]=3 1095 B9R0.23 CCC(C)N(C)CC(=O)O 75aef3e777568a148fc6457fb567c3e8 [0,1,0,0,0,1|0,0,0]=2 1096 B9R0.23 CCC(C)N(C)CC(C)O 39bbccfe89eea75c045cf35a8d1b4a07 [0,1,0,0,0,1|1,0,1]=4 1097 B9R0.23 CCC(C)N(C)C[C@@H](C)O 2a896790f114fe4f0c2b532c8c53b2cd [0,1,0,0,0,1|1,0,1]=4 1098 B9R0.23 CCC(C)N(C)C[C@H](C)O a522587a5935880285eca772f3589463 [0,1,0,0,0,1|1,0,1]=4 1099 B9R0.23 CCC(C)N(C)C[N+](=O)[O-] 07e928b8964de6ebefb17dddeccff2ae [0,1,0,0,0,1|1,0,1]=4 1100 B9R0.23 CCN(C)C(=O)CC(=O)C 1217fc72a4748fed1e5a83a097d2f82e [0,1,0,0,0,1|2,0,0]=4 1101 B9R0.23 CCN(C)C(=O)CC(=O)N 2b084e59d4717c091a1b437eb00a63a0 [0,1,0,0,0,1|2,0,0]=4 1102 B9R0.23 CCN(C)C(C)CC(=O)O abeb707970b255b95a0917af44198a47 [0,1,0,0,0,1|1,0,0]=3 1103 B9R0.23 C[C@@H](CO)N(C)CC(=O)N 5859eb44ebf30326f1e0d628a2993f50 [0,1,0,0,0,1|2,0,0]=4 1104 B9R0.23 C[C@@H](CO)N(C)CC(=O)O 28f9fcefb5baf6112312a5544f0c6757 [0,1,0,0,0,1|1,0,0]=3 1105 B9R0.23 C[C@H](C=O)N(C)CC(=O)O 627b1938d4a1b55a260a248683085e0c [0,1,0,0,0,1|1,0,1]=4 1106 B9R0.23 C[C@H](CO)N(C)CC(=O)N 6083822193ed0926f03a3278c8bdcd9a [0,1,0,0,0,1|2,0,0]=4 1107 B9R0.23 C[C@H](CO)N(C)CC(=O)O 506d89a3b4907e205d467d9fb789b7c5 [0,1,0,0,0,1|1,0,0]=3 1108 B9R0.24 C#CC(=O)NCC(C)CC eeb3f1593ef5697a697231e5655cf5e5 [0,1,0,0,0,1|1,0,0]=3 1109 B9R0.24 C#CC(=O)NCC(C)CO 41186f257f77adb0ef21254c99a5b697 [0,1,0,0,0,1|2,0,0]=4 1110 B9R0.24 C#CC(=O)NCC(O)CC a3064877d1f0e8465536a217f9016db8 [0,1,0,0,0,1|2,0,0]=4 1111 B9R0.24 C#CC(=O)NC[C@@H](C)CC 14264a207a356ac8bd8821577b0c36dd [0,1,0,0,0,1|1,0,0]=3 1112 B9R0.24 C#CC(=O)NC[C@@H](C)OC d425d04ea2b62cf45089aeb199bdb12a [0,1,0,0,0,1|2,0,0]=4 1113 B9R0.24 C#CC(=O)NC[C@H](C)CO 5512bb0ef33369afac10cb2ad91457de [0,1,0,0,0,1|2,0,0]=4 1114 B9R0.24 C#CC(=O)NC[C@H](C)OC 7a36a34873929e52221838bbe1b091b3 [0,1,0,0,0,1|2,0,0]=4 1115 B9R0.24 C#CC(=O)NC[C@H](O)CC 8b9853006def702ab3e26b6acdbcafac [0,1,0,0,0,1|2,0,0]=4 1116 B9R0.24 C#CC(C)NCC(=O)CO aca125c36f3fff20abf5c36bfd95551a [0,1,0,0,0,1|0,0,2]=4 1117 B9R0.24 C#CC(C)NCC(=O)NO 708e03eaa020b26f76acfb773352d776 [0,1,0,0,0,1|0,0,2]=4 1118 B9R0.24 C#CC(C)NCC(=O)OC d3111511e0f3b63da9cf8fbb6803bdcd [0,1,0,0,0,1|0,0,2]=4 1119 B9R0.24 C#CC(C)OCC(=O)OC 3834f9929bdb310a6b6f26aa3aff2944 [0,1,0,0,0,1|0,0,2]=4 1120 B9R0.24 C#C[C@@H](C)NCC(=O)CO 3807184f49a7845a3c47fec86cea39e0 [0,1,0,0,0,1|0,0,2]=4 1121 B9R0.24 C#C[C@@H](C)NCC(=O)OC f70b2489bdb7e036e2d5461d0aad8357 [0,1,0,0,0,1|0,0,2]=4 1122 B9R0.24 C#C[C@@H](C)OCC(=O)OC 4a93ad57e77e78a44764b6d964c53854 [0,1,0,0,0,1|0,0,2]=4 1123 B9R0.24 C#C[C@H](C)NCC(=O)CO 639e513a5c1c7c58d07732e858f7cb7a [0,1,0,0,0,1|0,0,2]=4 1124 B9R0.24 C#C[C@H](C)NCC(=O)OC 7e17f72d06f7ebbab6d4051854da7b9a [0,1,0,0,0,1|0,0,2]=4 1125 B9R0.24 C#C[C@H](C)OCC(=O)OC d95b66e1f6f317e6a47b949ce99cc02f [0,1,0,0,0,1|0,0,2]=4 1126 B9R0.24 C=C(C#N)CNC(C)CC 2d1594a56821c2da9df0685f6ca0ef3b [0,1,0,0,0,1|2,0,0]=4 1127 B9R0.24 C=C(C#N)CN[C@@H](C)CC 9ad5d7e992a9142373b3597c109da34f [0,1,0,0,0,1|2,0,0]=4 1128 B9R0.24 C=C(C#N)CN[C@H](C)CC dddffcf492716b451535dfa4bac0b1d2 [0,1,0,0,0,1|2,0,0]=4 1129 B9R0.24 C=C(C#N)COC(C)CC 1767733778aee8b30bc9e8ac7081f19e [0,1,0,0,0,1|2,0,0]=4 1130 B9R0.24 C=C(C#N)CO[C@@H](C)CC ccd7c306290cf5915b7ec07d52617bc9 [0,1,0,0,0,1|2,0,0]=4 1131 B9R0.24 C=C(C#N)CO[C@H](C)CC 5c54d8ade2c4df28f8fc8ae7f2b996d7 [0,1,0,0,0,1|2,0,0]=4 1132 B9R0.24 C=C(C=O)OCC(C)CC 94076fbb637be2099fefe5bb74ab7631 [0,1,0,0,0,1|1,0,0]=3 1133 B9R0.24 C=C(C=O)OCC(C)OC c907ae157f3e80043ae2be4b92fbffb5 [0,1,0,0,0,1|2,0,0]=4 1134 B9R0.24 C=C(C=O)OC[C@@H](C)CC c92820c9001e5f184f75d6985b3ac715 [0,1,0,0,0,1|1,0,0]=3 1135 B9R0.24 C=C(C=O)OC[C@@H](C)OC 4333ac0cad3af60fced030b92ff246c3 [0,1,0,0,0,1|2,0,0]=4 1136 B9R0.24 C=C(C=O)OC[C@H](C)CC acdcdc2ceb58caf2909e400b4e88cdbc [0,1,0,0,0,1|1,0,0]=3 1137 B9R0.24 C=C(C=O)OC[C@H](C)OC d9d15fb34c9eec8b6453049bca84bcd4 [0,1,0,0,0,1|2,0,0]=4 1138 B9R0.24 C=C(CC)CNC(C)CC a13c5b93760ac15cea8f8b85ea84061f [0,1,0,0,0,1|2,0,0]=4 1139 B9R0.24 C=C(CC)CN[C@@H](C)CC d8dfcde2e49178ef14a7926aa1242c6a [0,1,0,0,0,1|2,0,0]=4 1140 B9R0.24 C=C(CC)CN[C@H](C)CC da39420bf731bffc50f8dbdc737d52e3 [0,1,0,0,0,1|2,0,0]=4 1141 B9R0.24 C=C(CC)COC(C)CC c924422973408063b333741d53956feb [0,1,0,0,0,1|2,0,0]=4 1142 B9R0.24 C=C(CC)CO[C@@H](C)CC 5ebe813242e8c3d384ebdcae6d991e44 [0,1,0,0,0,1|2,0,0]=4 1143 B9R0.24 C=C(CC)CO[C@H](C)CC 46ba7758c94cfcc1174599b5da72113f [0,1,0,0,0,1|2,0,0]=4 1144 B9R0.24 C=C(CNC(C)CC)OC 199745e170d7136057adf692fc38bc38 [0,1,0,0,0,1|1,0,0]=3 1145 B9R0.24 C=C(CNC(C)CO)OC 7ed9c274e3583d47745d164a348d8b36 [0,1,0,0,0,1|2,0,0]=4 1146 B9R0.24 C=C(CN[C@@H](C)CC)OC 10f721623084d5e042fa686b6aba21f6 [0,1,0,0,0,1|1,0,0]=3 1147 B9R0.24 C=C(CN[C@@H](C)CO)OC 24349e6113f8cfabca61d315d9c14d02 [0,1,0,0,0,1|2,0,0]=4 1148 B9R0.24 C=C(CN[C@H](C)CC)OC 36d91e5ccdad465db0f3ec237f974baa [0,1,0,0,0,1|1,0,0]=3 1149 B9R0.24 C=C(CN[C@H](C)CO)OC b477e2c15eeb7635d940752d0dc57230 [0,1,0,0,0,1|2,0,0]=4 1150 B9R0.24 C=C(CO)CNC(C)CC f7e489a1daa82458cbf8b386d347af1d [0,1,0,0,0,1|1,0,0]=3 1151 B9R0.24 C=C(CO)CNC(C)CO 046a039ed1fc1e1a39de86175d69a591 [0,1,0,0,0,1|2,0,0]=4 1152 B9R0.24 C=C(CO)CN[C@@H](C)CC 5f8000ccd35054ea6c50e9f85089bdf1 [0,1,0,0,0,1|1,0,0]=3 1153 B9R0.24 C=C(CO)CN[C@@H](C)CO 909fd3b07559504a433e09717b163145 [0,1,0,0,0,1|2,0,0]=4 1154 B9R0.24 C=C(CO)CN[C@H](C)CC ea9e5c40fd15740e3eb8eadf2343cb70 [0,1,0,0,0,1|1,0,0]=3 1155 B9R0.24 C=C(CO)CN[C@H](C)CO f11cf0f2c44dae261e8250c0d3db312b [0,1,0,0,0,1|2,0,0]=4 1156 B9R0.24 C=C(COC(C)CC)OC 58b6feaf19e6f1997c779268ea3fd7b1 [0,1,0,0,0,1|1,0,0]=3 1157 B9R0.24 C=C(COC(C)CF)OC 51cf833942233803eb30e15a731946de [0,1,0,0,0,1|2,0,0]=4 1158 B9R0.24 C=C(COC(C)CS)OC e4e96e57af5d4721f79d62882779f76c [0,1,0,0,0,1|2,0,0]=4 1159 B9R0.24 C=C(CO[C@@H](C)CC)OC 5dbf68339d968dae26f268e1b4530471 [0,1,0,0,0,1|1,0,0]=3 1160 B9R0.24 C=C(CO[C@H](C)CC)OC 465be8e09831cc0a52bf3701e0ba6f9b [0,1,0,0,0,1|1,0,0]=3 1161 B9R0.24 C=C(CO[C@H](C)CS)OC bd06d82387b13dd5a693155f15bae87c [0,1,0,0,0,1|2,0,0]=4 1162 B9R0.24 C=CC(=O)NCC(C)CC 741b92221edb49a5786b80da6b26f931 [0,1,0,0,0,1|1,0,0]=3 1163 B9R0.24 C=CC(=O)NCC(C)CO 92291dabf089671184f5d0347002f503 [0,1,0,0,0,1|2,0,0]=4 1164 B9R0.24 C=CC(=O)NCC(O)CC b7e1f3cdc2c992d954fae7c24caef83b [0,1,0,0,0,1|2,0,0]=4 1165 B9R0.24 C=CC(=O)NC[C@@H](C)CC ed2dd0e0ee88d18345665ce5dc441f7e [0,1,0,0,0,1|1,0,0]=3 1166 B9R0.24 C=CC(=O)NC[C@@H](C)OC 106d6f31390313679231ccf71a569b46 [0,1,0,0,0,1|2,0,0]=4 1167 B9R0.24 C=CC(=O)NC[C@H](C)CO bec5f469822c7d3b1dc4aaea22892c54 [0,1,0,0,0,1|2,0,0]=4 1168 B9R0.24 C=CC(=O)NC[C@H](C)OC 44f98b08e5d7298179d7a6cd0189a816 [0,1,0,0,0,1|2,0,0]=4 1169 B9R0.24 C=CC(=O)NC[C@H](O)CC 1eef8d96e2aed42a7bc2a42dc790e786 [0,1,0,0,0,1|2,0,0]=4 1170 B9R0.24 C=CC(C)NCC(=O)CO b252e851a4d424d1074ec962a0cf8724 [0,1,0,0,0,1|0,0,2]=4 1171 B9R0.24 C=CC(C)NCC(=O)NO f493b9d5e4bf3716ea5090c9e619d164 [0,1,0,0,0,1|0,0,2]=4 1172 B9R0.24 C=CC(C)NCC(=O)OC 458ca9e0f72429bc5b6a0666dc9887f6 [0,1,0,0,0,1|0,0,2]=4 1173 B9R0.24 C=CC(C)OCC(=O)OC 49db1015aa1b9433cdff0d43f3b5ac9a [0,1,0,0,0,1|0,0,2]=4 1174 B9R0.24 C=CC(O)CNC(C)CC ea5dbe4f19a0c85d30995687d6fda584 [0,1,0,0,0,1|1,0,1]=4 1175 B9R0.24 C=C[C@H](C)OCC(=O)OC 3e0cc0a3880efc0cf26e8bb77e313458 [0,1,0,0,0,1|0,0,2]=4 1176 B9R0.24 CC(C#N)CNC(=O)CO 723ac511dbce34bf48e4aa88a76f4ffb [0,1,0,0,0,1|1,0,1]=4 1177 B9R0.24 CC(C#N)NCC(=O)CO 853106096bbd483be5c66e6267057089 [0,1,0,0,0,1|1,0,1]=4 1178 B9R0.24 CC(C#N)NCC(=O)NO 8f4202fc5931c8f8d1ac5d6e244719ba [0,1,0,0,0,1|1,0,1]=4 1179 B9R0.24 CC(C=O)NCC(=O)NO bc51939da60c90ef1be22a27ae9a7c85 [0,1,0,0,0,1|1,0,1]=4 1180 B9R0.24 CC(CO)CNC(=O)C=O 0c184885911fbc71450e3ddd6b5f3577 [0,1,0,0,0,1|1,0,1]=4 1181 B9R0.24 CC(CO)CNC(=O)CF dfa95f0e838d6050ac5f9dd06f8dcae3 [0,1,0,0,0,1|2,0,0]=4 1182 B9R0.24 CC(CO)CNC(=O)CO c433cb913c3f4a048671fb23e261810a [0,1,0,0,0,1|1,0,0]=3 1183 B9R0.24 CC(CO)CNC(=O)CS 9cad581698394879ce09e326a14b10e9 [0,1,0,0,0,1|1,1,0]=4 1184 B9R0.24 CC(CO)NCC(=O)CO c585403df2dd549fbed6db13dd1f46fc [0,1,0,0,0,1|1,0,0]=3 1185 B9R0.24 CC(CO)NCC(=O)NO 4aeda96bb4fd1908b9129c8e3077b0d9 [0,1,0,0,0,1|1,0,0]=3 1186 B9R0.24 CCC(=O)CNC(C)CC 8a7f34411ea9ff22baecd2bec9987e81 [0,1,0,0,0,1|1,0,0]=3 1187 B9R0.24 CCC(=O)CNC(C)CO 5e60ba7c010ccf2781cfa187e60d9931 [0,1,0,0,0,1|2,0,0]=4 1188 B9R0.24 CCC(=O)CN[C@@H](C)CC cf0e7ed200bceabd78136172de6ecd6c [0,1,0,0,0,1|1,0,0]=3 1189 B9R0.24 CCC(=O)CN[C@@H](C)CO 74e011e2f77654864ab9844d772548df [0,1,0,0,0,1|2,0,0]=4 1190 B9R0.24 CCC(=O)CN[C@H](C)CC e6fe0f86a523db447d188f70083e09d0 [0,1,0,0,0,1|1,0,0]=3 1191 B9R0.24 CCC(=O)CN[C@H](C)CO f786f4989a36138fb02fa088b8f656d9 [0,1,0,0,0,1|2,0,0]=4 1192 B9R0.24 CCC(=O)COC(C)CC 29d5bfcc3cb37f7ca0dad75c651a7aa4 [0,1,0,0,0,1|1,0,0]=3 1193 B9R0.24 CCC(=O)COC(C)CF 81a45643a713673f9a8cee2ff98f6a75 [0,1,0,0,0,1|2,0,0]=4 1194 B9R0.24 CCC(=O)COC(C)CS 984e285ab5f4a0ad9d6d8a292df0e276 [0,1,0,0,0,1|2,0,0]=4 1195 B9R0.24 CCC(=O)CO[C@@H](C)CC 83299bde6aa7b405212942272cb01c0d [0,1,0,0,0,1|1,0,0]=3 1196 B9R0.24 CCC(=O)CO[C@H](C)CC 22a053d890b84a836a154b9ddc55610a [0,1,0,0,0,1|1,0,0]=3 1197 B9R0.24 CCC(=O)CO[C@H](C)CS e24ec6525f0cb1fa141815260a562dff [0,1,0,0,0,1|2,0,0]=4 1198 B9R0.24 CCC(=O)NCC(=O)NO 07ad78ca4776594e09bc2b7c3a7c2f28 [0,1,0,0,0,1|1,0,1]=4 1199 B9R0.24 CCC(=O)NCC(=O)OC 5f6ec2d5f91cea317b39ea7a589feebf [0,1,0,0,0,1|1,0,1]=4 1200 B9R0.24 CCC(=O)NCC(C)CC 7a5f4f534369b61d9e8fb6bbf4fc8b31 [0,1,0,0,0,1|1,0,0]=3 1201 B9R0.24 CCC(=O)NCC(C)CO fa40852dedb4d165bd8eab47072e49aa [0,1,0,0,0,1|2,0,0]=4 1202 B9R0.24 CCC(=O)NCC(O)CC 0c6f585c4a613c01d94eec57c41006a2 [0,1,0,0,0,1|2,0,0]=4 1203 B9R0.24 CCC(=O)NC[C@@H](C)CC 20f140a9a510d7ecd72cce257acfa2d6 [0,1,0,0,0,1|1,0,0]=3 1204 B9R0.24 CCC(=O)NC[C@@H](C)OC 2b4d3bc307acd070b3e7f7cf9dd3ff4c [0,1,0,0,0,1|2,0,0]=4 1205 B9R0.24 CCC(=O)NC[C@H](C)CO 2514ca8a6ee761d51abaccbd3a6de585 [0,1,0,0,0,1|2,0,0]=4 1206 B9R0.24 CCC(=O)NC[C@H](C)OC e43467fd548414270671303609820f3d [0,1,0,0,0,1|2,0,0]=4 1207 B9R0.24 CCC(=O)NC[C@H](O)CC d28190137f6e71fee6c5823aba62fd52 [0,1,0,0,0,1|2,0,0]=4 1208 B9R0.24 CCC(=O)OCN(C)CC a281a4ec29756b3b4107ca2ca9de7f75 [0,1,0,0,0,1|2,0,0]=4 1209 B9R0.24 CCC(C)CNC(=O)C=O 91d514cf28991274b1ca6d31974e5e31 [0,1,0,0,0,1|0,0,1]=3 1210 B9R0.24 CCC(C)CNC(=O)CF 62d42cdf2cc7f038e9e989a2ab9bdb8f [0,1,0,0,0,1|1,0,0]=3 1211 B9R0.24 CCC(C)CNC(=O)CO c83ed1127f884f4213e48db54a8973b6 [0,1,0,0,0,1|0,0,0]=2 1212 B9R0.24 CCC(C)CNC(=O)CS 583bdfa66e6c39cd626f1854cfe0c0b0 [0,1,0,0,0,1|0,1,0]=3 1213 B9R0.24 CCC(C)CNC(C)C=O 62ad6e2a378b2a7ff0c7a3bfb72f8013 [0,1,0,0,0,1|1,0,1]=4 1214 B9R0.24 CCC(C)CNC(C)CO 60811aae074066dc27950d91e3b980a2 [0,1,0,0,0,1|1,0,1]=4 1215 B9R0.24 CCC(C)CN[C@@H](C)CO a3afb1b145d5d0de841398acac18819b [0,1,0,0,0,1|1,0,1]=4 1216 B9R0.24 CCC(C)CN[C@H](C)C=O 5c0bf9deb92ef3f8c88fc7010ce07878 [0,1,0,0,0,1|1,0,1]=4 1217 B9R0.24 CCC(C)CN[C@H](C)CO b14c967e3cf32c367184141dcf00f9fb [0,1,0,0,0,1|1,0,1]=4 1218 B9R0.24 CCC(C)COC(C)C=O 5c5a73b9937517abbe965da0b0e38e6c [0,1,0,0,0,1|1,0,1]=4 1219 B9R0.24 CCC(C)CO[C@H](C)C=O b107a332f74d8f7084cf421a3bcce3bb [0,1,0,0,0,1|1,0,1]=4 1220 B9R0.24 CCC(C)NC/C(=C/Cl)/Cl 5e9fd99047a801e2ad2fa551e80b513b [0,1,0,0,0,1|2,0,0]=4 1221 B9R0.24 CCC(C)NCC(=O)CO 747086db77c014fda376410a8a49b40e [0,1,0,0,0,1|0,0,0]=2 1222 B9R0.24 CCC(C)NCC(=O)NC 2611a3dfb5b7c258664f7cb330ea6fec [0,1,0,0,0,1|1,0,0]=3 1223 B9R0.24 CCC(C)NCC(=O)NO 381df0511f7cfb53c95756cb7b77418d [0,1,0,0,0,1|0,0,0]=2 1224 B9R0.24 CCC(C)NCC(=O)OC 59c2530d5471f061d4aa62b34152d7d0 [0,1,0,0,0,1|0,0,0]=2 1225 B9R0.24 CCC(C)NCC(C)CO 959364fbfd5418be4097b0ea80084b81 [0,1,0,0,0,1|1,0,1]=4 1226 B9R0.24 CCC(C)NCC(C)OC 55edc1328518eb237dcaf6438833db06 [0,1,0,0,0,1|1,0,1]=4 1227 B9R0.24 CCC(C)NCC(F)CO 003eed4bd41306fdad925ee103b64adc [0,1,0,0,0,1|1,0,1]=4 1228 B9R0.24 CCC(C)NCC(O)CF 19498ab851935d8e587d4350a57d77b0 [0,1,0,0,0,1|1,0,1]=4 1229 B9R0.24 CCC(C)NCC(O)CO 1def5b3c6f201504b5f100e78edef563 [0,1,0,0,0,1|0,0,2]=4 1230 B9R0.24 CCC(C)NC[C@@H](C)CO 2ac3e79e4c950b5cb105f3ad06257ea2 [0,1,0,0,0,1|1,0,1]=4 1231 B9R0.24 CCC(C)NC[C@@H](C)OC f2e0d4f1731446b12e8f6b77e83ed2ba [0,1,0,0,0,1|1,0,1]=4 1232 B9R0.24 CCC(C)NC[C@@H](F)CO 56e9013d83cafc2e224200ab1c52a119 [0,1,0,0,0,1|1,0,1]=4 1233 B9R0.24 CCC(C)NC[C@@H](O)CO 86898e6003e103b2d3bdfdd737dba4fc [0,1,0,0,0,1|0,0,2]=4 1234 B9R0.24 CCC(C)NC[C@H](C)CO 528ff2953b93bdd29968224fd19499d9 [0,1,0,0,0,1|1,0,1]=4 1235 B9R0.24 CCC(C)NC[C@H](C)OC 896b9ec46450d8592d4c4b91aa4f4daf [0,1,0,0,0,1|1,0,1]=4 1236 B9R0.24 CCC(C)NC[C@H](F)CO a949a5d6cfd314dd8d033b01bf7fe4d0 [0,1,0,0,0,1|1,0,1]=4 1237 B9R0.24 CCC(C)NC[C@H](O)CC e8641f1a2c1383fa85092a9b9417de65 [0,1,0,0,0,1|1,0,1]=4 1238 B9R0.24 CCC(C)NC[C@H](O)CO a19d325e334ea089cb7c8e6edd38b607 [0,1,0,0,0,1|0,0,2]=4 1239 B9R0.24 CCC(C)OC/C(=C/Cl)/Cl 86eff525b99f8f754095705eb9e5c964 [0,1,0,0,0,1|2,0,0]=4 1240 B9R0.24 CCC(C)OC/C(=C/I)/C 36fb90bae8bbbf0644461a83251b6a20 [0,1,0,0,0,1|2,0,0]=4 1241 B9R0.24 CCC(C)OCC(=CI)C ef2cd215595e9a22d0733342354f791c [0,1,0,0,0,1|2,0,0]=4 1242 B9R0.24 CCC(C)OCC(=O)NC fd2e488516bf2234fe71d5367b194c27 [0,1,0,0,0,1|1,0,0]=3 1243 B9R0.24 CCC(C)OCC(=O)OC 6aca864df4e41abf0022f5b67ba1eeb3 [0,1,0,0,0,1|0,0,0]=2 1244 B9R0.24 CCC(C)OCC(C)OC 55845eefb5c30d2fe9f4c69cf6821c58 [0,1,0,0,0,1|1,0,1]=4 1245 B9R0.24 CCC(C)OCC(O)CO 31c451bb8ae3e0525bd60fdae3c6e861 [0,1,0,0,0,1|0,0,2]=4 1246 B9R0.24 CCC(C)OC[C@@H](C)OC 43633c9129aab3ee04d569f20ecdda3d [0,1,0,0,0,1|1,0,1]=4 1247 B9R0.24 CCC(C)OC[C@@H](O)CO 85847e5e6dc8536622094eeced903a10 [0,1,0,0,0,1|0,0,2]=4 1248 B9R0.24 CCC(C)OC[C@H](C)OC ac0d5cbc19428644b7bb99dc79ea7274 [0,1,0,0,0,1|1,0,1]=4 1249 B9R0.24 CCC(C)OC[C@H](O)CO e71e155c211f81233adcdadf9441ee67 [0,1,0,0,0,1|0,0,2]=4 1250 B9R0.24 CCC(O)CNC(=O)C=O 589325bffb56b969b1f67eea67c8d0cc [0,1,0,0,0,1|1,0,1]=4 1251 B9R0.24 CCC(O)CNC(=O)CF 5703595eeaf3ecd363b7c14820e24fd8 [0,1,0,0,0,1|2,0,0]=4 1252 B9R0.24 CCC(O)CNC(=O)CO 0928fe22cca3c4eea08bea77b1ae9315 [0,1,0,0,0,1|1,0,0]=3 1253 B9R0.24 CCC(O)CNC(=O)CS a7aef8097f57ecee3e6d0de1b8bef33d [0,1,0,0,0,1|1,1,0]=4 1254 B9R0.24 CCC(O)CNC(C)CC af4c3c2f20184c76e4272776e71685b2 [0,1,0,0,0,1|1,0,1]=4 1255 B9R0.24 CCC(O)CN[C@@H](C)CC e3192934c88562fb09a91faa50134232 [0,1,0,0,0,1|1,0,1]=4 1256 B9R0.24 CCC(O)CN[C@H](C)CC 1205a7481d6c60973a837961fa633580 [0,1,0,0,0,1|1,0,1]=4 1257 B9R0.24 CCN(C)CCC(=O)NC 2662066c50046d25efb4730369bf3acc [0,1,0,0,0,1|2,0,0]=4 1258 B9R0.24 CCN(C)CCC(=O)OC d4cf3afdf7bf67f420c8138d9cf71b21 [0,1,0,0,0,1|1,0,0]=3 1259 B9R0.24 CCN(C)COC(=O)OC 7edde911e4bf2f7ddb416a1e0f67633c [0,1,0,0,0,1|1,0,0]=3 1260 B9R0.24 CC[C@@H](C)CNC(C)CO d2099792670f09bb6f099782bbe8086c [0,1,0,0,0,1|1,0,1]=4 1261 B9R0.24 CC[C@@H](C)CN[C@@H](C)CO 88c857353db968254e23f026ad956ae0 [0,1,0,0,0,1|1,0,1]=4 1262 B9R0.24 CC[C@@H](C)CN[C@H](C)CO ffba90297eb48664ae825e88c4e1f012 [0,1,0,0,0,1|1,0,1]=4 1263 B9R0.24 CC[C@@H](C)COC(C)C=O 5f2a423d5e84e84165cad52616ebe06a [0,1,0,0,0,1|1,0,1]=4 1264 B9R0.24 CC[C@@H](C)CO[C@H](C)C=O 94e3cf2f57eaf39351c0c89797af4a14 [0,1,0,0,0,1|1,0,1]=4 1265 B9R0.24 CC[C@@H](C)NC/C(=C/Cl)/Cl 8434b7dfcaff8bd706515e09dad7a564 [0,1,0,0,0,1|2,0,0]=4 1266 B9R0.24 CC[C@@H](C)NCC(=O)CO d8b4c8bcceaf1479e8e5170a427a4480 [0,1,0,0,0,1|0,0,0]=2 1267 B9R0.24 CC[C@@H](C)NCC(=O)NC 0ca27b77de1e030aca1751b3aa23f4cf [0,1,0,0,0,1|1,0,0]=3 1268 B9R0.24 CC[C@@H](C)NCC(=O)OC 64edeba17979e2fe49241dd635a58ddb [0,1,0,0,0,1|0,0,0]=2 1269 B9R0.24 CC[C@@H](C)NCC(C)CO e16138e0c51549f136233e3c07ac8b96 [0,1,0,0,0,1|1,0,1]=4 1270 B9R0.24 CC[C@@H](C)NCC(C)OC 9a69db503350f59975b69537785d2a81 [0,1,0,0,0,1|1,0,1]=4 1271 B9R0.24 CC[C@@H](C)NCC(O)CF 026efe9cc3580b0e51a89a5ed6411343 [0,1,0,0,0,1|1,0,1]=4 1272 B9R0.24 CC[C@@H](C)NCC(O)CO 742a3eef539a4b8c0aa23b681e517ea3 [0,1,0,0,0,1|0,0,2]=4 1273 B9R0.24 CC[C@@H](C)NC[C@@H](C)CO 7cd711df88871b90c1043b89f70d1d47 [0,1,0,0,0,1|1,0,1]=4 1274 B9R0.24 CC[C@@H](C)NC[C@@H](C)OC 429e8c63c4ee8498501a17da1357f891 [0,1,0,0,0,1|1,0,1]=4 1275 B9R0.24 CC[C@@H](C)NC[C@@H](O)CO 40997326e1aa5003269d6f53432d2446 [0,1,0,0,0,1|0,0,2]=4 1276 B9R0.24 CC[C@@H](C)NC[C@H](C)CO fe9a450ecc9843531dc18ebb51cf8369 [0,1,0,0,0,1|1,0,1]=4 1277 B9R0.24 CC[C@@H](C)NC[C@H](C)OC 848ec56c015cf60e058219bcff8dbab1 [0,1,0,0,0,1|1,0,1]=4 1278 B9R0.24 CC[C@@H](C)NC[C@H](O)CO 18482b3b717fed9c6181db7cc2f20a7f [0,1,0,0,0,1|0,0,2]=4 1279 B9R0.24 CC[C@@H](C)OC/C(=C/Cl)/Cl d7db374e8d75fbf0aa84075fb3616461 [0,1,0,0,0,1|2,0,0]=4 1280 B9R0.24 CC[C@@H](C)OCC(=O)NC 817bc16c72cd78f6e12f450b6b571e69 [0,1,0,0,0,1|1,0,0]=3 1281 B9R0.24 CC[C@@H](C)OCC(=O)OC 3145e5d285e192d9dfaf26cd6f7644e4 [0,1,0,0,0,1|0,0,0]=2 1282 B9R0.24 CC[C@@H](C)OCC(C)OC c45a2cd48462924ae961bd42ed716210 [0,1,0,0,0,1|1,0,1]=4 1283 B9R0.24 CC[C@@H](C)OCC(O)CO ba440ae4bc41314212717304c17c469e [0,1,0,0,0,1|0,0,2]=4 1284 B9R0.24 CC[C@@H](C)OC[C@@H](C)OC f1c1280d7867d8a7c79f0b2ecb03af8b [0,1,0,0,0,1|1,0,1]=4 1285 B9R0.24 CC[C@@H](C)OC[C@@H](O)CO e3d18fffeae6598369a01293f5e0d290 [0,1,0,0,0,1|0,0,2]=4 1286 B9R0.24 CC[C@@H](C)OC[C@H](C)OC 77b18b4de4f06aebd5e13e7034fa28b7 [0,1,0,0,0,1|1,0,1]=4 1287 B9R0.24 CC[C@@H](C)OC[C@H](O)CO 8247142430650723991e3322e67f2afc [0,1,0,0,0,1|0,0,2]=4 1288 B9R0.24 CC[C@@H](O)CNC(=O)C=O b2c16a451601358949d787dd856420b3 [0,1,0,0,0,1|1,0,1]=4 1289 B9R0.24 CC[C@@H](O)CNC(=O)CF ad570a8918919566498a65d0b9acf1d8 [0,1,0,0,0,1|2,0,0]=4 1290 B9R0.24 CC[C@@H](O)CNC(=O)CO 7575280e7285d9a3f58054ddb6e7bd3c [0,1,0,0,0,1|1,0,0]=3 1291 B9R0.24 CC[C@@H](O)CNC(=O)CS 54601b1a15927eccedc92db33a081850 [0,1,0,0,0,1|1,1,0]=4 1292 B9R0.24 CC[C@H](C)CNC(=O)C=O b152f22fd6d2bdaa800d838b41994c4f [0,1,0,0,0,1|0,0,1]=3 1293 B9R0.24 CC[C@H](C)CNC(=O)CF 54640882e6fae5c3ab1ad5ca09996f5a [0,1,0,0,0,1|1,0,0]=3 1294 B9R0.24 CC[C@H](C)CNC(=O)CO 71f236c0490b4515463a284ebbba7293 [0,1,0,0,0,1|0,0,0]=2 1295 B9R0.24 CC[C@H](C)CNC(=O)CS 479dfc2f85af34ba043b18392d8bbcea [0,1,0,0,0,1|0,1,0]=3 1296 B9R0.24 CC[C@H](C)CNC(C)C=O 812d49fa4c5a73a68e7fcf555a71b1df [0,1,0,0,0,1|1,0,1]=4 1297 B9R0.24 CC[C@H](C)CNC(C)CO 0b187c22d281aff0041613c6b9700281 [0,1,0,0,0,1|1,0,1]=4 1298 B9R0.24 CC[C@H](C)CN[C@@H](C)CO 4e4de397ca1654b1457c2a954a02d46b [0,1,0,0,0,1|1,0,1]=4 1299 B9R0.24 CC[C@H](C)CN[C@H](C)C=O 9b887330b4902a8d43be158458c30884 [0,1,0,0,0,1|1,0,1]=4 1300 B9R0.24 CC[C@H](C)CN[C@H](C)CO c132ee08f49bf2ba84a2a5d2f10c4deb [0,1,0,0,0,1|1,0,1]=4 1301 B9R0.24 CC[C@H](C)COC(C)C=O 1f3483513eefdafb9d5d2417472574e7 [0,1,0,0,0,1|1,0,1]=4 1302 B9R0.24 CC[C@H](C)CO[C@H](C)C=O 9f77b7292d3150efa78f5831c5171993 [0,1,0,0,0,1|1,0,1]=4 1303 B9R0.24 CC[C@H](C)NC/C(=C/Cl)/Cl e91b7cb06ffd92c03df928493cd34d20 [0,1,0,0,0,1|2,0,0]=4 1304 B9R0.24 CC[C@H](C)NCC(=O)CO e9206ac8cc3cd983500ccf78b1aa4921 [0,1,0,0,0,1|0,0,0]=2 1305 B9R0.24 CC[C@H](C)NCC(=O)NC b6643c7b3c39b0dd63a44a929e3e3a20 [0,1,0,0,0,1|1,0,0]=3 1306 B9R0.24 CC[C@H](C)NCC(=O)OC 98f1fcbe76f73cc49ef7ab910e9d424b [0,1,0,0,0,1|0,0,0]=2 1307 B9R0.24 CC[C@H](C)NCC(C)CO 2d65a1bdf019a8136dad9b89ccf7884e [0,1,0,0,0,1|1,0,1]=4 1308 B9R0.24 CC[C@H](C)NCC(C)OC 7f27bb0dae4e1029368e77efc005fe6c [0,1,0,0,0,1|1,0,1]=4 1309 B9R0.24 CC[C@H](C)NCC(O)CF 32671cba9f74571ce0d03f9ccdae5163 [0,1,0,0,0,1|1,0,1]=4 1310 B9R0.24 CC[C@H](C)NCC(O)CO e618846998fa626421c29247d3463b21 [0,1,0,0,0,1|0,0,2]=4 1311 B9R0.24 CC[C@H](C)NC[C@@H](C)CO c0042912012cc3ae5e7e4dd3c8681db9 [0,1,0,0,0,1|1,0,1]=4 1312 B9R0.24 CC[C@H](C)NC[C@@H](C)OC 97532918064b07798c552f695b9fee18 [0,1,0,0,0,1|1,0,1]=4 1313 B9R0.24 CC[C@H](C)NC[C@@H](O)CO 91c29dcacc0f79cc4ea7b62d2bb24524 [0,1,0,0,0,1|0,0,2]=4 1314 B9R0.24 CC[C@H](C)NC[C@H](C)CO 24d92355383c9a447977da59c57d60fc [0,1,0,0,0,1|1,0,1]=4 1315 B9R0.24 CC[C@H](C)NC[C@H](C)OC b79c3809c8043cf1b5f79ff0ca006b0a [0,1,0,0,0,1|1,0,1]=4 1316 B9R0.24 CC[C@H](C)NC[C@H](O)CO 108d488633c04314ffd7c2daf6c1e301 [0,1,0,0,0,1|0,0,2]=4 1317 B9R0.24 CC[C@H](C)OC/C(=C/Cl)/Cl 9912ec551077c0dfd494bb170d5da9a6 [0,1,0,0,0,1|2,0,0]=4 1318 B9R0.24 CC[C@H](C)OCC(=O)NC 8cc4a5382b0da495d42bf9faf91f3972 [0,1,0,0,0,1|1,0,0]=3 1319 B9R0.24 CC[C@H](C)OCC(=O)OC 86df6380b1146d2c264ca4f2009c7f20 [0,1,0,0,0,1|0,0,0]=2 1320 B9R0.24 CC[C@H](C)OCC(C)OC 8b007a5ffba31eb0414267c9d1fb1089 [0,1,0,0,0,1|1,0,1]=4 1321 B9R0.24 CC[C@H](C)OCC(O)CO d3f8c511ce80b5df149715a02efb2f74 [0,1,0,0,0,1|0,0,2]=4 1322 B9R0.24 CC[C@H](C)OC[C@@H](C)OC 74ddae12fdca8c59c4bc83df99dc0e69 [0,1,0,0,0,1|1,0,1]=4 1323 B9R0.24 CC[C@H](C)OC[C@@H](O)CO 3c2f068a7cebc41249fcd05efa7a4a5d [0,1,0,0,0,1|0,0,2]=4 1324 B9R0.24 CC[C@H](C)OC[C@H](C)OC abd7f4f9f60edbdce308cc07f1d2afb8 [0,1,0,0,0,1|1,0,1]=4 1325 B9R0.24 CC[C@H](C)OC[C@H](O)CO 8f0b259092d901c38dc080500d5cf382 [0,1,0,0,0,1|0,0,2]=4 1326 B9R0.24 CNC(=O)CNC(C)CO ec368f89ae3133e9914688d9526b3308 [0,1,0,0,0,1|2,0,0]=4 1327 B9R0.24 CNC(=O)CN[C@@H](C)CO 8531a9eb34ba0a4fc0ea4436f7489571 [0,1,0,0,0,1|2,0,0]=4 1328 B9R0.24 CNC(=O)CN[C@H](C)CO 4f02fcca7f221bc5a0c3d561312d2993 [0,1,0,0,0,1|2,0,0]=4 1329 B9R0.24 CNC(=O)COC(C)CF 49d6358dc1b3bf9946b10d6c9c79dc03 [0,1,0,0,0,1|2,0,0]=4 1330 B9R0.24 CNC(=O)COC(C)CS 629d4a83d0e4b525b8645cb193ce09bd [0,1,0,0,0,1|2,0,0]=4 1331 B9R0.24 CNC(=O)CO[C@H](C)CS 495aaa6f76c99ea9377664a3c1c75db0 [0,1,0,0,0,1|2,0,0]=4 1332 B9R0.24 COC(=O)CCN(C)CF df1ecc151d3c48659c12397496c94279 [0,1,0,0,0,1|2,0,0]=4 1333 B9R0.24 COC(=O)CCN(C)CO ab8817d781dac8c00b417de9f0f45392 [0,1,0,0,0,1|2,0,0]=4 1334 B9R0.24 COC(=O)CNC(C)C#N fc01721820eed30ba9b4b8cb59d5d728 [0,1,0,0,0,1|1,0,1]=4 1335 B9R0.24 COC(=O)CNC(C)C=O 2dfcf6cde44b92f9471ba53f321fd2aa [0,1,0,0,0,1|1,0,1]=4 1336 B9R0.24 COC(=O)CNC(C)CO 77bfeb42b55f78705d2d10d16062fb5d [0,1,0,0,0,1|1,0,0]=3 1337 B9R0.24 COC(=O)CN[C@@H](C)CO a8bf9a0ee8b1f8cec0f7a692c165f630 [0,1,0,0,0,1|1,0,0]=3 1338 B9R0.24 COC(=O)CN[C@H](C)C=O 1463b380ab51139274cc8359c96a1f75 [0,1,0,0,0,1|1,0,1]=4 1339 B9R0.24 COC(=O)CN[C@H](C)CO 9b055f26dd8da05358a6f557b707100d [0,1,0,0,0,1|1,0,0]=3 1340 B9R0.24 COC(=O)COC(C)C=O 2893581629e04d22b3e4e05cd3ab89b1 [0,1,0,0,0,1|1,0,1]=4 1341 B9R0.24 COC(=O)COC(C)CF ae8e20076061c42c64980b5fad7cae0e [0,1,0,0,0,1|1,0,0]=3 1342 B9R0.24 COC(=O)COC(C)CS 9c5b6e99de02bc94886d5fea75f150a9 [0,1,0,0,0,1|1,0,0]=3 1343 B9R0.24 COC(=O)CO[C@H](C)C=O 18cc6747b068bee5fcd005922c770056 [0,1,0,0,0,1|1,0,1]=4 1344 B9R0.24 COC(=O)CO[C@H](C)CS 9763eb97166cb02d86ae0eeee7c72710 [0,1,0,0,0,1|1,0,0]=3 1345 B9R0.24 CO[C@@H](C)CNC(=O)C=O 416ce50d5667fe2c054d92fe8e1ae3ca [0,1,0,0,0,1|1,0,1]=4 1346 B9R0.24 CO[C@@H](C)CNC(=O)CF 9c71752e88e3537f1549ea2c34796f20 [0,1,0,0,0,1|2,0,0]=4 1347 B9R0.24 CO[C@@H](C)CNC(=O)CO b95fa8c7148a81b6451cdc622cbb6140 [0,1,0,0,0,1|1,0,0]=3 1348 B9R0.24 CO[C@@H](C)CNC(=O)CS b904d4a82cbed37ba466c43dfd72cd4b [0,1,0,0,0,1|1,1,0]=4 1349 B9R0.24 CO[C@H](C)CNC(=O)C=O 5d92e88f5294d4eba46afe3bad3297db [0,1,0,0,0,1|1,0,1]=4 1350 B9R0.24 CO[C@H](C)CNC(=O)CF cd8f253fbdfc6148e4534a97efffcc39 [0,1,0,0,0,1|2,0,0]=4 1351 B9R0.24 CO[C@H](C)CNC(=O)CO 27142753b862c3bf94f22d3bf8c13f99 [0,1,0,0,0,1|1,0,0]=3 1352 B9R0.24 CO[C@H](C)CNC(=O)CS dff05e26c5c67063a3031ad9d0febc1c [0,1,0,0,0,1|1,1,0]=4 1353 B9R0.24 C[C@@H](CO)NCC(=O)CO 3225b42a885f3ed6c68d39acb497e53e [0,1,0,0,0,1|1,0,0]=3 1354 B9R0.24 C[C@@H](CO)NCC(=O)NO c3a18fba71dcb5aefd276e7d08a9ad65 [0,1,0,0,0,1|1,0,0]=3 1355 B9R0.24 C[C@H](C=O)NCC(=O)NO 4fc8691513b3c6a6c1196a36c9c69103 [0,1,0,0,0,1|1,0,1]=4 1356 B9R0.24 C[C@H](CO)CNC(=O)C=O 8889175de452081f82deb5969c2399f0 [0,1,0,0,0,1|1,0,1]=4 1357 B9R0.24 C[C@H](CO)CNC(=O)CF 3baa2e9c752d4b66ae409b5801b3170a [0,1,0,0,0,1|2,0,0]=4 1358 B9R0.24 C[C@H](CO)CNC(=O)CO a5fe05048ffdec3dc3e750a075dbac29 [0,1,0,0,0,1|1,0,0]=3 1359 B9R0.24 C[C@H](CO)CNC(=O)CS fb0b1510ecf30d05159447a3aa7ebcfe [0,1,0,0,0,1|1,1,0]=4 1360 B9R0.24 C[C@H](CO)NCC(=O)CO b3f42dfe0dee068b7cc05a35951cfa2a [0,1,0,0,0,1|1,0,0]=3 1361 B9R0.24 C[C@H](CO)NCC(=O)NO 12ef88be17cdd87cc51ff039fa32572a [0,1,0,0,0,1|1,0,0]=3 1362 B9R0.24 O=C(CO)NCC(Br)CBr 09a2531b5ddbb7d54991fcfe9b2eb354 [0,1,0,0,0,1|2,0,0]=4 1363 B9R0.24 O=C(CO)NCC(F)CO f5afcde18fbedef6152670175120d59b [0,1,0,0,0,1|2,0,0]=4 1364 B9R0.24 O=C(CO)NCC(O)CO 59b8d1e3f5dbb6e0d8cc49e15f524bcd [0,1,0,0,0,1|2,0,0]=4 1365 B9R0.24 O=C(CO)NC[C@@H](F)CO b9c1f0734722ad851767f4eb2e4059da [0,1,0,0,0,1|2,0,0]=4 1366 B9R0.24 O=C(CO)NC[C@@H](O)CO 7aaab2ab4025c8fed32eec6928cf259f [0,1,0,0,0,1|2,0,0]=4 1367 B9R0.24 O=C(CO)NC[C@H](F)CO 2af544e2c542cb586c92bda3d07e068d [0,1,0,0,0,1|2,0,0]=4 1368 B9R0.24 O=C(CO)NC[C@H](O)CO 33ab51de405864fc5b6ae5961bb63355 [0,1,0,0,0,1|2,0,0]=4 1369 B9R0.42 C#CC(C)NC(C)C(=O)O 47412c0503f341919877078a4de3b15b [0,1,0,0,0,1|0,0,2]=4 1370 B9R0.42 C#CC(C)NC(O)C(=O)O b7acf73e8148e88a7816d02761728c70 [0,1,0,0,0,1|0,0,2]=4 1371 B9R0.42 C#CC(C)N[C@@H](C)C(=O)O 3269fe6bbad23670c46cb1b49d0bf083 [0,1,0,0,0,1|0,0,2]=4 1372 B9R0.42 C#CC(C)N[C@H](C)C(=O)O 2df8ca07c5b3a2e429ec6180cebd0ff1 [0,1,0,0,0,1|0,0,2]=4 1373 B9R0.42 C#C[C@@H](C)NC(C)C(=O)O 434172b16639df33027afc7a81c556b7 [0,1,0,0,0,1|0,0,2]=4 1374 B9R0.42 C#C[C@@H](C)N[C@@H](C)C(=O)O c56a51179a366073685e661195b7ddae [0,1,0,0,0,1|0,0,2]=4 1375 B9R0.42 C#C[C@@H](C)N[C@H](C)C(=O)O 67046238bd4ab30b8bb5eca429d2549b [0,1,0,0,0,1|0,0,2]=4 1376 B9R0.42 C#C[C@H](C)NC(C)C(=O)O 3af0b91c05932c8a9ea6fe09e0e8bade [0,1,0,0,0,1|0,0,2]=4 1377 B9R0.42 C#C[C@H](C)N[C@@H](C)C(=O)O 5233f63c0002c430cca3b179eb79d34c [0,1,0,0,0,1|0,0,2]=4 1378 B9R0.42 C#C[C@H](C)N[C@H](C)C(=O)O 065298467453772e8016e2ed9f0c3100 [0,1,0,0,0,1|0,0,2]=4 1379 B9R0.42 C=C(CN(C)CC)C(=O)O ad8b230d9e37e71f54fd17d149f46463 [0,1,0,0,0,1|1,0,0]=3 1380 B9R0.42 C=CC(C)NC(C)C(=O)O a21c364ebf806c0b489514351780d545 [0,1,0,0,0,1|0,0,2]=4 1381 B9R0.42 C=CC(C)NC(F)C(=O)O 1eccd6464ff529fb4db555016f5871dd [0,1,0,0,0,1|0,0,2]=4 1382 B9R0.42 C=CC(C)NC(O)C(=O)O fa689c4ff06c77f4ca819c8817c7139e [0,1,0,0,0,1|0,0,2]=4 1383 B9R0.42 C=CC(C)N[C@@H](C)C(=O)O e755310822c45c5c0e8f3967eb2f796d [0,1,0,0,0,1|0,0,2]=4 1384 B9R0.42 C=CC(C)N[C@@H](F)C(=O)O f8ccfdc02c2ecebd328c5bb049755359 [0,1,0,0,0,1|0,0,2]=4 1385 B9R0.42 C=CC(C)N[C@H](C)C(=O)O 531b54e5cb86764563ede07ae1e5c672 [0,1,0,0,0,1|0,0,2]=4 1386 B9R0.42 C=CC(C)OC(C)C(=O)O 7ad7bfd5d12674284fda7343264d4010 [0,1,0,0,0,1|0,0,2]=4 1387 B9R0.42 C=CC(C)OC(F)C(=O)O 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CC(=O)C(C)N[C@H](C)CO 086d4f9a55c425402f3944055eb16896 [0,1,0,0,0,1|2,0,0]=4 1399 B9R0.42 CC(=O)C(C)OC(C)CF 9343945fc506d50c4bb5ff89a8cfe5a4 [0,1,0,0,0,1|2,0,0]=4 1400 B9R0.42 CC(=O)C(C)OC(C)CS f4a74ee84125f463e0f184fd01fa05d4 [0,1,0,0,0,1|2,0,0]=4 1401 B9R0.42 CC(=O)C(C)O[C@H](C)CS 9dc2a55710bbe85b31072d4f57b22eb8 [0,1,0,0,0,1|2,0,0]=4 1402 B9R0.42 CC(=O)N(C)CC(C)CO 5fc6af892d019edb3818f568e4972714 [0,1,0,0,0,1|2,0,0]=4 1403 B9R0.42 CC(C=O)NC(C)C(=O)O 20a60fbe7856cff95fc76d9ef94f22d5 [0,1,0,0,0,1|1,0,1]=4 1404 B9R0.42 CC(C=O)NC(O)C(=O)O db9c7b297edd7c7de73bc597b349df56 [0,1,0,0,0,1|1,0,1]=4 1405 B9R0.42 CC(C=O)N[C@@H](C)C(=O)O e3cf235a2693748060acfaea11b79b65 [0,1,0,0,0,1|1,0,1]=4 1406 B9R0.42 CC(C=O)N[C@H](C)C(=O)O 4ec6dc5e3aa5c2a3e70c2c676d764736 [0,1,0,0,0,1|1,0,1]=4 1407 B9R0.42 CC(C=O)OC(C)C(=O)O 1537e851619ce413e13fe6f204bab7d7 [0,1,0,0,0,1|1,0,1]=4 1408 B9R0.42 CC(C=O)OC(F)C(=O)O f994657f138457ec1e0b60d238af711d [0,1,0,0,0,1|1,0,1]=4 1409 B9R0.42 CC(C=O)O[C@@H](C)C(=O)O 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c4f6fe4fdd240638d0083650541f09fc [0,1,0,0,0,1|0,0,0]=2 1487 B9R0.42 CC[C@H](C)OC(F)C(=O)N 744d0bd42e08a9d9bee3fa69f4a01bfc [0,1,0,0,0,1|1,0,0]=3 1488 B9R0.42 CC[C@H](C)O[C@@H](C)C(=O)N e71f72e8da61c315e880361c47ef0d62 [0,1,0,0,0,1|1,0,0]=3 1489 B9R0.42 CC[C@H](C)O[C@@H](C)C(=O)O 8169e39c983146464221b38b3e9be7ca [0,1,0,0,0,1|0,0,0]=2 1490 B9R0.42 CC[C@H](C)O[C@H](C)C(=O)N 88c7111887df4dccdcda360cf543a9fc [0,1,0,0,0,1|1,0,0]=3 1491 B9R0.42 CC[C@H](C)O[C@H](C)C(=O)O ed9f7b940047fd9a74f5f18223d105e3 [0,1,0,0,0,1|0,0,0]=2 1492 B9R0.42 CN(CF)C[C@H](O)C(=O)O 60366e3171c2878a947ec480c44c1bd5 [0,1,0,0,0,1|2,0,0]=4 1493 B9R0.42 CN(CO)C[C@H](O)C(=O)O 9684eb013c9991979f1f883b59e5a0c5 [0,1,0,0,0,1|2,0,0]=4 1494 B9R0.42 C[C@@H](CO)NC(F)C(=O)N 8cf2f6322979ac0a8b224646a5442f17 [0,1,0,0,0,1|2,0,0]=4 1495 B9R0.42 C[C@@H](CO)NC(O)C(=O)O a6cb74e2b40c31da9f39edc27820ebf8 [0,1,0,0,0,1|1,0,0]=3 1496 B9R0.42 C[C@@H](CO)N[C@H](C)C(=O)N 3e9658560a6e1f637cb827b3e295c026 [0,1,0,0,0,1|2,0,0]=4 1497 B9R0.42 C[C@@H](CO)N[C@H](C)C(=O)O c1a428b0ddd139f9c2e2de1e99a8fc8a [0,1,0,0,0,1|1,0,0]=3 1498 B9R0.42 C[C@H](C=O)NC(O)C(=O)O f9acfd7578d2efc6770d6eca05c7d778 [0,1,0,0,0,1|1,0,1]=4 1499 B9R0.42 C[C@H](C=O)N[C@@H](C)C(=O)O 939bc4c7aaa3ec6d4eb0542bf7f8b345 [0,1,0,0,0,1|1,0,1]=4 1500 B9R0.42 C[C@H](C=O)N[C@H](C)C(=O)O cc7913b07882750d08c30e7582a0574f [0,1,0,0,0,1|1,0,1]=4 1501 B9R0.42 C[C@H](C=O)O[C@@H](C)C(=O)O b6f80b92b47a54815102fbd4899c5250 [0,1,0,0,0,1|1,0,1]=4 1502 B9R0.42 C[C@H](C=O)O[C@H](C)C(=O)O 44ced11a0975d80e393790a7eaccae4d [0,1,0,0,0,1|1,0,1]=4 1503 B9R0.42 C[C@H](CO)NC(F)C(=O)N 2e2fed8193c6cdc1e228c6f34d185ba3 [0,1,0,0,0,1|2,0,0]=4 1504 B9R0.42 C[C@H](CO)NC(O)C(=O)O 7ec955a21dba01cf6aa8cf71eef23a2e [0,1,0,0,0,1|1,0,0]=3 1505 B9R0.42 C[C@H](CO)N[C@@H](C)C(=O)N add6080309873043e8941bab18ede2a4 [0,1,0,0,0,1|2,0,0]=4 1506 B9R0.42 C[C@H](CO)N[C@@H](C)C(=O)O ac2b35d6c7874b85744c21c2fc268b36 [0,1,0,0,0,1|1,0,0]=3 1507 B9R0.42 C[C@H](CO)N[C@H](C)C(=O)N 2172b533263fde3d2253038ebff38b42 [0,1,0,0,0,1|2,0,0]=4 1508 B9R0.42 C[C@H](CO)N[C@H](C)C(=O)O 484a418c83723ee82ece2afa09d603dc [0,1,0,0,0,1|1,0,0]=3 1509 B9R0.42 C[C@H](CS)O[C@@H](C)C(=O)N de029951257e8590a95665a984e4d363 [0,1,0,0,0,1|2,0,0]=4 1510 B9R0.42 C[C@H](CS)O[C@H](C)C(=O)N 308f84ed3d2c37897757ccc72a650613 [0,1,0,0,0,1|2,0,0]=4 1511 B9R0.42 C[C@H](N[C@@H](C)CO)C(=O)N 47b121d320db6eb71f980a5a5880f4cb [0,1,0,0,0,1|2,0,0]=4 1512 B9R0.42 C[C@H](N[C@@H](C)CO)C(=O)O 1cea0a2a31427ddf84ea4f4f502411f2 [0,1,0,0,0,1|1,0,0]=3 1513 B9R0.43 C#CC(CC)OCC(=O)N 016ce731fbd25e3c07aeaafc7a1106ab [0,1,0,0,0,1|1,0,1]=4 1514 B9R0.43 C#CC(CC)OCC(=O)O 730b1e7fc7eb3300fdc71985647106f9 [0,1,0,0,0,1|0,0,1]=3 1515 B9R0.43 C=C(Br)CNC(CC)CC 97db30322f568231d64e4faf37443d20 [0,1,0,0,0,1|2,0,0]=4 1516 B9R0.43 C=C(Br)CNC(CC)CO 8226e5603d005e7e6168a397f596d62a [0,1,0,0,0,1|2,0,0]=4 1517 B9R0.43 C=C(Br)CN[C@@H](CC)CO aee06c63bc14f357f4bcd7a58e5c10cf [0,1,0,0,0,1|2,0,0]=4 1518 B9R0.43 C=C(Br)CN[C@H](CC)CO 4df3593910abe92d052ade44535b68f0 [0,1,0,0,0,1|2,0,0]=4 1519 B9R0.43 C=C(Br)COC(CC)CC 32c8353b33b03d43ef5552434b2cf053 [0,1,0,0,0,1|2,0,0]=4 1520 B9R0.43 C=C(C)CNC(CC)CC 4717b92c1f1fb1c793a1e708221dc81b [0,1,0,0,0,1|2,0,0]=4 1521 B9R0.43 C=C(C)CNC(CC)CO 41573add7ecc3c2b787577865120e2ad [0,1,0,0,0,1|2,0,0]=4 1522 B9R0.43 C=C(C)CN[C@@H](CC)CO aa526be5fa985545cd3de1bd4bdcdea0 [0,1,0,0,0,1|2,0,0]=4 1523 B9R0.43 C=C(C)CN[C@H](CC)CO 4848e608a0e249d81e00cb32c002745f [0,1,0,0,0,1|2,0,0]=4 1524 B9R0.43 C=C(C)COC(CC)CC 6ed63b2202386743d7e616cda27e9fd2 [0,1,0,0,0,1|2,0,0]=4 1525 B9R0.43 C=C(Cl)CNC(CC)CC 77863dd1f44a0a6d35a709c64edbb270 [0,1,0,0,0,1|2,0,0]=4 1526 B9R0.43 C=C(Cl)CNC(CC)CO 7308d06639016c6f9e4ef23aa5177f1d [0,1,0,0,0,1|2,0,0]=4 1527 B9R0.43 C=C(Cl)CN[C@@H](CC)CO aade8391b301b27c0c42e6324abd06ff [0,1,0,0,0,1|2,0,0]=4 1528 B9R0.43 C=C(Cl)CN[C@H](CC)CO bfa55701e21f8445b4e31fc42ccb6a61 [0,1,0,0,0,1|2,0,0]=4 1529 B9R0.43 C=C(Cl)COC(CC)CC 1cd6b94c53faab7d6e699744cf2d7d68 [0,1,0,0,0,1|2,0,0]=4 1530 B9R0.43 C=C(F)CNC(CC)CC fe31eeebc405f2d0c898168d31adb576 [0,1,0,0,0,1|2,0,0]=4 1531 B9R0.43 C=C(I)COC(CC)CC dc10a18c8d0421c9d2f99a19586aef7c [0,1,0,0,0,1|2,0,0]=4 1532 B9R0.43 C=CC(CC)OCC(=O)N 20a0e0364714fe8ac3370fe7047b3a8e [0,1,0,0,0,1|1,0,1]=4 1533 B9R0.43 C=CC(CC)OCC(=O)O b88f2e10a8550602707dec2f9eae7fb5 [0,1,0,0,0,1|0,0,1]=3 1534 B9R0.43 C=C[C@@H](CO)NCC(=O)O 8d053a06a2e2c444b01bd69fddfe73ff [0,1,0,0,0,1|0,0,2]=4 1535 B9R0.43 CC(=O)CNC(CO)CO 27a2650d76e9e15a63382fd7ad52a6ce [0,1,0,0,0,1|2,0,0]=4 1536 B9R0.43 CC(=O)COC(CO)CO 49c1efd5bc84fe886c67130d1ee8544b [0,1,0,0,0,1|2,0,0]=4 1537 B9R0.43 CC(=O)NCC(CO)CO 275c9e974a5537da3ca2a7e20c29fd1a [0,1,0,0,0,1|2,0,0]=4 1538 B9R0.43 CCC(C#N)OCC(=O)N 288eae6acf3aae85507d59dc1ea5be7a [0,1,0,0,0,1|1,0,1]=4 1539 B9R0.43 CCC(C#N)OCC(=O)O 9d4d7ebe4dc8dfaff9ab156c1788d83d [0,1,0,0,0,1|0,0,1]=3 1540 B9R0.43 CCC(C=O)NCC(=O)C e722b983dfd65925ee993463768d3a21 [0,1,0,0,0,1|1,0,1]=4 1541 B9R0.43 CCC(C=O)NCC(=O)N 26afc9988a3306c5f291107cd41975aa [0,1,0,0,0,1|1,0,1]=4 1542 B9R0.43 CCC(C=O)NCC(=O)O 2dff37ffe0c09807fcd641801f47306a [0,1,0,0,0,1|0,0,1]=3 1543 B9R0.43 CCC(C=O)OCC(=O)C 204385582c9e72ba1ef04200142d0135 [0,1,0,0,0,1|1,0,1]=4 1544 B9R0.43 CCC(C=O)OCC(=O)N 7514a50ff723b770f07c34bd72db76ff [0,1,0,0,0,1|1,0,1]=4 1545 B9R0.43 CCC(C=O)OCC(=O)O 200ce9180f5aea00044ac6edcf54d531 [0,1,0,0,0,1|0,0,1]=3 1546 B9R0.43 CCC(C=O)OCS(=O)O d09dc149e383a54e207ae1f48baec9b4 [0,1,0,0,0,1|1,0,1]=4 1547 B9R0.43 CCC(CC)CNC(=O)C 1549f79204b015c6741805722d63f02b [0,1,0,0,0,1|1,0,0]=3 1548 B9R0.43 CCC(CC)NCC(=O)C 70a7a34fd5b9f13420599575ca59b309 [0,1,0,0,0,1|1,0,0]=3 1549 B9R0.43 CCC(CC)NCC(=O)N ba1ba5684139cdae5f828e99c03588fa [0,1,0,0,0,1|1,0,0]=3 1550 B9R0.43 CCC(CC)NCC(=O)O 995cd6a8146da731115d097551736d02 [0,1,0,0,0,1|0,0,0]=2 1551 B9R0.43 CCC(CC)NCC(C)O f9f0c06ca7a62b72dc4a55ab775fcb97 [0,1,0,0,0,1|1,0,1]=4 1552 B9R0.43 CCC(CC)NC[C@@H](C)O 55549f8ca6d20d7a47b29e7f82011407 [0,1,0,0,0,1|1,0,1]=4 1553 B9R0.43 CCC(CC)NC[C@H](C)O 2c89179e78c12eb2909d49b1d61779fb [0,1,0,0,0,1|1,0,1]=4 1554 B9R0.43 CCC(CC)NC[N+](=O)[O-] 8c3850681e8efc00ca6c34b8d3e9b315 [0,1,0,0,0,1|1,0,1]=4 1555 B9R0.43 CCC(CC)OCC(=O)C e585e39db31cc4648e1fa74bf026183f [0,1,0,0,0,1|1,0,0]=3 1556 B9R0.43 CCC(CC)OCC(=O)N 1159d3ee802ce0ed1d8ecfa7ae9f3a38 [0,1,0,0,0,1|1,0,0]=3 1557 B9R0.43 CCC(CC)OCC(=O)O 1b3befb0c3d9e3800b8f83ed1ff32f58 [0,1,0,0,0,1|0,0,0]=2 1558 B9R0.43 CCC(CC)OCC(=S)N ff441c90fe02754ea4b856556d6918b5 [0,1,0,0,0,1|1,1,0]=4 1559 B9R0.43 CCC(CC)OCS(=O)O 9088dc5b9dfa1c1f32aa7ffed72cecc6 [0,1,0,0,0,1|1,0,0]=3 1560 B9R0.43 CCC(CC)OC[N+](=O)[O-] fe50457a9963924aa1d35c5d3ccc716a [0,1,0,0,0,1|1,0,1]=4 1561 B9R0.43 CCC(CO)CNC(=O)C f06f2cec7d1e6e4c1c3bbf6f6411b3ed [0,1,0,0,0,1|1,0,0]=3 1562 B9R0.43 CCC(CO)NCC(=O)C d3ea90a78330a2ba0c8b0126dca355b9 [0,1,0,0,0,1|1,0,0]=3 1563 B9R0.43 CCC(CO)NCC(=O)N 7e633424dbaaf57014c9bf99d0265d36 [0,1,0,0,0,1|1,0,0]=3 1564 B9R0.43 CCC(CO)NCC(=O)O 586189b2332a32af4757091d48666a8a [0,1,0,0,0,1|0,0,0]=2 1565 B9R0.43 CCC(CO)NCC(C)O 151f43a9b2968630ec35915eaaedfd6b [0,1,0,0,0,1|1,0,1]=4 1566 B9R0.43 CCC(CO)NC[C@@H](C)O 1bf2df805fb2cbdd0ff55aaefab426ac [0,1,0,0,0,1|1,0,1]=4 1567 B9R0.43 CCC(CO)NC[C@H](C)O 7e045774875688fd6e37f4362d35f031 [0,1,0,0,0,1|1,0,1]=4 1568 B9R0.43 CCC(CO)NC[N+](=O)[O-] 15220feab8412d9171ed190eb918054f [0,1,0,0,0,1|1,0,1]=4 1569 B9R0.43 CCN(CC)CCC(=O)N a8bdb500d800dfb76989944bf928047c [0,1,0,0,0,1|2,0,0]=4 1570 B9R0.43 CCN(CO)CCC(=O)N 922f26fe6b08d865c262df93248b88c0 [0,1,0,0,0,1|2,0,0]=4 1571 B9R0.43 CC[C@@H](CO)NCC(=O)N e22143a7c0573e78dadb07451102ce8b [0,1,0,0,0,1|1,0,0]=3 1572 B9R0.43 CC[C@@H](CO)NCC(=O)O ca5de122a401b27aebff33f963871c41 [0,1,0,0,0,1|0,0,0]=2 1573 B9R0.43 CC[C@@H](CO)NCC(C)O 5a280976c397a6cfed1f7a0a3aa55569 [0,1,0,0,0,1|1,0,1]=4 1574 B9R0.43 CC[C@@H](CO)NC[C@@H](C)O f8681883ead87702e6c8eecffbcbd330 [0,1,0,0,0,1|1,0,1]=4 1575 B9R0.43 CC[C@@H](CO)NC[C@H](C)O f3da66d9f3dd556e0416a00db9281772 [0,1,0,0,0,1|1,0,1]=4 1576 B9R0.43 CC[C@@H](CO)NC[N+](=O)[O-] 1a918f208b7b6d617871057ea266bac7 [0,1,0,0,0,1|1,0,1]=4 1577 B9R0.43 CC[C@H](CO)NCC(=O)N d10a2cce3c58bda571f1f8fb2e113e41 [0,1,0,0,0,1|1,0,0]=3 1578 B9R0.43 CC[C@H](CO)NCC(=O)O e8d663c48b3ee956fc556faee09136e0 [0,1,0,0,0,1|0,0,0]=2 1579 B9R0.43 CC[C@H](CO)NCC(C)O 90328898c26a5ab1cc16af67ca77ab94 [0,1,0,0,0,1|1,0,1]=4 1580 B9R0.43 CC[C@H](CO)NC[C@@H](C)O 321f58bf80797d97093abab3113dabec [0,1,0,0,0,1|1,0,1]=4 1581 B9R0.43 CC[C@H](CO)NC[C@H](C)O 23ccad1ffbaecbb6cbb77403015ddded [0,1,0,0,0,1|1,0,1]=4 1582 B9R0.43 CC[C@H](CO)NC[N+](=O)[O-] ca09ce51738f033e0a6452fe42af28f4 [0,1,0,0,0,1|1,0,1]=4 1583 B9R0.43 COC(CNC(=O)C)OC 7667afb1129bf19fdd7549c6df961d11 [0,1,0,0,0,1|2,0,0]=4 1584 B9R0.43 CO[C@@H](CO)CNC(=O)C 595c34503ab75b4f13d4a0f790389747 [0,1,0,0,0,1|2,0,0]=4 1585 B9R0.43 NC(=O)CNC(CO)CO 4e48d2cef0486bc40365c38a560cbc87 [0,1,0,0,0,1|2,0,0]=4 1586 B9R0.43 NC(=O)COC(CBr)CBr 755ef6a3375a8870d3ef80b1aa8b2b88 [0,1,0,0,0,1|2,0,0]=4 1587 B9R0.43 NC(=O)COC(CCl)CBr 666160a8b1b92e564b2cad77b8619df0 [0,1,0,0,0,1|2,0,0]=4 1588 B9R0.43 NC(=O)COC(CCl)CCl 72d2b2b5ce17ee74412b9ca7f7669966 [0,1,0,0,0,1|2,0,0]=4 1589 B9R0.43 NC(=O)COC(CF)CF cd6dbdf128f78c01c6454b08b415181f [0,1,0,0,0,1|2,0,0]=4 1590 B9R0.43 NC(=O)COC(CO)CO 1879ad44559e4d34e66c634af69fe537 [0,1,0,0,0,1|2,0,0]=4 1591 B9R0.43 NC(=O)CO[C@@H](CCl)CI dfb8636078a269567986621dec25f810 [0,1,0,0,0,1|2,0,0]=4 1592 B9R0.43 NC(=O)CO[C@H](CCl)CI b37605a22e7f52ae5b92f42ca5159ece [0,1,0,0,0,1|2,0,0]=4 1593 B9R0.43 O=C(O)CNC(CO)CO a2139af8eda74af59c3bc12727e73261 [0,1,0,0,0,1|1,0,0]=3 1594 B9R0.43 O=C(O)COC(CBr)CBr 968739f959b8050ba02b555082945239 [0,1,0,0,0,1|1,0,0]=3 1595 B9R0.43 O=C(O)COC(CCl)CBr 9033349e9d1caf3bf05451da377590dd [0,1,0,0,0,1|1,0,0]=3 1596 B9R0.43 O=C(O)COC(CCl)CCl 07b67d873a27eefc5209e32d4442733d [0,1,0,0,0,1|1,0,0]=3 1597 B9R0.43 O=C(O)COC(CF)CF 645fb4e5970d1448f8310a40d8900d10 [0,1,0,0,0,1|1,0,0]=3 1598 B9R0.43 O=C(O)COC(CO)CO 97a0c2721b7a536eedc3657cdcee9b13 [0,1,0,0,0,1|1,0,0]=3 1599 B9R0.43 O=C(O)CO[C@@H](CCl)CI 8724643fcfb76af31b10332219dbb5af [0,1,0,0,0,1|1,0,0]=3 1600 B9R0.43 O=C(O)CO[C@H](CCl)CI a55b93887e2d1bb2223800dc9912c456 [0,1,0,0,0,1|1,0,0]=3 1601 B9R0.43 O=S(O)COC(CO)CO c392060d1592de3451857c649c140b71 [0,1,0,0,0,1|2,0,0]=4 1602 B9R0.48 C#CCC(C)OCC(=O)N a1dc31bc0b83b828e6381714822d1850 [0,1,0,0,0,1|1,0,1]=4 1603 B9R0.48 C#CCC(C)OCC(=O)O 0835f7b07d3faca22337f7063acadc83 [0,1,0,0,0,1|0,0,1]=3 1604 B9R0.48 C#CCN(C)CCC(=O)O 190ebfe976f23c6a4760ea2b195e163b [0,1,0,0,0,1|1,0,1]=4 1605 B9R0.48 C/C=C/C(C)OCC(=O)N 522a488c5e33b435b3f48696e6e4d6df [0,1,0,0,0,1|1,0,1]=4 1606 B9R0.48 C/C=C/C(C)OCC(=O)O faebc3261e3a36af1d31713fdea4082c [0,1,0,0,0,1|0,0,1]=3 1607 B9R0.48 C=C(Br)CNC(C)CCC d1e87f5542f2307e864af5084642a423 [0,1,0,0,0,1|2,0,0]=4 1608 B9R0.48 C=C(Br)CNC(C)CCO 7e169a8de9e53bf390e68f399bb12557 [0,1,0,0,0,1|2,0,0]=4 1609 B9R0.48 C=C(Br)CNC(C)COC 188f3b812b95fa9fa10cef027a060b2f [0,1,0,0,0,1|2,0,0]=4 1610 B9R0.48 C=C(Br)CN[C@@H](C)CCC 026742ec5a83c2ea5c7cdd96b7bf8515 [0,1,0,0,0,1|2,0,0]=4 1611 B9R0.48 C=C(Br)CN[C@@H](C)CCO bc6411a6c413649f2bee4b60ebb3be5a [0,1,0,0,0,1|2,0,0]=4 1612 B9R0.48 C=C(Br)CN[C@@H](C)COC abbb04efe2850e8ff94685e8d8982c13 [0,1,0,0,0,1|2,0,0]=4 1613 B9R0.48 C=C(Br)CN[C@H](C)CCO 46904c0024df319a74180fdbb4fe4fc8 [0,1,0,0,0,1|2,0,0]=4 1614 B9R0.48 C=C(Br)CN[C@H](C)COC cc2fff09814aaca5672ba5b89987a276 [0,1,0,0,0,1|2,0,0]=4 1615 B9R0.48 C=C(Br)COC(C)CCC 9b42c71e18ddb5f1df0cfed1380fbc1d [0,1,0,0,0,1|2,0,0]=4 1616 B9R0.48 C=C(Br)COC(C)COC 0f41d2b81fbf80662df0c0a245ef6928 [0,1,0,0,0,1|2,0,0]=4 1617 B9R0.48 C=C(Br)COC(C)CSC 75fdc023a87ab1a07b801bd73197dce9 [0,1,0,0,0,1|2,0,0]=4 1618 B9R0.48 C=C(Br)CO[C@@H](C)CCC f5dbba56577b47c8139533bef64e6a47 [0,1,0,0,0,1|2,0,0]=4 1619 B9R0.48 C=C(Br)CO[C@@H](C)COC 9eb94a9ed15d77fd641ccc67f4ad59e7 [0,1,0,0,0,1|2,0,0]=4 1620 B9R0.48 C=C(Br)CO[C@H](C)CCC 31129fd17e5635d40c40e1dca48175e1 [0,1,0,0,0,1|2,0,0]=4 1621 B9R0.48 C=C(Br)CO[C@H](C)COC 1c40dc56a6ed4bd42d60c485e21c03de [0,1,0,0,0,1|2,0,0]=4 1622 B9R0.48 C=C(C)CNC(C)CCC 249a59065d0d74ced558dc9c9dc4f202 [0,1,0,0,0,1|2,0,0]=4 1623 B9R0.48 C=C(C)CNC(C)CCO d85fd1e307a4077b4cf36bbfe1d1c760 [0,1,0,0,0,1|2,0,0]=4 1624 B9R0.48 C=C(C)CNC(C)COC d45fc6cc89acec05571600c8255e3908 [0,1,0,0,0,1|2,0,0]=4 1625 B9R0.48 C=C(C)CN[C@@H](C)CCC fd09b17b6eab62ae3b8eb3ec9d6279f3 [0,1,0,0,0,1|2,0,0]=4 1626 B9R0.48 C=C(C)CN[C@@H](C)CCO e3246539a13a78bf32e18971e556d709 [0,1,0,0,0,1|2,0,0]=4 1627 B9R0.48 C=C(C)CN[C@@H](C)COC d0a1bbd5e2f7676228642c9c4dec7765 [0,1,0,0,0,1|2,0,0]=4 1628 B9R0.48 C=C(C)CN[C@H](C)CCO f260f56a0bcb5aa998bd25a2e7292621 [0,1,0,0,0,1|2,0,0]=4 1629 B9R0.48 C=C(C)CN[C@H](C)COC e78b35fad424012197589f4ce43a917c [0,1,0,0,0,1|2,0,0]=4 1630 B9R0.48 C=C(C)COC(C)CCC 8a712e3f999a984623a12b3e185e16f6 [0,1,0,0,0,1|2,0,0]=4 1631 B9R0.48 C=C(C)COC(C)COC de05f812b2faf52134b47c9c1c4e2013 [0,1,0,0,0,1|2,0,0]=4 1632 B9R0.48 C=C(C)COC(C)CSC 6cc77a62ccb99e8e83b2164eaaab66ff [0,1,0,0,0,1|2,0,0]=4 1633 B9R0.48 C=C(C)CO[C@@H](C)CCC e17237a765f8d2f7515c764ae18eed6b [0,1,0,0,0,1|2,0,0]=4 1634 B9R0.48 C=C(C)CO[C@@H](C)COC 3f2393e700f0ed43a30889580db0078b [0,1,0,0,0,1|2,0,0]=4 1635 B9R0.48 C=C(C)CO[C@H](C)CCC c07382948aa51118d6a02318fd89a90c [0,1,0,0,0,1|2,0,0]=4 1636 B9R0.48 C=C(C)CO[C@H](C)COC a9098aa7373848b15980244a0109a35c [0,1,0,0,0,1|2,0,0]=4 1637 B9R0.48 C=C(Cl)CNC(C)CCC 439f29525e9ac53db46e03cff08e57cc [0,1,0,0,0,1|2,0,0]=4 1638 B9R0.48 C=C(Cl)CNC(C)CCO eea145a7a0a61327a76ad83c49ed8bbe [0,1,0,0,0,1|2,0,0]=4 1639 B9R0.48 C=C(Cl)CNC(C)COC 2311aa329d9e30065f9326f331bd26e9 [0,1,0,0,0,1|2,0,0]=4 1640 B9R0.48 C=C(Cl)CN[C@@H](C)CCC 5b1f9afd10517d211188dba56c2833fa [0,1,0,0,0,1|2,0,0]=4 1641 B9R0.48 C=C(Cl)CN[C@@H](C)CCO c32c303158ecc614f151c28a575e8405 [0,1,0,0,0,1|2,0,0]=4 1642 B9R0.48 C=C(Cl)CN[C@@H](C)COC 6eda5c5daa29e3020568453abc4ee711 [0,1,0,0,0,1|2,0,0]=4 1643 B9R0.48 C=C(Cl)CN[C@H](C)CCO 244ed72c778eafb405a471375e4f4c90 [0,1,0,0,0,1|2,0,0]=4 1644 B9R0.48 C=C(Cl)CN[C@H](C)COC 9e4ba496910a6357551d3efaa1016271 [0,1,0,0,0,1|2,0,0]=4 1645 B9R0.48 C=C(Cl)COC(C)CCC 4469f239e88e997d5230d6906915a264 [0,1,0,0,0,1|2,0,0]=4 1646 B9R0.48 C=C(Cl)COC(C)COC 91d9aeb9094758abfa08572fc68c0fa8 [0,1,0,0,0,1|2,0,0]=4 1647 B9R0.48 C=C(Cl)COC(C)CSC 3a0478ed712010a79b998246925534e6 [0,1,0,0,0,1|2,0,0]=4 1648 B9R0.48 C=C(Cl)CO[C@@H](C)CCC 847077f2e15a78bac2a4d70b1ea7e8fa [0,1,0,0,0,1|2,0,0]=4 1649 B9R0.48 C=C(Cl)CO[C@@H](C)COC 67c12f4ea538720539c23d1a17cd9f47 [0,1,0,0,0,1|2,0,0]=4 1650 B9R0.48 C=C(Cl)CO[C@H](C)CCC ff9eb95f7bb39ecffad9190ef32d24a9 [0,1,0,0,0,1|2,0,0]=4 1651 B9R0.48 C=C(Cl)CO[C@H](C)COC 245c75120d506800dac751b0edc88bbf [0,1,0,0,0,1|2,0,0]=4 1652 B9R0.48 C=C(F)CNC(C)CCO a9aa1dadee3055aee8892f07e0f86961 [0,1,0,0,0,1|2,0,0]=4 1653 B9R0.48 C=C(F)CNC(C)COC 376f639b2dd2ab4a7515cc69b0b67692 [0,1,0,0,0,1|2,0,0]=4 1654 B9R0.48 C=C(F)CN[C@@H](C)CCO 2a031f53d5854138af68a408681cc916 [0,1,0,0,0,1|2,0,0]=4 1655 B9R0.48 C=C(F)CN[C@@H](C)COC d6a87ee2f6214bdecb2824ab2e4ae84c [0,1,0,0,0,1|2,0,0]=4 1656 B9R0.48 C=C(F)CN[C@H](C)CCO d9e3b1dc251a3c73cb65ce23eb1141b4 [0,1,0,0,0,1|2,0,0]=4 1657 B9R0.48 C=C(F)CN[C@H](C)COC 3ee43198fc4ae02eba4a668c38b03bb4 [0,1,0,0,0,1|2,0,0]=4 1658 B9R0.48 C=C(I)COC(C)CCC 7041f181646a6f58588ec8a65571cde0 [0,1,0,0,0,1|2,0,0]=4 1659 B9R0.48 C=C(I)COC(C)COC c3c1b3083be7e487e957e19cc14f9f8c [0,1,0,0,0,1|2,0,0]=4 1660 B9R0.48 C=CCC(C)OCC(=O)N 03d8170adf9c978b41b313e040ead01d [0,1,0,0,0,1|1,0,1]=4 1661 B9R0.48 C=CCC(C)OCC(=O)O d4c2db20e21f45057095c6dd9b09bcfe [0,1,0,0,0,1|0,0,1]=3 1662 B9R0.48 C=CCN(C)CCC(=O)O 85c31c0123bc751a9540d6f16d5ab7f5 [0,1,0,0,0,1|1,0,1]=4 1663 B9R0.48 C=CC[C@@H](C)OCC(=O)N b9e6e4dc02620404407ebbb35d51175b [0,1,0,0,0,1|1,0,1]=4 1664 B9R0.48 C=CC[C@@H](C)OCC(=O)O e1ec2ca024444d722f0b6bd34535e0cd [0,1,0,0,0,1|0,0,1]=3 1665 B9R0.48 C=CC[C@H](C)OCC(=O)N 81442f50a23cd38aaf08376b3d919b30 [0,1,0,0,0,1|1,0,1]=4 1666 B9R0.48 C=CC[C@H](C)OCC(=O)O 6ea8726abd2765890e4fcb26b01386e0 [0,1,0,0,0,1|0,0,1]=3 1667 B9R0.48 CC#CC(C)OCC(=O)N edf00e7e25d82976b604c420dc19d994 [0,1,0,0,0,1|1,0,1]=4 1668 B9R0.48 CC#CC(C)OCC(=O)O e813873701cea8517348ce7a075a23bc [0,1,0,0,0,1|0,0,1]=3 1669 B9R0.48 CC(=O)CCN(C)CCF cdc83228dd3252c1749d13a60adc5400 [0,1,0,0,0,1|2,0,0]=4 1670 B9R0.48 CC(=O)CCN(C)CCO 4a03b831e9c1e8d9f6e965d9f1dd4ebb [0,1,0,0,0,1|2,0,0]=4 1671 B9R0.48 CC(=O)CNC(C)CC#N 411fc034ca518537ab837a56952cf84f [0,1,0,0,0,1|1,0,1]=4 1672 B9R0.48 CC(=O)CNC(C)CCO 9e95fc34e5592f78b50834034d3bee25 [0,1,0,0,0,1|1,0,0]=3 1673 B9R0.48 CC(=O)COC(C)CC#N eb8919a139a34aace08c8712d76e936b [0,1,0,0,0,1|1,0,1]=4 1674 B9R0.48 CC(=O)NCC(C)CCO e9136906ce0994bcda960f696063f2a9 [0,1,0,0,0,1|1,0,0]=3 1675 B9R0.48 CC(=O)NCC(C)OCF b0f4bcee091e9ec82fc9f31c12a11230 [0,1,0,0,0,1|2,0,0]=4 1676 B9R0.48 CC(=O)OCC(C)OCF d945c8dd292c0b146df582fcf02d66be [0,1,0,0,0,1|2,0,0]=4 1677 B9R0.48 CC(=O)OCN(C)CCF 24d5def49e8d2055e6966b61dd517ecc [0,1,0,0,0,1|2,0,0]=4 1678 B9R0.48 CC(=O)OCN(C)CCO 069b3daa8f7a19ea9cc69cf1079fc5e7 [0,1,0,0,0,1|2,0,0]=4 1679 B9R0.48 CC(CC#N)NCC(=O)N 4ccac1b1d75beabb5f8bb2d9eefb263d [0,1,0,0,0,1|1,0,1]=4 1680 B9R0.48 CC(CC#N)NCC(=O)O 69fba03fb5560f26359cbab13b359b1e [0,1,0,0,0,1|0,0,1]=3 1681 B9R0.48 CC(CC#N)OCC(=O)N 3593c24237626e3791e1293cee8f8bf5 [0,1,0,0,0,1|1,0,1]=4 1682 B9R0.48 CC(CC#N)OCC(=O)O 70ee78feb9ab6a3020a3affabc75ae0e [0,1,0,0,0,1|0,0,1]=3 1683 B9R0.48 CC(CC#N)OCS(=O)O 66fc60d65adfc73f35786f0a04cb6e2a [0,1,0,0,0,1|1,0,1]=4 1684 B9R0.48 CC(CCC(=O)O)NC#N 013e3f5bce1f84721446768ab72dd503 [0,1,0,0,0,1|1,0,1]=4 1685 B9R0.48 CC(CCC(=O)O)NCF a92d39df8a126f0852271a9b340958b4 [0,1,0,0,0,1|1,0,0]=3 1686 B9R0.48 CC(CCC(=O)O)OCF 8a850024bcf506861cc56e2f4b203d76 [0,1,0,0,0,1|1,0,0]=3 1687 B9R0.48 CC(CCO)NCC(=O)N ee855d8cbfe47d902f4e0ecbc66af7f8 [0,1,0,0,0,1|1,0,0]=3 1688 B9R0.48 CC(CCO)NCC(=O)O facbaef0695b9d4fe56ffc8af771a40f [0,1,0,0,0,1|0,0,0]=2 1689 B9R0.48 CC(CCO)NC[C@@H](C)O 943d8e859e75a5b249fd0890eb559e5b [0,1,0,0,0,1|1,0,1]=4 1690 B9R0.48 CC(CCO)NC[C@H](C)O ff390b018e21ae0e97b968f08b734b5d [0,1,0,0,0,1|1,0,1]=4 1691 B9R0.48 CC(CCO)NC[N+](=O)[O-] c0c3614e32defcb58907e02c28062428 [0,1,0,0,0,1|1,0,1]=4 1692 B9R0.48 CC(O)CNC(C)CCO f58e37f406c63a50d90e22345c5673cd [0,1,0,0,0,1|1,0,1]=4 1693 B9R0.48 CC(O)CN[C@@H](C)CCO 4ff006fac9782be19aab4020a464a184 [0,1,0,0,0,1|1,0,1]=4 1694 B9R0.48 CC(O)CN[C@H](C)CCO b66b0295e1617c4998f94801152e2980 [0,1,0,0,0,1|1,0,1]=4 1695 B9R0.48 CC=CC(C)OCC(=O)N ae1198b8e6babc179e832d8a4463dfaa [0,1,0,0,0,1|1,0,1]=4 1696 B9R0.48 CC=CC(C)OCC(=O)O 4f9396fcfa89905cdd40c7dc857f21fd [0,1,0,0,0,1|0,0,1]=3 1697 B9R0.48 CCCC(=S)OCC(=O)O 1c62169da41f2cb2acdc293fd6559f2d [0,1,0,0,0,1|1,0,1]=4 1698 B9R0.48 CCCC(C)NCC(=O)C 6b8217a6e509e4e9ac7eac79852a2211 [0,1,0,0,0,1|1,0,0]=3 1699 B9R0.48 CCCC(C)NCC(=O)N c7599e8ca497fbac7099aebf1f0f8aac [0,1,0,0,0,1|1,0,0]=3 1700 B9R0.48 CCCC(C)NCC(=O)O cc1e9c4996e6fef62cc1269e902e2107 [0,1,0,0,0,1|0,0,0]=2 1701 B9R0.48 CCCC(C)NCC(C)O 47ca46de854bc307afa51b274d820e99 [0,1,0,0,0,1|1,0,1]=4 1702 B9R0.48 CCCC(C)NC[C@@H](C)O dd3e1e5a99d06357b215baaa3e655fbd [0,1,0,0,0,1|1,0,1]=4 1703 B9R0.48 CCCC(C)NC[C@H](C)O 9331ecd30e898992036bbad5faca0440 [0,1,0,0,0,1|1,0,1]=4 1704 B9R0.48 CCCC(C)NC[N+](=O)[O-] fec979aa2692a5b6c311cad8c0dbbc6c [0,1,0,0,0,1|1,0,1]=4 1705 B9R0.48 CCCC(C)OCC(=O)C 1cb96080ad3b5f1e9dd4a42dcc86b0a0 [0,1,0,0,0,1|1,0,0]=3 1706 B9R0.48 CCCC(C)OCC(=O)N 7e6999709f4494a1ecc876c304501582 [0,1,0,0,0,1|1,0,0]=3 1707 B9R0.48 CCCC(C)OCC(=O)O 841e752dc9ac365809a80143d547b4ea [0,1,0,0,0,1|0,0,0]=2 1708 B9R0.48 CCCC(C)OCC(=S)N 53e4836c2da53eec93819a42a5b417e0 [0,1,0,0,0,1|1,1,0]=4 1709 B9R0.48 CCCC(C)OCS(=O)O 5fd3c2b57cde05de71deaa29073d7460 [0,1,0,0,0,1|1,0,0]=3 1710 B9R0.48 CCCC(C)OC[N+](=O)[O-] 46ae41b33890caee55b9c81d88ba1802 [0,1,0,0,0,1|1,0,1]=4 1711 B9R0.48 CCCC(O)CNC(=O)C 5b570a4d674c9d38425ae4777e887a42 [0,1,0,0,0,1|2,0,0]=4 1712 B9R0.48 CCCN(C)CCC(=O)C b29483cd50605788c7eef5f63dcb49c2 [0,1,0,0,0,1|2,0,0]=4 1713 B9R0.48 CCCN(C)CCC(=O)N df69e561042543f03748d6be46a7cd9c [0,1,0,0,0,1|2,0,0]=4 1714 B9R0.48 CCCN(C)CCC(=O)O c326725f005578bca676b9f1f6f13638 [0,1,0,0,0,1|1,0,0]=3 1715 B9R0.48 CCCN(C)COC(=O)C 0353bc7482d98b3c935ad94681e2352d [0,1,0,0,0,1|2,0,0]=4 1716 B9R0.48 CCCN(C)CSC(=O)N ac12b7ae18653dba20b50f3ea6b2b656 [0,1,0,0,0,1|2,0,0]=4 1717 B9R0.48 CCC[C@@H](C)OCC(=O)N c33601ccdbc26af4c94de37ccd60dbb7 [0,1,0,0,0,1|1,0,0]=3 1718 B9R0.48 CCC[C@@H](C)OCC(=O)O 51c501112f8d973994eff73221ed5619 [0,1,0,0,0,1|0,0,0]=2 1719 B9R0.48 CCC[C@@H](C)OC[N+](=O)[O-] 037447bd914f940e773e9ae4eec2b2c8 [0,1,0,0,0,1|1,0,1]=4 1720 B9R0.48 CCC[C@H](C)NCC(=O)N 2f193e4895d45290d1e4c025c650c03f [0,1,0,0,0,1|1,0,0]=3 1721 B9R0.48 CCC[C@H](C)NCC(=O)O e4aa324610e7a29c03d24a187e7b9bea [0,1,0,0,0,1|0,0,0]=2 1722 B9R0.48 CCC[C@H](C)NCC(C)O 564c6afcec40669a3c18d484e9d625f8 [0,1,0,0,0,1|1,0,1]=4 1723 B9R0.48 CCC[C@H](C)NC[C@@H](C)O f8f56b630d6b9084881f1dc1c9f6ac45 [0,1,0,0,0,1|1,0,1]=4 1724 B9R0.48 CCC[C@H](C)NC[C@H](C)O a434bea59043bb2c05076edff7a7581d [0,1,0,0,0,1|1,0,1]=4 1725 B9R0.48 CCC[C@H](C)NC[N+](=O)[O-] 5a5a7758cb713843e598c06054fa95a6 [0,1,0,0,0,1|1,0,1]=4 1726 B9R0.48 CCC[C@H](C)OCC(=O)N 838feb7f628304bf0a6aa0910dbfc330 [0,1,0,0,0,1|1,0,0]=3 1727 B9R0.48 CCC[C@H](C)OCC(=O)O 21190ebbab7da0abc6514346eed4dcf5 [0,1,0,0,0,1|0,0,0]=2 1728 B9R0.48 CCC[C@H](C)OC[N+](=O)[O-] c885816113158913d765d3fd15d0fea0 [0,1,0,0,0,1|1,0,1]=4 1729 B9R0.48 CCNC(C)CCC(=O)O 7dbe459581ff5b66cbefd9a1d696ad43 [0,1,0,0,0,1|0,0,0]=2 1730 B9R0.48 CCN[C@@H](C)CCC(=O)O c2d632f7e33174af2c524d9023ca075b [0,1,0,0,0,1|0,0,0]=2 1731 B9R0.48 CCOC(C)CCC(=O)O 31641a6cc61a92f98818e768ef37979d [0,1,0,0,0,1|0,0,0]=2 1732 B9R0.48 CCOC(C)CNC(=O)C 217fca33332c664f1a507b96c62f402a [0,1,0,0,0,1|1,0,0]=3 1733 B9R0.48 CCOC(C)COC(=O)C 9e93393c063eba810753fb5603d4fc7e [0,1,0,0,0,1|1,0,0]=3 1734 B9R0.48 CN(CC#N)CCC(=O)O 7ee855adb388b27d4f530ceef2499116 [0,1,0,0,0,1|1,0,1]=4 1735 B9R0.48 CN(CC=O)CCC(=O)O c2208c5f20eb019e9eb30d465cfc143b [0,1,0,0,0,1|1,0,1]=4 1736 B9R0.48 CN(CCF)CCC(=O)N 1162d624abb9e02bb3e7367ba7025435 [0,1,0,0,0,1|2,0,0]=4 1737 B9R0.48 CN(CCF)CCC(=O)O 98b30d2a6b798aa5402f2613938994ad [0,1,0,0,0,1|1,0,0]=3 1738 B9R0.48 CN(CCF)CSC(=O)N 9ff773f1f50e3639e500ef7d1ecf5359 [0,1,0,0,0,1|2,0,0]=4 1739 B9R0.48 CN(CCO)CCC(=O)N 4c6097e8d0e68d91a2233c9af460ed84 [0,1,0,0,0,1|2,0,0]=4 1740 B9R0.48 CN(CCO)CCC(=O)O dff5f325047c0f022e242f8ab09a0166 [0,1,0,0,0,1|1,0,0]=3 1741 B9R0.48 CN(CCO)CSC(=O)N 5023055fe36a55f7f39ee58647633c05 [0,1,0,0,0,1|2,0,0]=4 1742 B9R0.48 CN(CCS)CCC(=O)N b280f17724c33fdc42441d54cfbf13fc [0,1,0,0,0,1|2,0,0]=4 1743 B9R0.48 CN(CCS)CCC(=O)O 834e8dabd4decc6fedd4ae2dee1a1dfb [0,1,0,0,0,1|1,0,0]=3 1744 B9R0.48 COCC(C)NCC(=O)C 66428d1fbec130ffc6abd2b2b4184289 [0,1,0,0,0,1|1,0,0]=3 1745 B9R0.48 COCC(C)NCC(=O)N 2a85402add89b33d09cee582d974122e [0,1,0,0,0,1|1,0,0]=3 1746 B9R0.48 COCC(C)NCC(=O)O e01666d87959623998976d0fafabe1b4 [0,1,0,0,0,1|0,0,0]=2 1747 B9R0.48 COCC(C)NCC(C)O 9d426d75bc0b74d79c2ecab5d1bb9ee3 [0,1,0,0,0,1|1,0,1]=4 1748 B9R0.48 COCC(C)NC[C@@H](C)O 21c32a8f2e0c727ab10a3008d038f51d [0,1,0,0,0,1|1,0,1]=4 1749 B9R0.48 COCC(C)NC[C@H](C)O 40d30d4246bdff9ff6144eec84f806f2 [0,1,0,0,0,1|1,0,1]=4 1750 B9R0.48 COCC(C)NC[N+](=O)[O-] 964955dd12fd8237a2142ce52e8c4862 [0,1,0,0,0,1|1,0,1]=4 1751 B9R0.48 COCC(C)OCC(=O)C ace81521640f8e9505293b44aa1ed37f [0,1,0,0,0,1|1,0,0]=3 1752 B9R0.48 COCC(C)OCC(=O)N 7d04affdce90658a1e1f9af9f91e8fcc [0,1,0,0,0,1|1,0,0]=3 1753 B9R0.48 COCC(C)OCC(=O)O af12d17716abae98c4b6439f05d9b8db [0,1,0,0,0,1|0,0,0]=2 1754 B9R0.48 COCC(C)OCC(=S)N c60f6ae09bd6294110528312839afb7f [0,1,0,0,0,1|1,1,0]=4 1755 B9R0.48 COCC(C)OCS(=O)O 8e0f3d4aa3af6e49675c6678bb54e2f6 [0,1,0,0,0,1|1,0,0]=3 1756 B9R0.48 COCC(C)OC[N+](=O)[O-] 0b15efcf2f46cafdd327bd561d9b2677 [0,1,0,0,0,1|1,0,1]=4 1757 B9R0.48 COCC(O)CNC(=O)C b9e4b5e9625177a365a4bdbe35bd87be [0,1,0,0,0,1|2,0,0]=4 1758 B9R0.48 COCN(C)CCC(=O)N 5f04638c852e547a486d808a2002a8b7 [0,1,0,0,0,1|2,0,0]=4 1759 B9R0.48 COCN(C)CCC(=O)O 0303bd9b3e27ba66031eea0a93003c39 [0,1,0,0,0,1|1,0,0]=3 1760 B9R0.48 COC[C@@H](C)NCC(=O)N 19cec0a0d7c311317a88ea4dd58f1b22 [0,1,0,0,0,1|1,0,0]=3 1761 B9R0.48 COC[C@@H](C)NCC(=O)O e8166a8a6f9778cdf58111f239ebd7ae [0,1,0,0,0,1|0,0,0]=2 1762 B9R0.48 COC[C@@H](C)NCC(C)O f8f0b486b1b430543e65cbf8a5d49074 [0,1,0,0,0,1|1,0,1]=4 1763 B9R0.48 COC[C@@H](C)NC[C@@H](C)O c47e09c5525570350b3644916dc03306 [0,1,0,0,0,1|1,0,1]=4 1764 B9R0.48 COC[C@@H](C)NC[C@H](C)O b9333b4228e5ddb20adaab9b26168d72 [0,1,0,0,0,1|1,0,1]=4 1765 B9R0.48 COC[C@@H](C)NC[N+](=O)[O-] 2ad1721bb1cae978b327b09bfc4d0be4 [0,1,0,0,0,1|1,0,1]=4 1766 B9R0.48 COC[C@@H](C)OCC(=O)N 0de9ccc6f20a88c5b21b25c17c729130 [0,1,0,0,0,1|1,0,0]=3 1767 B9R0.48 COC[C@@H](C)OCC(=O)O 98562fabe6feb10b85b2a34b6a556f9c [0,1,0,0,0,1|0,0,0]=2 1768 B9R0.48 COC[C@@H](C)OC[N+](=O)[O-] 482455b597f96267e7c4748a1ae164a0 [0,1,0,0,0,1|1,0,1]=4 1769 B9R0.48 COC[C@@H](O)CNC(=O)C 77bae3eb71a3b0890035e84a8c0ee4ab [0,1,0,0,0,1|2,0,0]=4 1770 B9R0.48 COC[C@H](C)NCC(=O)N 38f4aae9a8b29f292cc33528055c603b [0,1,0,0,0,1|1,0,0]=3 1771 B9R0.48 COC[C@H](C)NCC(=O)O 6115e49dc0a4f10f9f15c2b7faed79c6 [0,1,0,0,0,1|0,0,0]=2 1772 B9R0.48 COC[C@H](C)NCC(C)O addac1b2d2405f2de2d0c66d63acd147 [0,1,0,0,0,1|1,0,1]=4 1773 B9R0.48 COC[C@H](C)NC[C@@H](C)O d9024b970862d8842b400c0f9452e69a [0,1,0,0,0,1|1,0,1]=4 1774 B9R0.48 COC[C@H](C)NC[C@H](C)O c0599c557023f0b41b90992bad8663f8 [0,1,0,0,0,1|1,0,1]=4 1775 B9R0.48 COC[C@H](C)NC[N+](=O)[O-] 49cecfaa9e168d105e5f2a77e9054f3d [0,1,0,0,0,1|1,0,1]=4 1776 B9R0.48 COC[C@H](C)OCC(=O)N dd66be63f36dd9f2bb1c38aa8a13e8db [0,1,0,0,0,1|1,0,0]=3 1777 B9R0.48 COC[C@H](C)OCC(=O)O 3f04353f9edb1d4c983cf07f5d5e3249 [0,1,0,0,0,1|0,0,0]=2 1778 B9R0.48 COC[C@H](C)OC[N+](=O)[O-] 36211c21edcff4c2f24937fbeec7d93b [0,1,0,0,0,1|1,0,1]=4 1779 B9R0.48 CSCC(C)OCC(=O)N 6815567749759bca3910689394e3339c [0,1,0,0,0,1|1,0,0]=3 1780 B9R0.48 CSCC(C)OCC(=O)O 55d35686540ec9ccedd07c412d0e4191 [0,1,0,0,0,1|0,0,0]=2 1781 B9R0.48 CSCC(C)OC[N+](=O)[O-] b8f661daad682887ad03a4ac8de5673a [0,1,0,0,0,1|1,0,1]=4 1782 B9R0.48 CSCN(C)CCC(=O)N 4e591e866b2c73dbff30a7b48b193437 [0,1,0,0,0,1|2,0,0]=4 1783 B9R0.48 CSCN(C)CCC(=O)O 014d9e48ffe569c3e580b87ffc15fcd1 [0,1,0,0,0,1|1,0,0]=3 1784 B9R0.48 C[C@@H](CC#N)OCC(=O)N 2c43b7baee83c40ff4d41fb8e04dfe4d [0,1,0,0,0,1|1,0,1]=4 1785 B9R0.48 C[C@@H](CC#N)OCC(=O)O 8221ae7fefced7c44c448304bb0cf294 [0,1,0,0,0,1|0,0,1]=3 1786 B9R0.48 C[C@@H](CCC(=O)O)NCF b06f766ae4850f0433b3999a4509184a [0,1,0,0,0,1|1,0,0]=3 1787 B9R0.48 C[C@@H](CCO)NCC(=O)N ce9017a5837179665e14eb055febb119 [0,1,0,0,0,1|1,0,0]=3 1788 B9R0.48 C[C@@H](CCO)NCC(=O)O e3de9f2ceaa95fe96caa8265de6dee4c [0,1,0,0,0,1|0,0,0]=2 1789 B9R0.48 C[C@@H](CCO)NC[N+](=O)[O-] e65f717c79c213d40d9aedfae971eaab [0,1,0,0,0,1|1,0,1]=4 1790 B9R0.48 C[C@@H](O)CN[C@@H](C)CCO 532fc1d968518803338dab4b16b55976 [0,1,0,0,0,1|1,0,1]=4 1791 B9R0.48 C[C@H](CC#N)OCC(=O)N 6ef0ed06ef30eb3431df63892ba9d306 [0,1,0,0,0,1|1,0,1]=4 1792 B9R0.48 C[C@H](CC#N)OCC(=O)O 8b21be68c80128a2aeb313ea629aed62 [0,1,0,0,0,1|0,0,1]=3 1793 B9R0.48 C[C@H](CCO)NCC(=O)N b5d7ad76dea80bd36b6380bd7b31cf62 [0,1,0,0,0,1|1,0,0]=3 1794 B9R0.48 C[C@H](CCO)NCC(=O)O a393ad11daa1ce12621ddeee9e978586 [0,1,0,0,0,1|0,0,0]=2 1795 B9R0.48 C[C@H](CCO)NC[C@@H](C)O a32e42b56da6aad0cbc516b448fc537f [0,1,0,0,0,1|1,0,1]=4 1796 B9R0.48 C[C@H](CCO)NC[N+](=O)[O-] b113ec349cf6b56a1763a1bda1fa767d [0,1,0,0,0,1|1,0,1]=4 1797 B9R0.48 C[C@H](O)CN[C@@H](C)CCO 0b20a83189180fc44a706f9440afb8c2 [0,1,0,0,0,1|1,0,1]=4 1798 B9R0.48 C[C@H](O)CN[C@H](C)CCO 041b059991b49ab1041acbb2f9f2566a [0,1,0,0,0,1|1,0,1]=4 1799 B9R0.64 C#CC(C)(C)NCC(=O)O a17f9a3492f5da153c2e8b46081a49f7 [0,1,0,0,0,1|0,0,2]=4 1800 B9R0.64 C=C(Br)CNC(C)(C)CC c80045eeca1ac325809f29ffd233d908 [0,1,0,0,0,1|2,0,0]=4 1801 B9R0.64 C=C(C)CNC(C)(C)CC 4bbe915ce980257683f7d5d52d280850 [0,1,0,0,0,1|2,0,0]=4 1802 B9R0.64 C=C(Cl)CNC(C)(C)CC b736dbfcc5212a2fa8fa1fb3f02a806f [0,1,0,0,0,1|2,0,0]=4 1803 B9R0.64 CC(=O)NCC(C)(C)CF 35c376e83fb345feea30b4b52662f085 [0,1,0,0,0,1|2,0,0]=4 1804 B9R0.64 CC(=O)NCC(C)(C)CO 3ef564fa58488a3437688fe1a969e512 [0,1,0,0,0,1|2,0,0]=4 1805 B9R0.64 CC(C)(C#N)NCC(=O)O ec201b0188121fc090c779c46e768348 [0,1,0,0,0,1|1,0,1]=4 1806 B9R0.64 CC(C)(CF)NCC(=O)N f9a4b0f67788445592b26971e642378e [0,1,0,0,0,1|2,0,0]=4 1807 B9R0.64 CC(C)(CF)NCC(=O)O 1a4e72b512223df8d349776ccef40e80 [0,1,0,0,0,1|1,0,0]=3 1808 B9R0.64 CC(C)(CO)NCC(=O)N dacbc56c3497dda920d4002ba9aafe2c [0,1,0,0,0,1|2,0,0]=4 1809 B9R0.64 CC(C)(CO)NCC(=O)O 67fe174ec0e1fc280c3085d51bb29881 [0,1,0,0,0,1|1,0,0]=3 1810 B9R0.64 CCC(C)(C)CNC(=O)C a5d06d07f2be7328cab309362822b65c [0,1,0,0,0,1|1,0,0]=3 1811 B9R0.64 CCC(C)(C)NCC(=O)N 28106e2989c09b9e47bc1095eab84054 [0,1,0,0,0,1|1,0,0]=3 1812 B9R0.64 CCC(C)(C)NCC(C)O 8ed9d0ecf41567d89d26cfac7194a307 [0,1,0,0,0,1|1,0,1]=4 1813 B9R0.64 CCC(C)(C)NC[C@@H](C)O d0780cd08b250256ff86aff8258c0967 [0,1,0,0,0,1|1,0,1]=4 1814 B9R0.64 CCC(C)(C)NC[C@H](C)O d6bea49e50a3657e88ec6a71a9822808 [0,1,0,0,0,1|1,0,1]=4 1815 B9R0.64 CCC(C)(C)NC[N+](=O)[O-] 8a53c83d3323237668c7eba89f4623e4 [0,1,0,0,0,1|1,0,1]=4 1816 B9R0.64 CCC(C)(O)CNC(=O)C 5cdbea673ddb6eaec5c42e286f6da6ff [0,1,0,0,0,1|1,0,0]=3 1817 B9R0.64 COC(C)(C)CNC(=O)C 498dba83dc84f6d723d23e0aba6bb8a0 [0,1,0,0,0,1|2,0,0]=4 1818 B9R0.6 C#CCN(C)C(C)C(=O)O e374002f1df7937cec28306a3d13af0d [0,2,0,0,0,0|1,0,1]=4 1819 B9R0.6 C#CCN(C)C(F)C(=O)O 0601738776f2411a6645b3eaa02af6e8 [0,2,0,0,0,0|1,0,1]=4 1820 B9R0.6 C#CCN(C)[C@@H](C)C(=O)O cfd287b8fd6c37d84e97399a3151666f [0,2,0,0,0,0|1,0,1]=4 1821 B9R0.6 C#CCN(C)[C@@H](F)C(=O)O c25d644a3ac0d62cb7eb4fec5b94af0f [0,2,0,0,0,0|1,0,1]=4 1822 B9R0.6 C#CCN(C)[C@H](C)C(=O)O c965fcd92c24547951619168c3ec6c36 [0,2,0,0,0,0|1,0,1]=4 1823 B9R0.6 C=CCN(C)C(C)C(=O)O f6b2c3ab8b402a6878286b05dfc5fd3e [0,2,0,0,0,0|1,0,1]=4 1824 B9R0.6 C=CCN(C)C(F)C(=O)O ab7a74ec0ddb69d787bf6b8dfef0e9ee [0,2,0,0,0,0|1,0,1]=4 1825 B9R0.6 C=CCN(C)[C@@H](C)C(=O)O 1741857d459e250d6c8b9c98af2739eb [0,2,0,0,0,0|1,0,1]=4 1826 B9R0.6 C=CCN(C)[C@@H](F)C(=O)O 6d6fc63e5762305ad41a64197462de3f [0,2,0,0,0,0|1,0,1]=4 1827 B9R0.6 C=CCN(C)[C@H](C)C(=O)O 715529504fd342c238b40582e484fd03 [0,2,0,0,0,0|1,0,1]=4 1828 B9R0.6 CC(=O)C(C)N(C)CCF c5d47e1a92ee81658700a386051e1a75 [0,2,0,0,0,0|2,0,0]=4 1829 B9R0.6 CC(=O)C(C)N(C)CCO 51e0c269f714d953765d3faf2b5f2421 [0,2,0,0,0,0|2,0,0]=4 1830 B9R0.6 CC(=O)N(C)C(C)CCO 4f10b5938b38e7850ab030a78481e11d [0,2,0,0,0,0|2,0,0]=4 1831 B9R0.6 CC(=O)N(C)[C@@H](C)CCO 367a67f3edf3ca0be8496dbb55d3d759 [0,2,0,0,0,0|2,0,0]=4 1832 B9R0.6 CC(C(=O)N)N(C)CCF b3d63dde4ab58b46b7d5936683984ab2 [0,2,0,0,0,0|2,0,0]=4 1833 B9R0.6 CC(C(=O)N)N(C)CCO dd9e3c97475ac1bf4a16e7dd9460dfe3 [0,2,0,0,0,0|2,0,0]=4 1834 B9R0.6 CC(C(=O)N)N(C)CCS 47426ac0f7eee1013328c5d27f00b3b9 [0,2,0,0,0,0|2,0,0]=4 1835 B9R0.6 CC(C(=O)O)N(C)CC#N cf8ca6630d375e9000befdc66ecffe78 [0,2,0,0,0,0|1,0,1]=4 1836 B9R0.6 CC(C(=O)O)N(C)CC=O 6f4aef9fa366a6057a9e1b899b4b27f3 [0,2,0,0,0,0|1,0,1]=4 1837 B9R0.6 CC(C(=O)O)N(C)CCF e44cd4cbe19f77a1288c72785e09d4ca [0,2,0,0,0,0|1,0,0]=3 1838 B9R0.6 CC(C(=O)O)N(C)CCO 24a541fd10360206d0222569d1abf7e3 [0,2,0,0,0,0|1,0,0]=3 1839 B9R0.6 CC(C(=O)O)N(C)CCS 59424363d2350ed7fde780fb4de14e27 [0,2,0,0,0,0|1,0,0]=3 1840 B9R0.6 CC(OCF)C(C)C(=O)O 65d47df94c61384b516882aa40a31329 [0,2,0,0,0,0|1,0,0]=3 1841 B9R0.6 CCCN(C)C(C)C(=O)C 0ed03c9188e77740bffc26f0c2820448 [0,2,0,0,0,0|2,0,0]=4 1842 B9R0.6 CCCN(C)C(C)C(=O)N 48f19b616238debf7809f80535f95c35 [0,2,0,0,0,0|2,0,0]=4 1843 B9R0.6 CCCN(C)C(C)C(=O)O f70fec3653f8caa91c122702576f4a6d [0,2,0,0,0,0|1,0,0]=3 1844 B9R0.6 CCCN(C)C(F)C(=O)N aa6c72104d8d518f3861ce06834c9755 [0,2,0,0,0,0|2,0,0]=4 1845 B9R0.6 CCCN(C)[C@@H](C)C(=O)N 17553a457ad1447714697d601bac57ee [0,2,0,0,0,0|2,0,0]=4 1846 B9R0.6 CCCN(C)[C@@H](C)C(=O)O 33f2c0d3908618aac995bd4430161391 [0,2,0,0,0,0|1,0,0]=3 1847 B9R0.6 CCCN(C)[C@H](C)C(=O)N 77eba5d5b60bad6e1f7fa42ad8b17a9f [0,2,0,0,0,0|2,0,0]=4 1848 B9R0.6 CCCN(C)[C@H](C)C(=O)O 5c8b184c0ab62c90ff99df884739207b [0,2,0,0,0,0|1,0,0]=3 1849 B9R0.6 CCOC(C)C(C)C(=O)O 0340fa6b71e090f1b398080bd25b7143 [0,2,0,0,0,0|0,0,0]=2 1850 B9R0.6 CCOC(C)C(C)[N+](=O)[O-] 7aee92c0416caee8f1223a823169412b [0,2,0,0,0,0|1,0,1]=4 1851 B9R0.6 CN(CCF)C(F)C(=O)N b4e8c8a44f07e5d5ca73dc56b5141d93 [0,2,0,0,0,0|2,0,0]=4 1852 B9R0.6 COCN(C)C(C)C(=O)N 5ea7b88a05a50a532749f09588858a7b [0,2,0,0,0,0|2,0,0]=4 1853 B9R0.6 COCN(C)C(C)C(=O)O 58493b6e50645657ba85e8c482465391 [0,2,0,0,0,0|1,0,0]=3 1854 B9R0.6 COCN(C)[C@@H](C)C(=O)N 682edc31d7767cc41290176ed85dd174 [0,2,0,0,0,0|2,0,0]=4 1855 B9R0.6 COCN(C)[C@@H](C)C(=O)O 73a054d8912c72cb95dce991aab29537 [0,2,0,0,0,0|1,0,0]=3 1856 B9R0.6 COCN(C)[C@H](C)C(=O)O f51663443e14d28b46b54ec9d30f1173 [0,2,0,0,0,0|1,0,0]=3 1857 B9R0.6 CSCN(C)C(C)C(=O)N 477bb6c1bb0eb59e6658f73583218db3 [0,2,0,0,0,0|2,0,0]=4 1858 B9R0.6 CSCN(C)C(C)C(=O)O 614a73aead9c5ac8d865975d6529b701 [0,2,0,0,0,0|1,0,0]=3 1859 B9R0.6 CSCN(C)[C@@H](C)C(=O)N ec3ecd8d681e7e2afdbe9b21148e5259 [0,2,0,0,0,0|2,0,0]=4 1860 B9R0.6 CSCN(C)[C@@H](C)C(=O)O b9e680512af92360df7a1d0bb832e1bf [0,2,0,0,0,0|1,0,0]=3 1861 B9R0.6 CSCN(C)[C@H](C)C(=O)O 97ca591a395fb45fb0d3c825d20c81ac [0,2,0,0,0,0|1,0,0]=3 1862 B9R0.6 C[C@@H](C(=O)N)N(C)CCF ea13e09df5f07290fe21a2543b077e44 [0,2,0,0,0,0|2,0,0]=4 1863 B9R0.6 C[C@@H](C(=O)N)N(C)CCO 44b09f98ac5cbe57bd2b7b28ca54973c [0,2,0,0,0,0|2,0,0]=4 1864 B9R0.6 C[C@@H](C(=O)N)N(C)CCS 01f48329abc14493e48e07183a9c1f22 [0,2,0,0,0,0|2,0,0]=4 1865 B9R0.6 C[C@@H](C(=O)O)N(C)CC#N 31695ad70dcc5b57eb92a154a13c4ce4 [0,2,0,0,0,0|1,0,1]=4 1866 B9R0.6 C[C@@H](C(=O)O)N(C)CC=O 36b5dc57abb84f84be980aebb05a9149 [0,2,0,0,0,0|1,0,1]=4 1867 B9R0.6 C[C@@H](C(=O)O)N(C)CCF b7bd913ce83947407cb082115140a640 [0,2,0,0,0,0|1,0,0]=3 1868 B9R0.6 C[C@@H](C(=O)O)N(C)CCO 321cb42b3f4d5036ff661e1050f70812 [0,2,0,0,0,0|1,0,0]=3 1869 B9R0.6 C[C@@H](C(=O)O)N(C)CCS 4a5a8539b9d5e852a5c8fd15b8863ea4 [0,2,0,0,0,0|1,0,0]=3 1870 B9R0.6 C[C@H](C(=O)N)N(C)CCF 47e660887463e676afac809079c73a36 [0,2,0,0,0,0|2,0,0]=4 1871 B9R0.6 C[C@H](C(=O)N)N(C)CCO ba7ea23b2b5c018c8b8840c41c3ef3c9 [0,2,0,0,0,0|2,0,0]=4 1872 B9R0.6 C[C@H](C(=O)O)N(C)CC#N aae78cc98a0218897e5ed6665231e2d5 [0,2,0,0,0,0|1,0,1]=4 1873 B9R0.6 C[C@H](C(=O)O)N(C)CC=O 85dec63ea36a36b9f66794dfff10523b [0,2,0,0,0,0|1,0,1]=4 1874 B9R0.6 C[C@H](C(=O)O)N(C)CCF ef3ec66328511d59c447568526ce02a1 [0,2,0,0,0,0|1,0,0]=3 1875 B9R0.6 C[C@H](C(=O)O)N(C)CCO 65459b20ae0e22507258b13b8a6201b1 [0,2,0,0,0,0|1,0,0]=3 1876 B9R0.6 C[C@H](C(=O)O)N(C)CCS 7304b6ec7cb9add7c3c1faf010cc60e8 [0,2,0,0,0,0|1,0,0]=3 1877 B9R0.27 C#CC(=O)N(C)C(C)CC 3b1cb0ba2560414dd952f5a9f7aec810 [0,2,0,0,0,0|2,0,0]=4 1878 B9R0.27 C=CC(=O)N(C)C(C)CC a677ec492c6555ab25d79cf2410fce86 [0,2,0,0,0,0|2,0,0]=4 1879 B9R0.27 CC(CO)N(C)C(=O)CO 0e0d41cd8235a5bb1e331b63041202cf [0,2,0,0,0,0|2,0,0]=4 1880 B9R0.27 CCC(=O)C(C)N(C)CC 80d04c9c6919b30b17f31203560fa1e5 [0,2,0,0,0,0|2,0,0]=4 1881 B9R0.27 CCC(=O)N(C)C(C)CC bde5342d9c864dc0699d63b7cff28f18 [0,2,0,0,0,0|2,0,0]=4 1882 B9R0.27 CCC(C)N(C)C(=O)C=O 10e0bf5a5249547d7a881a52aa31bf2d [0,2,0,0,0,0|1,0,1]=4 1883 B9R0.27 CCC(C)N(C)C(=O)CF e43dfa86386439596c426a66353ddcb0 [0,2,0,0,0,0|2,0,0]=4 1884 B9R0.27 CCC(C)N(C)C(=O)CO ef362ee6f991bb046944a1b9fa10b4f7 [0,2,0,0,0,0|1,0,0]=3 1885 B9R0.27 CCC(C)N(C)C(=O)CS 3757dadd571f58b805e75edc1a42e8db [0,2,0,0,0,0|1,1,0]=4 1886 B9R0.27 CCN(C)C(=O)C(=O)OC 356657e2714d07f9eafe225612663087 [0,2,0,0,0,0|1,0,1]=4 1887 B9R0.27 CCN(C)C(C)C(=O)NC 07964eb143b612726fe0fce8a508cb23 [0,2,0,0,0,0|2,0,0]=4 1888 B9R0.27 CCN(C)C(C)C(=O)OC 2ce66a10778347f29731811a6719d051 [0,2,0,0,0,0|1,0,0]=3 1889 B9R0.27 CCN(C)[C@@H](C)C(=O)OC 6d44433b9c40980fb7ee5f9a4bba1762 [0,2,0,0,0,0|1,0,0]=3 1890 B9R0.27 CCN(C)[C@H](C)C(=O)OC 66b78c8403f67c8c0912bf60edf2a5f6 [0,2,0,0,0,0|1,0,0]=3 1891 B9R0.27 COC(=O)C(C)N(C)CF 30dc338c99925ba3f8390d22507c7f66 [0,2,0,0,0,0|2,0,0]=4 1892 B9R0.27 COC(=O)C(C)N(C)CO 34ab813a548bcdd69a229f8ba1cde927 [0,2,0,0,0,0|2,0,0]=4 1893 B9R0.27 C[C@@H](CO)N(C)C(=O)CO 7f2a103be4c3380dd665fb78ca7a759e [0,2,0,0,0,0|2,0,0]=4 1894 B9R0.27 C[C@H](CO)N(C)C(=O)CO a01bd9532746c87410d1650810bb9b1f [0,2,0,0,0,0|2,0,0]=4 1895 B9R0.28 CCN(C)C(C)(C)C(=O)O 1e7680116e5aae1a3c72454887e9adcf [0,2,0,0,0,0|1,0,0]=3 1896 B9R0.28 CN(CF)C(C)(C)C(=O)O 63f00042f4f11eea0152cb8076c9036c [0,2,0,0,0,0|2,0,0]=4 1897 B9R0.28 CN(CO)C(C)(C)C(=O)O 0eb728d936ac185b6189d2299b5d327f [0,2,0,0,0,0|2,0,0]=4 1898 B9R0.29 CCC(C(=O)N)N(C)CC a0b5ed413496d5f723bff238156ad164 [0,2,0,0,0,0|2,0,0]=4 1899 B9R0.29 CCC(C(=O)O)N(C)CC c538e4ae24aa046d2fdd00f89123f5e1 [0,2,0,0,0,0|1,0,0]=3 1900 B9R0.29 CCN(C)C(CF)C(=O)O 50aa66999b6bb8755ee5455f2976838d [0,2,0,0,0,0|1,0,0]=3 1901 B9R0.29 CCN(C)C(CO)C(=O)O ab79be6b84ef910271315a0e4bf3fd4b [0,2,0,0,0,0|1,0,0]=3 1902 B9R0.29 CCN(C)[C@@H](CO)C(=O)O 4d23087bc5092b5eb7d30309317f714a [0,2,0,0,0,0|1,0,0]=3 1903 B9R0.29 CCN(C)[C@H](CO)C(=O)O c41ee58e427dee9f5257488488b326e5 [0,2,0,0,0,0|1,0,0]=3 1904 B9R0.29 CC[C@@H](C(=O)O)N(C)CC 930dcde365defb38750fba331d85d8d8 [0,2,0,0,0,0|1,0,0]=3 1905 B9R0.29 CC[C@@H](C(=O)O)N(C)CF ea4e660119149f896726d6e737437832 [0,2,0,0,0,0|2,0,0]=4 1906 B9R0.29 CC[C@@H](C(=O)O)N(C)CO fae2afed70cb93f8e439e6c6e3a18d7b [0,2,0,0,0,0|2,0,0]=4 1907 B9R0.29 CC[C@H](C(=O)O)N(C)CC 3fb76b84154a63fac65a55ab1fde4b7d [0,2,0,0,0,0|1,0,0]=3 1908 B9R0.29 CN(CF)C(CO)C(=O)O ac3156df1d1b4db14e09df76b099057d [0,2,0,0,0,0|2,0,0]=4 1909 B9R0.29 CN(CF)[C@@H](CO)C(=O)O d853899711a9d0acb207c5598e25dd49 [0,2,0,0,0,0|2,0,0]=4 1910 B9R0.29 CN(CF)[C@H](CO)C(=O)O 6e585aab916e9eee9aafdfe1f798deb1 [0,2,0,0,0,0|2,0,0]=4 1911 B9R0.29 CN(CO)C(CO)C(=O)O 04f3893027376334cc866c2531ad77be [0,2,0,0,0,0|2,0,0]=4 1912 B9R0.29 CN(CO)[C@@H](CO)C(=O)O 6f382b68e618b85fa27e92b855241f3b [0,2,0,0,0,0|2,0,0]=4 1913 B9R0.29 CN(CO)[C@H](CO)C(=O)O 83db36faa7573b1117281e20842bb034 [0,2,0,0,0,0|2,0,0]=4 1914 B9R0.32 CCC(C)(C)N(C)C(=O)C f2c4ae77096d94b88ddc69431025d77b [0,2,0,0,0,0|2,0,0]=4 1915 B9R0.41 CCC(CC)N(C)C(=O)C 05867eee83c6fc8b84fb88234814322e [0,2,0,0,0,0|2,0,0]=4 1916 B9R0.41 CCN(CC)C(C)C(=O)O d0101ec35a87cbc02df1bafa51ac3540 [0,2,0,0,0,0|1,0,0]=3 1917 B9R0.41 CCN(CC)[C@@H](C)C(=O)O b293752e872bff7809db3f4999e13ed4 [0,2,0,0,0,0|1,0,0]=3 1918 B9R0.41 CCN(CC)[C@H](C)C(=O)O 4fad9fcac6c0bafd99691a6eb1b0ba2a [0,2,0,0,0,0|1,0,0]=3 1919 B9R0.41 CCN(CF)C(C)C(=O)O 11187c55a9fa3a1f00ebca063e5eb7f5 [0,2,0,0,0,0|1,0,0]=3 1920 B9R0.41 CCN(CF)[C@@H](C)C(=O)O 0bb66ee39bc122d2eff8007852f955ea [0,2,0,0,0,0|1,0,0]=3 1921 B9R0.41 CCN(CF)[C@H](C)C(=O)O f3004c27813452be49a3cf5ee642d8cc [0,2,0,0,0,0|1,0,0]=3 1922 B9R0.41 CCN(CO)C(C)C(=O)O dcebe1327b88d91fbf46b604427648b3 [0,2,0,0,0,0|1,0,0]=3 1923 B9R0.41 CCN(CO)[C@@H](C)C(=O)O 2cf8e096294829744e401d0958772926 [0,2,0,0,0,0|1,0,0]=3 1924 B9R0.41 CCN(CO)[C@H](C)C(=O)O a98a367bfdf0574e9735d0d74e6e0690 [0,2,0,0,0,0|1,0,0]=3 1925 B9R0.79 CC(=O)C(C)N(C)C(C)C 671bf142c263466554d58da0036009a5 [0,2,0,0,0,0|2,0,0]=4 1926 B9R0.79 CC(=O)N(C)C(C)C(C)C 36fb0da84ce96436c1f6865fe92b6f6f [0,2,0,0,0,0|2,0,0]=4 1927 B9R0.79 CC(C)N(C)C(C)C(=O)N 0675d0f0926bd17bd5837ef1933daf76 [0,2,0,0,0,0|2,0,0]=4 1928 B9R0.79 CC(C)N(C)C(C)C(=O)O e86e3ef885a98e9581732e5b4fd4673a [0,2,0,0,0,0|1,0,0]=3 1929 B9R0.79 CC(C)N(C)[C@@H](C)C(=O)N 76b9e738bcd2d6424cf7ba5358b318f3 [0,2,0,0,0,0|2,0,0]=4 1930 B9R0.79 CC(C)N(C)[C@@H](C)C(=O)O 801e51c74bed5f1ec1af558778f654a6 [0,2,0,0,0,0|1,0,0]=3 1931 B9R0.79 CC(C)N(C)[C@H](C)C(=O)N 0bcd1554faa8672651c4dce38f8a1bbf [0,2,0,0,0,0|2,0,0]=4 1932 B9R0.79 CC(C)N(C)[C@H](C)C(=O)O 92464dee844224f6dd9bbc5f0671fad7 [0,2,0,0,0,0|1,0,0]=3 1933 B9R0.4 C#CCCN(C)CC(=O)N ffb92ca082473904c5a9de661209aa4d [0,2,0,0,0,0|2,0,0]=4 1934 B9R0.4 C#CCCN(C)CC(=O)O c342fc1eae056e6a4f78801859bc9f02 [0,2,0,0,0,0|1,0,0]=3 1935 B9R0.4 C#CCNC(C)CC(=O)O e88c4b46a26cab7526b69bf619ffd97e [0,2,0,0,0,0|0,0,1]=3 1936 B9R0.4 C#CCN[C@@H](C)CC(=O)O e4cbba3f0406b208247d46092df228cc [0,2,0,0,0,0|0,0,1]=3 1937 B9R0.4 C#CCN[C@H](C)CC(=O)O f96ee44735fe8a0a7543e042b18f148e [0,2,0,0,0,0|0,0,1]=3 1938 B9R0.4 C#CCOC(C)CC(=O)N 297069a57c4fd6a49064ef4741bbd3ab [0,2,0,0,0,0|1,0,1]=4 1939 B9R0.4 C#CCOC(C)CC(=O)O d03427f80a956cc816f509672bb000dc [0,2,0,0,0,0|0,0,1]=3 1940 B9R0.4 C#CCO[C@@H](C)CC(=O)O 44b33f5be83a64ff06d3732c99a80179 [0,2,0,0,0,0|0,0,1]=3 1941 B9R0.4 C#CCO[C@H](C)CC(=O)O 469413630488a2a850e98ad978ab272d [0,2,0,0,0,0|0,0,1]=3 1942 B9R0.4 C/C=C/CN(C)CC(=O)N 5c1d03b9691004adfeb8597fd2c2651e [0,2,0,0,0,0|2,0,0]=4 1943 B9R0.4 C/C=C/CN(C)CC(=O)O 23ac9de1d2dde35b4e407697595e4c31 [0,2,0,0,0,0|1,0,0]=3 1944 B9R0.4 C/C=C\CN(C)CC(=O)N db9f3367997a6188d0fa62544dca716a [0,2,0,0,0,0|2,0,0]=4 1945 B9R0.4 C/C=C\CN(C)CC(=O)O f33e8e9cccae63a33fb2ea55fc4083d8 [0,2,0,0,0,0|1,0,0]=3 1946 B9R0.4 C=CCCN(C)CC(=O)N 538baa8e2631c810024eff240ed3e05e [0,2,0,0,0,0|2,0,0]=4 1947 B9R0.4 C=CCCN(C)CC(=O)O c45dddea24cad7bcd2fe878b0aa2a882 [0,2,0,0,0,0|1,0,0]=3 1948 B9R0.4 C=CCNC(C)CC(=O)O 6ae10b64077133545f3d91156e398a8c [0,2,0,0,0,0|0,0,1]=3 1949 B9R0.4 C=CCN[C@@H](C)CC(=O)O e24fbde4dfaa347b67a58faa90e875fd [0,2,0,0,0,0|0,0,1]=3 1950 B9R0.4 C=CCN[C@H](C)CC(=O)O 68d1d33710689e20c468e0a1bf3fde2f [0,2,0,0,0,0|0,0,1]=3 1951 B9R0.4 C=CCOC(C)CC(=O)N 672a9e5f9e0304cb67614996d46bff59 [0,2,0,0,0,0|1,0,1]=4 1952 B9R0.4 C=CCOC(C)CC(=O)O 6aa6c0b2ae081456bfb4b15bc98ff0b4 [0,2,0,0,0,0|0,0,1]=3 1953 B9R0.4 C=CCO[C@@H](C)CC(=O)O 2f3de0688fccb90592132bae9389e4e8 [0,2,0,0,0,0|0,0,1]=3 1954 B9R0.4 C=CCO[C@H](C)CC(=O)O 82558ab3b4b44d284dc8a385450a58eb [0,2,0,0,0,0|0,0,1]=3 1955 B9R0.4 CC(=O)NC(C)CCCO a409476001ef0aff88161eb86bbe5db4 [0,2,0,0,0,0|2,0,0]=4 1956 B9R0.4 CC(=O)NC(C)COCF 43d67978ba504f4a6c3b09ca55c43049 [0,2,0,0,0,0|2,0,0]=4 1957 B9R0.4 CC(=O)N[C@H](C)CCCO 9a046063324b070dedfa3d3739745edc [0,2,0,0,0,0|2,0,0]=4 1958 B9R0.4 CC(=O)N[C@H](C)COCF 268619c282af458800db37ffa5982322 [0,2,0,0,0,0|2,0,0]=4 1959 B9R0.4 CC(=O)OC(C)NCCBr 3f1c204a59be950e15bd4feaa3675001 [0,2,0,0,0,0|2,0,0]=4 1960 B9R0.4 CC(=O)OC(C)NCCF 228736a205797ea15b61fd8e68b87e67 [0,2,0,0,0,0|2,0,0]=4 1961 B9R0.4 CC(=O)OC(C)NCCI c286c8d763aee4f3868d0f17a0d94c3b [0,2,0,0,0,0|2,0,0]=4 1962 B9R0.4 CC(=O)OC(C)NCCO ac5b0ecf8a083e3beb0c0204a7207851 [0,2,0,0,0,0|2,0,0]=4 1963 B9R0.4 CC(=O)OC(C)NCCS 7d5c0fa70919a52ddfecf5135d6ca3d7 [0,2,0,0,0,0|2,0,0]=4 1964 B9R0.4 CC(=O)OC(C)OCCF da7affa6b14ff4a99be2b6049cc00c20 [0,2,0,0,0,0|2,0,0]=4 1965 B9R0.4 CC(=O)OC(C)OCCS 4f606964d17daf8060dfd0795b3ba543 [0,2,0,0,0,0|2,0,0]=4 1966 B9R0.4 CC(CC(=O)N)OCC#N bef64d8d2e65945be57e557cbef5e6bf [0,2,0,0,0,0|1,0,1]=4 1967 B9R0.4 CC(CC(=O)N)OCC=O 32ab8c759e6f0a0d2dd587f467d7d0df [0,2,0,0,0,0|1,0,1]=4 1968 B9R0.4 CC(CC(=O)N)OCCF 33c76992ff5934781e3515f9fc43f0ec [0,2,0,0,0,0|1,0,0]=3 1969 B9R0.4 CC(CC(=O)N)OCCS b93b22eba38e053f131c509a795ffec2 [0,2,0,0,0,0|1,0,0]=3 1970 B9R0.4 CC(CC(=O)O)NCC#N b141632e27612f0c1515a54a70fedc87 [0,2,0,0,0,0|0,0,1]=3 1971 B9R0.4 CC(CC(=O)O)NCC=O 0b9db54dda8ed6cd9b17284ce8476910 [0,2,0,0,0,0|0,0,1]=3 1972 B9R0.4 CC(CC(=O)O)NCCBr e7e4b6e2fc1ea75d46b4b42316397fca [0,2,0,0,0,0|0,0,0]=2 1973 B9R0.4 CC(CC(=O)O)NCCF d1685d2be3fcc9d24c11d15d0d1d1325 [0,2,0,0,0,0|0,0,0]=2 1974 B9R0.4 CC(CC(=O)O)NCCI 94de66baab7b311efb40a9409058838e [0,2,0,0,0,0|0,0,0]=2 1975 B9R0.4 CC(CC(=O)O)NCCO 363ffb708fc7cb9d3ee89320c343223e [0,2,0,0,0,0|0,0,0]=2 1976 B9R0.4 CC(CC(=O)O)NCCS cdbc52c158398597a14b9e2a91a129d1 [0,2,0,0,0,0|0,0,0]=2 1977 B9R0.4 CC(CC(=O)O)OCC#N 21562a890821fc012e09d5d22bab806a [0,2,0,0,0,0|0,0,1]=3 1978 B9R0.4 CC(CC(=O)O)OCC=O 9fd72e4383abedaf34b13def7c8a057b [0,2,0,0,0,0|0,0,1]=3 1979 B9R0.4 CC(CC(=O)O)OCCF 9f416da46c9c293ab23e60b18d16f471 [0,2,0,0,0,0|0,0,0]=2 1980 B9R0.4 CC(CC(=O)O)OCCS 3dd9e26375cdcf4681c093bf5c86e3fc [0,2,0,0,0,0|0,0,0]=2 1981 B9R0.4 CC(C[N+](=O)[O-])OCCF 173e87b9653895d472eb881f891b5848 [0,2,0,0,0,0|1,0,1]=4 1982 B9R0.4 CC(C[N+](=O)[O-])OCCS 99a1d69d64f5d4ab7a66fa808c6cafe1 [0,2,0,0,0,0|1,0,1]=4 1983 B9R0.4 CC(O)CC(C)NCCF ae36b5c5f983d998c13f44a1f9b50d3f [0,2,0,0,0,0|1,0,1]=4 1984 B9R0.4 CC(O)CC(C)NCCO 18fd7bbc2d56fe18813d36c3680a81ca [0,2,0,0,0,0|1,0,1]=4 1985 B9R0.4 CC(O)CC(C)NCCS 1a6ee0ffaf1753805e716c45dc626efc [0,2,0,0,0,0|1,0,1]=4 1986 B9R0.4 CCCCC(C)NC(=O)C 8c6d1ed0c215b53ce5178d84ca54f179 [0,2,0,0,0,0|2,0,0]=4 1987 B9R0.4 CCCCN(C)CC(=O)N 11a1371995cbb23558bde2849897cd1f [0,2,0,0,0,0|2,0,0]=4 1988 B9R0.4 CCCCN(C)CC(=O)O 2ab0d2e55fe8aec010bf103a963bc69a [0,2,0,0,0,0|1,0,0]=3 1989 B9R0.4 CCCC[C@@H](C)NC(=O)C 438042d33778c53023e503021e96ec24 [0,2,0,0,0,0|2,0,0]=4 1990 B9R0.4 CCCNC(C)CC(=O)O 2d5bf9ae8b9d33e8e5f89637131f543d [0,2,0,0,0,0|0,0,0]=2 1991 B9R0.4 CCCNC(C)CC(C)O 98aedfcb0c4404029eedc1338854ce8c [0,2,0,0,0,0|1,0,1]=4 1992 B9R0.4 CCCNC(C)OC(=O)C 284b4f4f851898134a79c6bd0e68afcb [0,2,0,0,0,0|2,0,0]=4 1993 B9R0.4 CCCN[C@@H](C)CC(=O)O 7dd12827a70b6d0f3eb1d105dd87e0f1 [0,2,0,0,0,0|0,0,0]=2 1994 B9R0.4 CCCN[C@H](C)CC(=O)O 49558fe427823d5af7fc8494312831dd [0,2,0,0,0,0|0,0,0]=2 1995 B9R0.4 CCCOC(C)CC(=O)N 7cf4be07e7dc937d6ecb8463967854c0 [0,2,0,0,0,0|1,0,0]=3 1996 B9R0.4 CCCOC(C)CC(=O)O 464f5b57c4d27de1c96f770591eff582 [0,2,0,0,0,0|0,0,0]=2 1997 B9R0.4 CCCOC(C)C[N+](=O)[O-] ad8354c1f5266ca94ef2b943016280b5 [0,2,0,0,0,0|1,0,1]=4 1998 B9R0.4 CCCOC(C)OC(=O)C 6c8b7c881ac77e2983b8764698a63829 [0,2,0,0,0,0|2,0,0]=4 1999 B9R0.4 CCCO[C@@H](C)CC(=O)O 672c62b3f5b285724de30ca7be3b4175 [0,2,0,0,0,0|0,0,0]=2 2000 B9R0.4 CCCO[C@H](C)CC(=O)O 78d34951f815792f2a0561852a75d7ea [0,2,0,0,0,0|0,0,0]=2 2001 B9R0.4 CCNCC(O)CC(=O)O 02bb2a3b8bce33db43c21894720f909a [0,2,0,0,0,0|1,0,0]=3 2002 B9R0.4 CCNC[C@@H](O)CC(=O)O 54b4ddf2085c3305103a3bf1339d420e [0,2,0,0,0,0|1,0,0]=3 2003 B9R0.4 CCNC[C@H](O)CC(=O)O 4584b045ec61df30c14bf052bebdc4b7 [0,2,0,0,0,0|1,0,0]=3 2004 B9R0.4 CCOCC(C)NC(=O)C 891e676bd6e096c9e78b579a4d42a446 [0,2,0,0,0,0|2,0,0]=4 2005 B9R0.4 CCOCN(C)CC(=O)N 3f2fa03280875450069a7ca45bb5a142 [0,2,0,0,0,0|2,0,0]=4 2006 B9R0.4 CCOCN(C)CC(=O)O 4256c877b9befd6c7672b731e0ef19d3 [0,2,0,0,0,0|1,0,0]=3 2007 B9R0.4 CCOC[C@@H](C)NC(=O)C 82a9a914977322c59ad71ebab295e094 [0,2,0,0,0,0|2,0,0]=4 2008 B9R0.4 CN(C/C=C/Cl)CC(=O)O 4689186df77e5e3cf250ed6d1abfb9e4 [0,2,0,0,0,0|1,0,1]=4 2009 B9R0.4 CN(C/C=C\Cl)CC(=O)O ed5eebeb76ef47ceb6c288dd86ecbe90 [0,2,0,0,0,0|1,0,1]=4 2010 B9R0.4 CN(C/C=C\O)CC(=O)O b90536257896da311afd8c2f61e23b46 [0,2,0,0,0,0|1,0,1]=4 2011 B9R0.4 CN(CCC#N)CC(=O)N f1bc80122ea97472f442bb6c3371801a [0,2,0,0,0,0|2,0,0]=4 2012 B9R0.4 CN(CCC#N)CC(=O)O b6189c60dab8da7d0e37557ba3a3ab51 [0,2,0,0,0,0|1,0,0]=3 2013 B9R0.4 CN(CCC=O)CC(=O)N 2719b2bcf22ae4a90339a3f337017599 [0,2,0,0,0,0|2,0,0]=4 2014 B9R0.4 CN(CCC=O)CC(=O)O 59fa05e094f7be06a59bae3f1cb68898 [0,2,0,0,0,0|1,0,0]=3 2015 B9R0.4 CN(CCCF)CC(=O)N 1f272e5a874222b3e12c264d3c0393df [0,2,0,0,0,0|2,0,0]=4 2016 B9R0.4 CN(CCCF)CC(=O)O daae18585a4edad046d8e7cf5857ea62 [0,2,0,0,0,0|1,0,0]=3 2017 B9R0.4 CN(CCCO)CC(=O)N 2cf8473631d181ba7fe335e6287fbf91 [0,2,0,0,0,0|2,0,0]=4 2018 B9R0.4 CN(CCCO)CC(=O)O 92663a30e18fe103a2042493da2adef9 [0,2,0,0,0,0|1,0,0]=3 2019 B9R0.4 CN(CCCS)CC(=O)N de9d018ded98578e94220b2608394c9d [0,2,0,0,0,0|2,0,0]=4 2020 B9R0.4 CN(CCCS)CC(=O)O e6cefed2a7241559ae7d60ae4a2c5333 [0,2,0,0,0,0|1,0,0]=3 2021 B9R0.4 CN(CCON)CC(=O)N 28d0c9de11da53850ad47ae16fec7651 [0,2,0,0,0,0|2,0,0]=4 2022 B9R0.4 CN(CCON)CC(=O)O 9d7e8e288045c2c2df5e20efd431910a [0,2,0,0,0,0|1,0,0]=3 2023 B9R0.4 COCCN(C)CC(=O)N 448db3e3b58a5685e8588e13dc93be67 [0,2,0,0,0,0|2,0,0]=4 2024 B9R0.4 COCCN(C)CC(=O)O 3ec55bcb2ffdbac5ba2cd2153b901598 [0,2,0,0,0,0|1,0,0]=3 2025 B9R0.4 COCNC(C)CC(=O)O bdd3c4ac12ec667d560eb5ade66eadf9 [0,2,0,0,0,0|0,0,0]=2 2026 B9R0.4 COCNC(C)CC(C)O b72cc638063dacd99040bbb3ee8f0c35 [0,2,0,0,0,0|1,0,1]=4 2027 B9R0.4 COCN[C@@H](C)CC(=O)O 4b81306ee6db218e1b372a75a0b0c2f0 [0,2,0,0,0,0|0,0,0]=2 2028 B9R0.4 COCN[C@H](C)CC(=O)O 818aa4572c41952106f807fa5cf3ab38 [0,2,0,0,0,0|0,0,0]=2 2029 B9R0.4 COCOC(C)CC(=O)O e4795a30f6180746c828b10734be8c74 [0,2,0,0,0,0|0,0,0]=2 2030 B9R0.4 COCOC(C)OC(=O)C c73ebf630a8c2a58943bc42724d4d8d9 [0,2,0,0,0,0|2,0,0]=4 2031 B9R0.4 COCO[C@@H](C)CC(=O)O 49833e6f04b5f2fdf75e458c967a7948 [0,2,0,0,0,0|0,0,0]=2 2032 B9R0.4 COCO[C@H](C)CC(=O)O 765396246824776e46490c64897c4638 [0,2,0,0,0,0|0,0,0]=2 2033 B9R0.4 CSCCN(C)CC(=O)N 8e2d1a7102cd8411ae44c2d7e50835dd [0,2,0,0,0,0|2,0,0]=4 2034 B9R0.4 CSCCN(C)CC(=O)O 0f0cc55bdca109b4ba7871c4d09278eb [0,2,0,0,0,0|1,0,0]=3 2035 B9R0.4 CSCNC(C)CC(=O)O 4241a9c2ff111280db351016191e8370 [0,2,0,0,0,0|0,0,0]=2 2036 B9R0.4 CSCNC(C)CC(C)O 2b66378552c5acc5c37c9b56a8e745d5 [0,2,0,0,0,0|1,0,1]=4 2037 B9R0.4 CSCN[C@@H](C)CC(=O)O 726b4fd612fce34bc66b4c1104c65f69 [0,2,0,0,0,0|0,0,0]=2 2038 B9R0.4 CSCN[C@H](C)CC(=O)O 93bb6ece58999a9701d836c8d56af5da [0,2,0,0,0,0|0,0,0]=2 2039 B9R0.4 CSCOC(C)CC(=O)N af4c2afd288a15ee14238dc19e02472e [0,2,0,0,0,0|1,0,0]=3 2040 B9R0.4 CSCOC(C)CC(=O)O 8960316d76a52d36cff0632f6a8a6a82 [0,2,0,0,0,0|0,0,0]=2 2041 B9R0.4 CSCOC(C)C[N+](=O)[O-] 271bb6f38f4cbceb98d1bb0492c8e923 [0,2,0,0,0,0|1,0,1]=4 2042 B9R0.4 CSCO[C@@H](C)CC(=O)O 950648eb7385f49e6308659ead0c2a76 [0,2,0,0,0,0|0,0,0]=2 2043 B9R0.4 CSCO[C@H](C)CC(=O)O e5cb5d5e67dbe01167902ba3b365c14b [0,2,0,0,0,0|0,0,0]=2 2044 B9R0.4 C[C@@H](CC(=O)O)NCC#N 8535603aa506265d93611dda2c62f654 [0,2,0,0,0,0|0,0,1]=3 2045 B9R0.4 C[C@@H](CC(=O)O)NCC=O 61f815c552e042769d4d4f90edfce438 [0,2,0,0,0,0|0,0,1]=3 2046 B9R0.4 C[C@@H](CC(=O)O)NCCF 618a0c24e5c55843ce8edb4caec723f0 [0,2,0,0,0,0|0,0,0]=2 2047 B9R0.4 C[C@@H](CC(=O)O)NCCO f1302a077d62282b824321ee35a8059e [0,2,0,0,0,0|0,0,0]=2 2048 B9R0.4 C[C@@H](CC(=O)O)NCCS 5d7d40247ddb99f3d68b90786e69ddbb [0,2,0,0,0,0|0,0,0]=2 2049 B9R0.4 C[C@@H](CC(=O)O)OCC#N a1560da538dacec812ad2b648ec86ec5 [0,2,0,0,0,0|0,0,1]=3 2050 B9R0.4 C[C@@H](CC(=O)O)OCC=O afad9ddae2004cc03830c79908d592c0 [0,2,0,0,0,0|0,0,1]=3 2051 B9R0.4 C[C@@H](CC(=O)O)OCCF 5c0f2e4119dfa55ab335c16ab0367197 [0,2,0,0,0,0|0,0,0]=2 2052 B9R0.4 C[C@@H](CC(=O)O)OCCS 95108e5655092fc4113468a510808654 [0,2,0,0,0,0|0,0,0]=2 2053 B9R0.4 C[C@H](CC(=O)O)NCC#N 2c1f0cf9b9f687284995abb8dc7844fc [0,2,0,0,0,0|0,0,1]=3 2054 B9R0.4 C[C@H](CC(=O)O)NCC=O 8ad60e5c3f750e74022ec085d11788c1 [0,2,0,0,0,0|0,0,1]=3 2055 B9R0.4 C[C@H](CC(=O)O)NCCF 20751cb9b29a347f4c1a5217e86a8518 [0,2,0,0,0,0|0,0,0]=2 2056 B9R0.4 C[C@H](CC(=O)O)NCCO 5a022e1cde4048f3a447d9f460edd75d [0,2,0,0,0,0|0,0,0]=2 2057 B9R0.4 C[C@H](CC(=O)O)NCCS 0e4f4fa60a5012cf1fca3e5091c18f41 [0,2,0,0,0,0|0,0,0]=2 2058 B9R0.4 C[C@H](CC(=O)O)OCC#N cef74b7d39d1261d6940bb08c5c2b71a [0,2,0,0,0,0|0,0,1]=3 2059 B9R0.4 C[C@H](CC(=O)O)OCC=O 5898615cb0e02bab189a5a3da6d20aec [0,2,0,0,0,0|0,0,1]=3 2060 B9R0.4 C[C@H](CC(=O)O)OCCF f5b48f7a21ef3e4b18c68d6fc0bb22c6 [0,2,0,0,0,0|0,0,0]=2 2061 B9R0.4 C[C@H](CC(=O)O)OCCS a1e94870d79cddf896a1bd4028514c04 [0,2,0,0,0,0|0,0,0]=2 2062 B9R0.4 O=C(O)CC(O)CNCF 9de17aeb8156f9b30eae4a928d55d408 [0,2,0,0,0,0|1,0,0]=3 2063 B9R0.4 O=C(O)CC(O)CNCO d51ade6d66756563bbc84453fda67d62 [0,2,0,0,0,0|1,0,0]=3 2064 B9R0.4 O=C(O)C[C@@H](O)CNCF e06fd31c8d2997a1f63214946e26a10a [0,2,0,0,0,0|1,0,0]=3 2065 B9R0.4 O=C(O)C[C@@H](O)CNCO aa032d8b3fc8a184994c5d27aeeb5075 [0,2,0,0,0,0|1,0,0]=3 2066 B9R0.4 O=C(O)C[C@H](O)CNCF 8c3349543124a531516a5ca6a55a4ab6 [0,2,0,0,0,0|1,0,0]=3 2067 B9R0.4 O=C(O)C[C@H](O)CNCO 19fadec569eb61b632db1521edc1b9f2 [0,2,0,0,0,0|1,0,0]=3 2068 B9R0.14 C#CCN(CC)CC(=O)O 44e7a6faefe5ff13b678cc32158fde22 [0,2,0,0,0,0|1,0,0]=3 2069 B9R0.14 C#CCN(CF)CC(=O)O 3760c3903903d587c43dde67774fcacb [0,2,0,0,0,0|1,0,1]=4 2070 B9R0.14 C#CCN(CO)CC(=O)O d1523b40ec467512318fa46142db549b [0,2,0,0,0,0|1,0,1]=4 2071 B9R0.14 C=CCN(CC)CC(=O)O 8a2022935676f2fe3b417e9ee3e3ec70 [0,2,0,0,0,0|1,0,0]=3 2072 B9R0.14 CC(=O)NC(CO)CCO 2ca85a82cbe9cc591bc306e37053f306 [0,2,0,0,0,0|2,0,0]=4 2073 B9R0.14 CC(=O)N[C@@H](CO)CCO 120a9546a4368a319df273961922dccd [0,2,0,0,0,0|2,0,0]=4 2074 B9R0.14 CCC(CC#N)NC(=O)C 9e00c37846b0ea1d12d2885e437e46ca [0,2,0,0,0,0|2,0,0]=4 2075 B9R0.14 CCC(CC(=O)O)NCF c8416d3387249110d906445dfd47021b [0,2,0,0,0,0|0,0,0]=2 2076 B9R0.14 CCC(CC(=O)O)NCO 854a3f707e850876fb09e8e934a0addc [0,2,0,0,0,0|0,0,0]=2 2077 B9R0.14 CCC(CC(=O)O)OCF 468103e807211f2b09b87714cb52c75b [0,2,0,0,0,0|0,0,0]=2 2078 B9R0.14 CCC(COC)NC(=O)C 33391342a5047426c06babf996f3c088 [0,2,0,0,0,0|2,0,0]=4 2079 B9R0.14 CCCC(CO)NC(=O)C f3bf17abc83f73293b80dc3dfcb282f9 [0,2,0,0,0,0|2,0,0]=4 2080 B9R0.14 CCCN(CC)CC(=O)N 9bf9e40bad95314a8a84e74e0471e384 [0,2,0,0,0,0|2,0,0]=4 2081 B9R0.14 CCCN(CC)CC(=O)O 3343166bff6a93f1a85ce8253803b19e [0,2,0,0,0,0|1,0,0]=3 2082 B9R0.14 CCCN(CF)CC(=O)O 21355191fdc7ce92b7c643dead498d77 [0,2,0,0,0,0|1,0,0]=3 2083 B9R0.14 CCCN(CO)CC(=O)O a14f517247eea95393f8f124f075bdf9 [0,2,0,0,0,0|1,0,0]=3 2084 B9R0.14 CCC[C@@H](CO)NC(=O)C 1f7828ff873e7c1f12c0daf2d17463c6 [0,2,0,0,0,0|2,0,0]=4 2085 B9R0.14 CCC[C@H](CO)NC(=O)C da4d526e59be455b3e6f6ae6f972462b [0,2,0,0,0,0|2,0,0]=4 2086 B9R0.14 CCN(CC#N)CC(=O)N c2cec2a49ed665b0caa30d2b082e8d57 [0,2,0,0,0,0|2,0,0]=4 2087 B9R0.14 CCN(CC#N)CC(=O)O dbce1b8bf73fc16fc9690210930231a9 [0,2,0,0,0,0|1,0,0]=3 2088 B9R0.14 CCN(CC=O)CC(=O)O 7f5cd95513b3aca957092871375195a5 [0,2,0,0,0,0|1,0,0]=3 2089 B9R0.14 CCN(CCCl)CC(=O)N 47f82dee4e0cfa390585a7f5ef96cc12 [0,2,0,0,0,0|2,0,0]=4 2090 B9R0.14 CCN(CCCl)CC(=O)O 403f715f5c6fe36d21bf6c5696a15127 [0,2,0,0,0,0|1,0,0]=3 2091 B9R0.14 CCN(CCF)CC(=O)O 9363597ee4b976e54757cc5583545bd2 [0,2,0,0,0,0|1,0,0]=3 2092 B9R0.14 CCN(CCO)CC(=O)N b8d94447d9ac81fefa8bbdb2bab37eb6 [0,2,0,0,0,0|2,0,0]=4 2093 B9R0.14 CCN(CCO)CC(=O)O a910f1ae38fa7155c7b0579d5026162e [0,2,0,0,0,0|1,0,0]=3 2094 B9R0.14 CCN(CCS)CC(=O)O 6ec05f62d2e444c0ffbe9eee263c8a2c [0,2,0,0,0,0|1,0,0]=3 2095 B9R0.14 CCN(COC)CC(=O)O 396b8dfa8e235ba68ab33cc02ba85b2f [0,2,0,0,0,0|1,0,0]=3 2096 B9R0.14 CCN(CSC)CC(=O)O b9cab41d30c096602678e37256675821 [0,2,0,0,0,0|1,0,0]=3 2097 B9R0.14 CCNC(CC)CC(=O)O 46b3094fad7cebceb8943df84913f37e [0,2,0,0,0,0|0,0,0]=2 2098 B9R0.14 CCNC(CO)CC(=O)O de42f1ec16e1fb0c1f9931b1f91f5c75 [0,2,0,0,0,0|0,0,0]=2 2099 B9R0.14 CCN[C@@H](CC)CC(=O)O 21df25326eabd4481a004736f4916afa [0,2,0,0,0,0|0,0,0]=2 2100 B9R0.14 CCN[C@@H](CO)CC(=O)O 4c04f88414ade284e774f0dd3cf1d8d4 [0,2,0,0,0,0|0,0,0]=2 2101 B9R0.14 CCN[C@H](CC)CC(=O)O a15a38745d4cdc3a3747943041323451 [0,2,0,0,0,0|0,0,0]=2 2102 B9R0.14 CCN[C@H](CO)CC(=O)O a308a18a97c9f53f7fd9fcb31e04fbd8 [0,2,0,0,0,0|0,0,0]=2 2103 B9R0.14 CCOC(CC)CC(=O)O 067fe73a7b822a47a7ba0f3d160fbef0 [0,2,0,0,0,0|0,0,0]=2 2104 B9R0.14 CCO[C@@H](CC)CC(=O)O 33e42c57d3d148d94f92e79e109828f9 [0,2,0,0,0,0|0,0,0]=2 2105 B9R0.14 CCO[C@H](CC)CC(=O)O 455a3fd4e9034df148e3bfd48e87cfe6 [0,2,0,0,0,0|0,0,0]=2 2106 B9R0.14 CC[C@@H](CC#N)NC(=O)C cd9ece3877b2a08da518d74802aea068 [0,2,0,0,0,0|2,0,0]=4 2107 B9R0.14 CC[C@@H](CC(=O)O)NCF 2b6e17b5c5543b7aef94a495b74ba341 [0,2,0,0,0,0|0,0,0]=2 2108 B9R0.14 CC[C@@H](CC(=O)O)NCO 8aae4f0e6ae84c7880313232076671d3 [0,2,0,0,0,0|0,0,0]=2 2109 B9R0.14 CC[C@@H](CC(=O)O)OCF a3bfff8ada89b4fc30e51ffe3516e980 [0,2,0,0,0,0|0,0,0]=2 2110 B9R0.14 CC[C@H](CC#N)NC(=O)C 13bc2826bad75097764539d89159cbc1 [0,2,0,0,0,0|2,0,0]=4 2111 B9R0.14 CC[C@H](CC(=O)O)NCF 4e32572c5ac7213e41a4a7032c96c0a8 [0,2,0,0,0,0|0,0,0]=2 2112 B9R0.14 CC[C@H](CC(=O)O)NCO fcd4074b59e4e3418d62793abb6ab9e1 [0,2,0,0,0,0|0,0,0]=2 2113 B9R0.14 CC[C@H](CC(=O)O)OCF 6ffc009862a12455bfd233e2a3930c6c [0,2,0,0,0,0|0,0,0]=2 2114 B9R0.14 COCC(CO)NC(=O)C 4af97eace3aa2ab3670eea26459a3b10 [0,2,0,0,0,0|2,0,0]=4 2115 B9R0.14 CSCC(CO)NC(=O)C 5371a65779c19ffcb4bdce7024de7c98 [0,2,0,0,0,0|2,0,0]=4 2116 B9R0.14 NC(=O)CN(CO)CCO ed2efa26d022fe412f21de78a50e010f [0,2,0,0,0,0|2,0,0]=4 2117 B9R0.14 O=C(O)CC(CO)NCF d868a67ad17b2ba73c7196121d8595d2 [0,2,0,0,0,0|1,0,0]=3 2118 B9R0.14 O=C(O)CC(CO)NCO 2421ad8190ddf6be09dd84a049df16b7 [0,2,0,0,0,0|1,0,0]=3 2119 B9R0.14 O=C(O)CN(CF)CCO baf48b2902b74d482cb2bc2e8eafd3f9 [0,2,0,0,0,0|1,0,0]=3 2120 B9R0.14 O=C(O)CN(CO)CCO ff99656facc30a5de7e795faadbd43ba [0,2,0,0,0,0|1,0,0]=3 2121 B9R0.14 O=C(O)C[C@@H](CO)NCF 3ead710aa9b1f38be25e9a5df8bfb86a [0,2,0,0,0,0|1,0,0]=3 2122 B9R0.14 O=C(O)C[C@@H](CO)NCO 85d31f6650b2aea90a9f2b7d501c474f [0,2,0,0,0,0|1,0,0]=3 2123 B9R0.14 O=C(O)C[C@H](CO)NCF 67bbe1bf3929fcdaf15089f77de15dd0 [0,2,0,0,0,0|1,0,0]=3 2124 B9R0.14 O=C(O)C[C@H](CO)NCO c8916738da5cc0d97bcb967090995c68 [0,2,0,0,0,0|1,0,0]=3 2125 B9R0.34 C#CC(=O)NC(C)CCC 9ef6b2a06bd3e21b68b6e6b9a4d6e65c [0,2,0,0,0,0|2,0,0]=4 2126 B9R0.34 C#CC(=O)NC(C)CCO 5fb27ea3eb214df2cc66bcd5018de573 [0,2,0,0,0,0|2,0,0]=4 2127 B9R0.34 C#CC(=O)NC(C)COC 661013f0345457a8b039663bd38d9022 [0,2,0,0,0,0|2,0,0]=4 2128 B9R0.34 C#CC(=O)N[C@@H](C)CCC c9717a49753ea79f46cf92ea3c41222f [0,2,0,0,0,0|2,0,0]=4 2129 B9R0.34 C#CC(=O)N[C@@H](C)CCO a146525047b009699a3d26760406fe78 [0,2,0,0,0,0|2,0,0]=4 2130 B9R0.34 C#CC(=O)N[C@@H](C)COC 715f707c4bf77843923547a71ca1c6e9 [0,2,0,0,0,0|2,0,0]=4 2131 B9R0.34 C#CC(=O)N[C@H](C)CCO 6909bed6885e23f8807e434dea95cbf5 [0,2,0,0,0,0|2,0,0]=4 2132 B9R0.34 C#CC(=O)N[C@H](C)COC b3d460a5ec2985e230dceda798eb561c [0,2,0,0,0,0|2,0,0]=4 2133 B9R0.34 C#CCC(=O)NC(C)CC bffac230516b69f07e55458af18ae886 [0,2,0,0,0,0|2,0,0]=4 2134 B9R0.34 C#CCC(=O)N[C@@H](C)CC 61cf60be0e9dd523f51792d63ff04307 [0,2,0,0,0,0|2,0,0]=4 2135 B9R0.34 C#CCC(=O)N[C@H](C)CC d045b2667aebc15f587d19796c3488ed [0,2,0,0,0,0|2,0,0]=4 2136 B9R0.34 C#CCN(C)CC(=O)CO f6c0231747fdd1f048f841fc3bbadce6 [0,2,0,0,0,0|1,0,1]=4 2137 B9R0.34 C#CCN(C)CC(=O)OC bec8bb6e750bee07ee53d35c56adbcd3 [0,2,0,0,0,0|1,0,1]=4 2138 B9R0.34 C/C=C/C(=O)NC(C)CC 27ed765dfbe6637d2f6dd85e1b2d3cc1 [0,2,0,0,0,0|2,0,0]=4 2139 B9R0.34 C/C=C/C(=O)N[C@@H](C)CC 6f7587f0ac9fc3820297fcd97d2898a8 [0,2,0,0,0,0|2,0,0]=4 2140 B9R0.34 C/C=C/C(=O)N[C@H](C)CC f5f16f18488c967735ac4e6c51c5f813 [0,2,0,0,0,0|2,0,0]=4 2141 B9R0.34 C=C(C=O)OC(C)CCC 979f90834a5eca82fa0a112573062881 [0,2,0,0,0,0|2,0,0]=4 2142 B9R0.34 C=C(C=O)OC(C)COC 1d97b37a7578d82741e578e0db2ef36e [0,2,0,0,0,0|2,0,0]=4 2143 B9R0.34 C=C(CN(C)CCC)OC 4b1347482598cf292a1ac84b6f7cec98 [0,2,0,0,0,0|2,0,0]=4 2144 B9R0.34 C=C(CN(C)CCF)OC 7dda8392f8b3b89fd1186da92ad4d88b [0,2,0,0,0,0|2,0,0]=4 2145 B9R0.34 C=C(CN(C)CCO)OC 568b78cd61cfbd49833fe7639ad205cc [0,2,0,0,0,0|2,0,0]=4 2146 B9R0.34 C=C(CO)CN(C)CCC 517b6ab86ed3cd7a6be3ba32d3b63364 [0,2,0,0,0,0|2,0,0]=4 2147 B9R0.34 C=C(CO)CN(C)CCF 9fbe2a9be3a9700953332edf87564d59 [0,2,0,0,0,0|2,0,0]=4 2148 B9R0.34 C=C(CO)CN(C)CCO 368ef44eeffeeda64889fd2f1553f39b [0,2,0,0,0,0|2,0,0]=4 2149 B9R0.34 C=CC(=O)NC(C)CCC 5ac77412dce7bf0021b564aebcc19f5a [0,2,0,0,0,0|2,0,0]=4 2150 B9R0.34 C=CC(=O)NC(C)CCO ad2e9774473b75af208003aa0540eccf [0,2,0,0,0,0|2,0,0]=4 2151 B9R0.34 C=CC(=O)NC(C)COC 21c2ee0b68b9aeded2d38719f7e2f491 [0,2,0,0,0,0|2,0,0]=4 2152 B9R0.34 C=CC(=O)N[C@@H](C)CCC 679261b3434e976ef3fab88d3604d028 [0,2,0,0,0,0|2,0,0]=4 2153 B9R0.34 C=CC(=O)N[C@@H](C)CCO de81f2e0244b795f631d2a322e51316b [0,2,0,0,0,0|2,0,0]=4 2154 B9R0.34 C=CC(=O)N[C@@H](C)COC c167ba499b81471d2a1d90c284791358 [0,2,0,0,0,0|2,0,0]=4 2155 B9R0.34 C=CC(=O)N[C@H](C)CCO 917f194ba1c773997180ace42f828825 [0,2,0,0,0,0|2,0,0]=4 2156 B9R0.34 C=CC(=O)N[C@H](C)COC b32d325b973567a1e283d201b1875276 [0,2,0,0,0,0|2,0,0]=4 2157 B9R0.34 C=CCC(=O)NC(C)CC ca2e07c3083949b732403cf0f9aa0d1a [0,2,0,0,0,0|2,0,0]=4 2158 B9R0.34 C=CCC(=O)N[C@@H](C)CC 0be7b6cc15cd85e44e462da3d08151b5 [0,2,0,0,0,0|2,0,0]=4 2159 B9R0.34 C=CCC(=O)N[C@H](C)CC ef34aa7458e34105535e8c727cf1bf77 [0,2,0,0,0,0|2,0,0]=4 2160 B9R0.34 C=CCN(C)CC(=O)CO cda688febc42dd55dbe3bd832c0e687b [0,2,0,0,0,0|1,0,1]=4 2161 B9R0.34 C=CCN(C)CC(=O)OC f2e9736a5a1e55a617f4ebb315071d59 [0,2,0,0,0,0|1,0,1]=4 2162 B9R0.34 C=COC(=O)CN(C)CC c2a2929197fbfc522f555aa4d9d6ba1c [0,2,0,0,0,0|1,0,0]=3 2163 B9R0.34 CC#CC(=O)NC(C)CC 57fb25605d1190ef667789df2d6ab309 [0,2,0,0,0,0|2,0,0]=4 2164 B9R0.34 CC#CC(=O)N[C@@H](C)CC 5e05c0b5573d9725d75126477e2a2890 [0,2,0,0,0,0|2,0,0]=4 2165 B9R0.34 CC#CC(=O)N[C@H](C)CC f028830b4a900d3b4bfcf3a3e0030821 [0,2,0,0,0,0|2,0,0]=4 2166 B9R0.34 CC(CC#N)NC(=O)CO 24fa7109777a9284fc41612ab64874d3 [0,2,0,0,0,0|1,0,1]=4 2167 B9R0.34 CC(CCO)NC(=O)C=O d8e672fa6e85dba5b6356f3f455ae6ed [0,2,0,0,0,0|1,0,1]=4 2168 B9R0.34 CC(CCO)NC(=O)CF addcb767053ed3d6461a0258663939dd [0,2,0,0,0,0|2,0,0]=4 2169 B9R0.34 CC(CCO)NC(=O)CO 0427225a7df4f14d3ecf575fbe1c2ca8 [0,2,0,0,0,0|1,0,0]=3 2170 B9R0.34 CC(CCO)NC(=O)CS 36d7e03a5d1c1fe348a7804019d7d313 [0,2,0,0,0,0|1,1,0]=4 2171 B9R0.34 CC(CO)NC(=O)CCO 1451167c210ea4ff78e1c778fbc93664 [0,2,0,0,0,0|2,0,0]=4 2172 B9R0.34 CC(CO)NC(=O)CON 8591f0d03f0708dd9292c79fb81e3315 [0,2,0,0,0,0|2,0,0]=4 2173 B9R0.34 CCC(=O)CN(C)CCF 7585e37b63bdbb92e00fd42e9b5b75a3 [0,2,0,0,0,0|2,0,0]=4 2174 B9R0.34 CCC(=O)CN(C)CCO 89e8f518682c803ef78fe38f0dbad88f [0,2,0,0,0,0|2,0,0]=4 2175 B9R0.34 CCC(=O)NC(C)CCO a883fc34859346abd88179101d515e1d [0,2,0,0,0,0|2,0,0]=4 2176 B9R0.34 CCC(=O)NC(C)COC 9d038691261b178e2c31a5ae222e85e5 [0,2,0,0,0,0|2,0,0]=4 2177 B9R0.34 CCC(=O)N[C@@H](C)CCO f39b1caa19cceb4e390c6db1cb780fdc [0,2,0,0,0,0|2,0,0]=4 2178 B9R0.34 CCC(=O)N[C@@H](C)COC 18b9f52b18f606df44997eabf4ae8872 [0,2,0,0,0,0|2,0,0]=4 2179 B9R0.34 CCC(=O)N[C@H](C)CCO b8d67ac64c2350c7e7098139ad8e20ec [0,2,0,0,0,0|2,0,0]=4 2180 B9R0.34 CCC(=O)N[C@H](C)COC 4456c5ca59fc7a24d1313850c49ec7c2 [0,2,0,0,0,0|2,0,0]=4 2181 B9R0.34 CCC(C)CC(=O)NC#N ab71259e4afcb8d65c8ad3eb02f5d0f6 [0,2,0,0,0,0|1,0,0]=3 2182 B9R0.34 CCC(C)CC(C)NC=O da1680796a95364ea1511cef23b93312 [0,2,0,0,0,0|1,0,1]=4 2183 B9R0.34 CCC(C)CC(C)NCO 6392937f8c561eb019a1c5af1135dd1e [0,2,0,0,0,0|1,0,1]=4 2184 B9R0.34 CCC(C)CN(C)CCO ad8bab7a17c4600f433244b3a8af00cc [0,2,0,0,0,0|2,0,0]=4 2185 B9R0.34 CCC(C)NC(=O)/C=C/Br 2741422c12c350ef40d7a7f1b26f57d4 [0,2,0,0,0,0|2,0,0]=4 2186 B9R0.34 CCC(C)NC(=O)/C=C/Cl 2923aeaefb4c523d2525081498e38c12 [0,2,0,0,0,0|2,0,0]=4 2187 B9R0.34 CCC(C)NC(=O)/C=C/I aec0b2ca433ae41a355a4ce249d76210 [0,2,0,0,0,0|2,0,0]=4 2188 B9R0.34 CCC(C)NC(=O)/C=C\Br 16bfbd81a02776e6ea92b3eba9b0992d [0,2,0,0,0,0|2,0,0]=4 2189 B9R0.34 CCC(C)NC(=O)/C=C\Cl 5566377e714a3d081e8448354ce36d45 [0,2,0,0,0,0|2,0,0]=4 2190 B9R0.34 CCC(C)NC(=O)/C=C\I 7ba0fdc1509dc73d81c521951a478ac8 [0,2,0,0,0,0|2,0,0]=4 2191 B9R0.34 CCC(C)NC(=O)C#CBr d2afba9c4bd1eb09ef4814c3a5665300 [0,2,0,0,0,0|2,0,0]=4 2192 B9R0.34 CCC(C)NC(=O)C=CBr 7947a9686ce4adb3a48d469bceed049a [0,2,0,0,0,0|2,0,0]=4 2193 B9R0.34 CCC(C)NC(=O)C=CI 5ab2d321054e9cead14a4baab3dd97ff [0,2,0,0,0,0|2,0,0]=4 2194 B9R0.34 CCC(C)NC(=O)CC#N 8bb3949a96378a08bf9a293e2a6b44c0 [0,2,0,0,0,0|2,0,0]=4 2195 B9R0.34 CCC(C)NC(=O)CC=O fffc9cdc89eb43b42d452f7441f6b359 [0,2,0,0,0,0|1,0,1]=4 2196 B9R0.34 CCC(C)NC(=O)CCF 897d964ca2cc8eb712029dcd0ee6bf63 [0,2,0,0,0,0|2,0,0]=4 2197 B9R0.34 CCC(C)NC(=O)CCO b962fc4e6619b7e10119a59a59b706c4 [0,2,0,0,0,0|1,0,0]=3 2198 B9R0.34 CCC(C)NC(=O)CCS 51871ba438815abf0ae6af354e3928c6 [0,2,0,0,0,0|1,1,0]=4 2199 B9R0.34 CCC(C)NC(=O)COC 16f2a377fe0f0e899c23e3908d3f7f10 [0,2,0,0,0,0|1,0,0]=3 2200 B9R0.34 CCC(C)NC(=O)CON e2775deb16c0ed03adc135dc71beb963 [0,2,0,0,0,0|1,0,0]=3 2201 B9R0.34 CCC(C)NC(=O)CSC 79abb5b7e7689915212f24e1f515bb8b [0,2,0,0,0,0|1,1,0]=4 2202 B9R0.34 CCC(C)NC(=O)NC#N eea8328078c7f03b66486e70a36b8135 [0,2,0,0,0,0|2,0,0]=4 2203 B9R0.34 CCC(O)CC(=O)NC#N 7e79ca8a9bb6029f57a7113f4c4d3ab3 [0,2,0,0,0,0|2,0,0]=4 2204 B9R0.34 CCCC(=O)CN(C)CC aab50acb4edd8cca9877e21b8238cd5a [0,2,0,0,0,0|2,0,0]=4 2205 B9R0.34 CCCC(=O)NC(C)CC 38c367e96c0a19794c8b20cd2fb7c376 [0,2,0,0,0,0|2,0,0]=4 2206 B9R0.34 CCCC(=O)N[C@@H](C)CC efc6625fdae8a77efd786fcb0643e4e6 [0,2,0,0,0,0|2,0,0]=4 2207 B9R0.34 CCCC(=O)N[C@H](C)CC 25ef63beafef1f6530659eafa2b0dfe9 [0,2,0,0,0,0|2,0,0]=4 2208 B9R0.34 CCCC(C)NC(=O)C=O dc38ba5950699f1803639c5140fa8f50 [0,2,0,0,0,0|1,0,1]=4 2209 B9R0.34 CCCC(C)NC(=O)CC 1c5e7d013b6d8314fad6ff12635fab4a [0,2,0,0,0,0|2,0,0]=4 2210 B9R0.34 CCCC(C)NC(=O)CF cd7744f1d589c1a7b205a0234a07d025 [0,2,0,0,0,0|2,0,0]=4 2211 B9R0.34 CCCC(C)NC(=O)CO 984314b099c12612925dab4544371cf9 [0,2,0,0,0,0|1,0,0]=3 2212 B9R0.34 CCCC(C)NC(=O)CS 3bb1ac3eb0af8520569c681c11dd1e08 [0,2,0,0,0,0|1,1,0]=4 2213 B9R0.34 CCCN(C)CC(=O)CC c80c7d6de1d5253ede7d75a7d9fc6b4c [0,2,0,0,0,0|2,0,0]=4 2214 B9R0.34 CCCN(C)CC(=O)CO 1841a828916dd36659413f240ce49dae [0,2,0,0,0,0|1,0,0]=3 2215 B9R0.34 CCCN(C)CC(=O)NC d85e1507ae005559e38ddcbdbef008c1 [0,2,0,0,0,0|2,0,0]=4 2216 B9R0.34 CCCN(C)CC(=O)OC c724ec5b9ab34c00a457a6a511b7bf14 [0,2,0,0,0,0|1,0,0]=3 2217 B9R0.34 CCC[C@H](C)NC(=O)C=O 81441a404e2525c1e98a6c56f6b1e7e7 [0,2,0,0,0,0|1,0,1]=4 2218 B9R0.34 CCC[C@H](C)NC(=O)CC ad5f66cc617489af6f8b7c428b7d7795 [0,2,0,0,0,0|2,0,0]=4 2219 B9R0.34 CCC[C@H](C)NC(=O)CF dfb674c0934ab272546ec19a7393ba83 [0,2,0,0,0,0|2,0,0]=4 2220 B9R0.34 CCC[C@H](C)NC(=O)CO d75a0e1acfe3e1874736f9eab8d0c961 [0,2,0,0,0,0|1,0,0]=3 2221 B9R0.34 CCC[C@H](C)NC(=O)CS b9cba590ec9acd80841d765b6372692b [0,2,0,0,0,0|1,1,0]=4 2222 B9R0.34 CCN(C)CC(=O)COC c71c185d9ff1671c026b501ccf0bd57f [0,2,0,0,0,0|1,0,0]=3 2223 B9R0.34 CCN(C)CC(=O)NC#N ea75e16c3c1090e6b445ca73aa92debd [0,2,0,0,0,0|2,0,0]=4 2224 B9R0.34 CCN(C)CC(=O)NCO 55b96fe8f7a60ce60acb3bd37562cf98 [0,2,0,0,0,0|1,0,0]=3 2225 B9R0.34 CCNC(=O)CN(C)CC 59c656345bbe98dac68b6425a09efbe0 [0,2,0,0,0,0|2,0,0]=4 2226 B9R0.34 CCNC(C)CC(=O)OC 8f5a36e5208499c391d24b252a12bf38 [0,2,0,0,0,0|0,0,0]=2 2227 B9R0.34 CCN[C@@H](C)CC(=O)OC 9e23f1bf52061ebf026cb501e421df05 [0,2,0,0,0,0|0,0,0]=2 2228 B9R0.34 CCN[C@H](C)CC(=O)OC 996cd301be79ec168f4649523ee618f0 [0,2,0,0,0,0|0,0,0]=2 2229 B9R0.34 CCOC(=O)CN(C)CC a8474fa2e310db8d1704be7deba7f938 [0,2,0,0,0,0|1,0,0]=3 2230 B9R0.34 CCOC(C)CC(=O)OC bb8935a6b3f2527590add1883d9af4ba [0,2,0,0,0,0|0,0,0]=2 2231 B9R0.34 CCOC(C)CC(C)OC 75f20277cb944ba5164a781b25ba2a9e [0,2,0,0,0,0|1,0,1]=4 2232 B9R0.34 CCOC(C)CN(C)C=O 9c84bdcef60f94191a71a98ae2651424 [0,2,0,0,0,0|2,0,0]=4 2233 B9R0.34 CCOC(C)CN(C)CO 87cd0c6e2fcd7bb8782b569d33e00af4 [0,2,0,0,0,0|2,0,0]=4 2234 B9R0.34 CCO[C@@H](C)CC(=O)OC aac0a176fbc44f8c523dab5a743853de [0,2,0,0,0,0|0,0,0]=2 2235 B9R0.34 CCO[C@H](C)CC(=O)OC 3c6c55836fc2ed2696b0ec29d17e7dcf [0,2,0,0,0,0|0,0,0]=2 2236 B9R0.34 CC[C@@H](C)CC(=O)NC#N 1208e171c0b9b0d582b3f977be9440c6 [0,2,0,0,0,0|1,0,0]=3 2237 B9R0.34 CC[C@@H](C)CN(C)CCO 72c0ef13ecc3940cde1b3056b77537f7 [0,2,0,0,0,0|2,0,0]=4 2238 B9R0.34 CC[C@@H](C)NC(=O)/C=C/Br b8a5b2aefa05a896408b008e6221e7a5 [0,2,0,0,0,0|2,0,0]=4 2239 B9R0.34 CC[C@@H](C)NC(=O)/C=C/Cl f924bedd58207bbd10fcadb3f4b7c468 [0,2,0,0,0,0|2,0,0]=4 2240 B9R0.34 CC[C@@H](C)NC(=O)/C=C/I c3a3066991c17be08c475e967090570a [0,2,0,0,0,0|2,0,0]=4 2241 B9R0.34 CC[C@@H](C)NC(=O)/C=C\Br 3a13748fd6af4654f058956c464bc18f [0,2,0,0,0,0|2,0,0]=4 2242 B9R0.34 CC[C@@H](C)NC(=O)/C=C\Cl c4a8c655fb1629c8498b1a49830302c3 [0,2,0,0,0,0|2,0,0]=4 2243 B9R0.34 CC[C@@H](C)NC(=O)/C=C\I 5f27a1051860ea350a45ecdd7085054b [0,2,0,0,0,0|2,0,0]=4 2244 B9R0.34 CC[C@@H](C)NC(=O)C#CBr 6d7d3394184238b919301e797e51f08d [0,2,0,0,0,0|2,0,0]=4 2245 B9R0.34 CC[C@@H](C)NC(=O)C=CBr ec2b70cf25ec8af9ffdb7f8671c23af7 [0,2,0,0,0,0|2,0,0]=4 2246 B9R0.34 CC[C@@H](C)NC(=O)C=CI a7be5737e80a86f1f4a57d115b65243d [0,2,0,0,0,0|2,0,0]=4 2247 B9R0.34 CC[C@@H](C)NC(=O)CC#N 02ae836a7ad407a759f03c2d42e685ac [0,2,0,0,0,0|2,0,0]=4 2248 B9R0.34 CC[C@@H](C)NC(=O)CC=O c52c55af7b57ae0dfd4aa5399ec0b750 [0,2,0,0,0,0|1,0,1]=4 2249 B9R0.34 CC[C@@H](C)NC(=O)CCF 2096cdab738ce6dd275899a92ce2e3cb [0,2,0,0,0,0|2,0,0]=4 2250 B9R0.34 CC[C@@H](C)NC(=O)CCO 3ac150908206e0e8666e48c83803ccb1 [0,2,0,0,0,0|1,0,0]=3 2251 B9R0.34 CC[C@@H](C)NC(=O)CCS 1a9f8047ad236cbf1e88b9c10c1fad05 [0,2,0,0,0,0|1,1,0]=4 2252 B9R0.34 CC[C@@H](C)NC(=O)COC 48e1c453949bea3e32bb0d96c962c7ca [0,2,0,0,0,0|1,0,0]=3 2253 B9R0.34 CC[C@@H](C)NC(=O)CON aeb5edc43bd4c7f2a6e80d771975c29b [0,2,0,0,0,0|1,0,0]=3 2254 B9R0.34 CC[C@@H](C)NC(=O)CSC 4d798388fffa22f640531c50e257bd3f [0,2,0,0,0,0|1,1,0]=4 2255 B9R0.34 CC[C@@H](C)NC(=O)NC#N 471ae6c392337c98596f103bd6a94c7b [0,2,0,0,0,0|2,0,0]=4 2256 B9R0.34 CC[C@@H](O)CC(=O)NC#N 7206841b90efcd207f148352e5874630 [0,2,0,0,0,0|2,0,0]=4 2257 B9R0.34 CC[C@H](C)CC(=O)NC#N 0dceab4b8db8cf70b10ba08d9aa2a2e4 [0,2,0,0,0,0|1,0,0]=3 2258 B9R0.34 CC[C@H](C)CN(C)CCO 9ab48fc1c860d94393a1ca7b805797cf [0,2,0,0,0,0|2,0,0]=4 2259 B9R0.34 CC[C@H](C)NC(=O)/C=C/Br 2fbf8a2f3c5fbbb86c0d681117643284 [0,2,0,0,0,0|2,0,0]=4 2260 B9R0.34 CC[C@H](C)NC(=O)/C=C/Cl 809329a833c362aba1fda312945384f3 [0,2,0,0,0,0|2,0,0]=4 2261 B9R0.34 CC[C@H](C)NC(=O)/C=C/I 7d3acb36b6817d8c17a0617aba05aced [0,2,0,0,0,0|2,0,0]=4 2262 B9R0.34 CC[C@H](C)NC(=O)/C=C\Br d5ea3d83d79cb66e20863714a7756c93 [0,2,0,0,0,0|2,0,0]=4 2263 B9R0.34 CC[C@H](C)NC(=O)/C=C\Cl 67ae42f44be251a7bb26415612044053 [0,2,0,0,0,0|2,0,0]=4 2264 B9R0.34 CC[C@H](C)NC(=O)/C=C\I ac42462ee5095bfab8fcd360b15ccd30 [0,2,0,0,0,0|2,0,0]=4 2265 B9R0.34 CC[C@H](C)NC(=O)C#CBr f6acd6205ab0f23c2cf8cb21d2f3c423 [0,2,0,0,0,0|2,0,0]=4 2266 B9R0.34 CC[C@H](C)NC(=O)C=CBr 31f5f89a64fb7520e146456bb3412bcb [0,2,0,0,0,0|2,0,0]=4 2267 B9R0.34 CC[C@H](C)NC(=O)C=CI 50718fbdd7ed36a302428e46f3c280b4 [0,2,0,0,0,0|2,0,0]=4 2268 B9R0.34 CC[C@H](C)NC(=O)CC#N 48cc5ae24c3f493da050772b51b46c69 [0,2,0,0,0,0|2,0,0]=4 2269 B9R0.34 CC[C@H](C)NC(=O)CC=O 02c2be14eca1a0be64d4fba9a43b76f1 [0,2,0,0,0,0|1,0,1]=4 2270 B9R0.34 CC[C@H](C)NC(=O)CCF cf1ef90c58efa611d88c51e5180c0356 [0,2,0,0,0,0|2,0,0]=4 2271 B9R0.34 CC[C@H](C)NC(=O)CCO 322f0603fdba897ce9e312b98e7e61d7 [0,2,0,0,0,0|1,0,0]=3 2272 B9R0.34 CC[C@H](C)NC(=O)CCS ac021828c976e0f2230d9f77deffc893 [0,2,0,0,0,0|1,1,0]=4 2273 B9R0.34 CC[C@H](C)NC(=O)COC 1594ed02551392a9437845ba84793c38 [0,2,0,0,0,0|1,0,0]=3 2274 B9R0.34 CC[C@H](C)NC(=O)CON 804234767df310919e4ea36e62b31064 [0,2,0,0,0,0|1,0,0]=3 2275 B9R0.34 CC[C@H](C)NC(=O)CSC 41f70346ebc317eaef81bc38ee11eeec [0,2,0,0,0,0|1,1,0]=4 2276 B9R0.34 CC[C@H](C)NC(=O)NC#N dbab752b422b9576415a607e2c0bdb57 [0,2,0,0,0,0|2,0,0]=4 2277 B9R0.34 CC[C@H](O)CC(=O)NC#N 03c8ef9746e022225def0151104688b6 [0,2,0,0,0,0|2,0,0]=4 2278 B9R0.34 CN(CC#N)CC(=O)CO 7f428b5d2750db4be2044df1deeb82fc [0,2,0,0,0,0|1,0,1]=4 2279 B9R0.34 CN(CCF)CC(=O)CO 7a10749312a8bc2b11792e6a9e1d10c3 [0,2,0,0,0,0|1,0,0]=3 2280 B9R0.34 CN(CCO)CC(=O)CO aa6f2c46c2ac30157f3207f73e04182c [0,2,0,0,0,0|1,0,0]=3 2281 B9R0.34 CNC(=O)CN(C)CCF 97fc4d5d9644b81365131a1a9db14d39 [0,2,0,0,0,0|2,0,0]=4 2282 B9R0.34 CNC(=O)CN(C)CCO 0f0a9763761e58691c47667f62204cb7 [0,2,0,0,0,0|2,0,0]=4 2283 B9R0.34 CNC(=O)CN(C)CCS 2fbee0334bed909a70452e1ce0334406 [0,2,0,0,0,0|2,0,0]=4 2284 B9R0.34 CNC(=O)CN(C)COC c9d8140bf14832dbc84770f6fc0f2146 [0,2,0,0,0,0|2,0,0]=4 2285 B9R0.34 CNC(=O)CN(C)CSC 5d7dd8ba42ec1e1e76234eb87b1d093e [0,2,0,0,0,0|2,0,0]=4 2286 B9R0.34 COC(=O)CC(C)NC#N df38146e7a667b28846b4ba6c043d6ce [0,2,0,0,0,0|1,0,1]=4 2287 B9R0.34 COC(=O)CC(C)NC=O b72211864df35ffd2380f82f65b89de4 [0,2,0,0,0,0|1,0,1]=4 2288 B9R0.34 COC(=O)CC(C)NCF 0a7538be72429a002b6b34a850e63618 [0,2,0,0,0,0|1,0,0]=3 2289 B9R0.34 COC(=O)CC(C)NCO 9753ba70d33825a7595610867e756db2 [0,2,0,0,0,0|1,0,0]=3 2290 B9R0.34 COC(=O)CC(C)OCF 68dbeec4b12b0259cc1cb07aaaa75105 [0,2,0,0,0,0|1,0,0]=3 2291 B9R0.34 COC(=O)CN(C)CC#N 6228a1773b5138a97c278f0d758ea010 [0,2,0,0,0,0|1,0,1]=4 2292 B9R0.34 COC(=O)CN(C)CC=O cc00c0b6da1d7eba3533da3045fb7caa [0,2,0,0,0,0|1,0,1]=4 2293 B9R0.34 COC(=O)CN(C)CCF 7b41865c913d9b2c4d4122ccac5837a9 [0,2,0,0,0,0|1,0,0]=3 2294 B9R0.34 COC(=O)CN(C)CCO 1aad489fa1b45518825201dd6f7c38ac [0,2,0,0,0,0|1,0,0]=3 2295 B9R0.34 COC(=O)CN(C)CCS 8a8c2fe6c6a87cff3965790c5275f6ca [0,2,0,0,0,0|1,0,0]=3 2296 B9R0.34 COC(=O)CN(C)CSC 0d6887e7a7c91b703c53f416b59021da [0,2,0,0,0,0|1,0,0]=3 2297 B9R0.34 COC(=O)C[C@@H](C)NC=O 7aa9f69886994f74910370c29191665a [0,2,0,0,0,0|1,0,1]=4 2298 B9R0.34 COC(=O)C[C@@H](C)NCF e8a318d42732337cd2ff2138a3efff74 [0,2,0,0,0,0|1,0,0]=3 2299 B9R0.34 COC(=O)C[C@@H](C)NCO d777fda6d4f2319c41cbabe57c5b3877 [0,2,0,0,0,0|1,0,0]=3 2300 B9R0.34 COC(=O)C[C@@H](C)OCF 7f7d1856387b433cec9b5e54411bfa81 [0,2,0,0,0,0|1,0,0]=3 2301 B9R0.34 COC(=O)C[C@H](C)NC#N 9ef41ece7628552e3e57d5f377c7df0b [0,2,0,0,0,0|1,0,1]=4 2302 B9R0.34 COC(=O)C[C@H](C)NC=O 4500b3412c0f97479f50647dae47746c [0,2,0,0,0,0|1,0,1]=4 2303 B9R0.34 COC(=O)C[C@H](C)NCF 2e3f06d4fde4df2be2e62c70eb519f8b [0,2,0,0,0,0|1,0,0]=3 2304 B9R0.34 COC(=O)C[C@H](C)NCO 3fd4d27b51ca9c405e6a5685f286ea0c [0,2,0,0,0,0|1,0,0]=3 2305 B9R0.34 COC(=O)C[C@H](C)OCF 5de665b9654f96b29e1d14acbc21116f [0,2,0,0,0,0|1,0,0]=3 2306 B9R0.34 COC(C)CC(=O)NC#N a5f15ab8ca9bb1a47b6c05cb5c617b4e [0,2,0,0,0,0|2,0,0]=4 2307 B9R0.34 COCC(=O)NC(C)CO ded064b2c7e3ee9cff8fbc24b92be2b0 [0,2,0,0,0,0|2,0,0]=4 2308 B9R0.34 COCC(=O)N[C@@H](C)CO 530671860d368edbef4e9a662734f2b2 [0,2,0,0,0,0|2,0,0]=4 2309 B9R0.34 COCC(=O)N[C@H](C)CO f8ec4c01599cd2038b26ce03eb5a452e [0,2,0,0,0,0|2,0,0]=4 2310 B9R0.34 COCC(C)NC(=O)C=O 7c6101c88d393f86ef52b3d00a97740e [0,2,0,0,0,0|1,0,1]=4 2311 B9R0.34 COCC(C)NC(=O)CF 987bb52ad626c5cacae313be3b87c3d8 [0,2,0,0,0,0|2,0,0]=4 2312 B9R0.34 COCC(C)NC(=O)CO d3dec175a25d21bb24b4de7fa1880277 [0,2,0,0,0,0|1,0,0]=3 2313 B9R0.34 COCC(C)NC(=O)CS e1a8fcf792a039bb68555ce2ecb8a2ab [0,2,0,0,0,0|1,1,0]=4 2314 B9R0.34 COCN(C)CC(=O)OC 33349a2663dda1be891b3184c8c7f1e3 [0,2,0,0,0,0|1,0,0]=3 2315 B9R0.34 COC[C@@H](C)NC(=O)C=O 1c118e5f298277fe11bcf5721dadc36a [0,2,0,0,0,0|1,0,1]=4 2316 B9R0.34 COC[C@@H](C)NC(=O)CF 2608f5636407b701c542c7126f9685e7 [0,2,0,0,0,0|2,0,0]=4 2317 B9R0.34 COC[C@@H](C)NC(=O)CO 405e40dd9fb1508be50d272312b405f6 [0,2,0,0,0,0|1,0,0]=3 2318 B9R0.34 COC[C@@H](C)NC(=O)CS 4c3d8a5b5c3e1741f0ac0f706bde4c21 [0,2,0,0,0,0|1,1,0]=4 2319 B9R0.34 COC[C@H](C)NC(=O)C=O e71153b1401d9ff78fd5472327f20638 [0,2,0,0,0,0|1,0,1]=4 2320 B9R0.34 COC[C@H](C)NC(=O)CF f9d31f6878f92070cf14188f5f1885c7 [0,2,0,0,0,0|2,0,0]=4 2321 B9R0.34 COC[C@H](C)NC(=O)CO c178bb49851d9a839be1a7cecd60fa18 [0,2,0,0,0,0|1,0,0]=3 2322 B9R0.34 COC[C@H](C)NC(=O)CS 6a2f3ccbf83d54c745d9a5f1b7695908 [0,2,0,0,0,0|1,1,0]=4 2323 B9R0.34 C[C@@H](CCO)NC(=O)C=O 414b7153b4d6feae3ebd6684523827cf [0,2,0,0,0,0|1,0,1]=4 2324 B9R0.34 C[C@@H](CCO)NC(=O)CF d59362538fad05ee537a74044bdb6ca8 [0,2,0,0,0,0|2,0,0]=4 2325 B9R0.34 C[C@@H](CCO)NC(=O)CO 492e5a8b88c4346847f95b6840bbc2bb [0,2,0,0,0,0|1,0,0]=3 2326 B9R0.34 C[C@@H](CCO)NC(=O)CS 19199c98226f0ea1ccccd53e8012f2f3 [0,2,0,0,0,0|1,1,0]=4 2327 B9R0.34 C[C@@H](CO)NC(=O)CCO 8b43c65b62106c536feff9d8ff559ad2 [0,2,0,0,0,0|2,0,0]=4 2328 B9R0.34 C[C@@H](CO)NC(=O)CON 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2408 B9R0.26 CC[C@@H](CO)NC(=O)CS 073de352a271c70a39c5845914f3c321 [0,2,0,0,0,0|1,1,0]=4 2409 B9R0.26 CC[C@H](CO)NC(=O)C=O 6bb23aea18dd42b4670a18a2d90dd20e [0,2,0,0,0,0|1,0,1]=4 2410 B9R0.26 CC[C@H](CO)NC(=O)CF 914cbed16ea24adb3951d820c2266acb [0,2,0,0,0,0|2,0,0]=4 2411 B9R0.26 CC[C@H](CO)NC(=O)CO 0b63e2f70c7e2b41af0b3014fc3aa706 [0,2,0,0,0,0|1,0,0]=3 2412 B9R0.26 CC[C@H](CO)NC(=O)CS 447fc0838fdbe5cb994ff4ad904decf9 [0,2,0,0,0,0|1,1,0]=4 2413 B9R0.26 O=C(CO)NC(CO)CO 3d3952bd62f7da927fdc4d5e0961c831 [0,2,0,0,0,0|2,0,0]=4 2414 B9R0.39 CC(=O)NC(CO)C(C)C 703c63e5ceccbfc00ce9c33d8c8ffb77 [0,2,0,0,0,0|2,0,0]=4 2415 B9R0.39 CC(=O)NC(CO)C(C)O fbbab85f0e12ad8394f7af438c3ef002 [0,2,0,0,0,0|2,0,0]=4 2416 B9R0.39 CC(=O)N[C@@H](CO)C(C)C 72d352aec1b33b2e93aa3c7e308adea3 [0,2,0,0,0,0|2,0,0]=4 2417 B9R0.39 CC(=O)N[C@@H](CO)[C@@H](C)O 50c6d8c6e22256f12d0b6b01bbbd3c4d [0,2,0,0,0,0|2,0,0]=4 2418 B9R0.39 CC(=O)N[C@@H](CO)[C@H](C)O f877126fbf1035a6fdb7452946ded67a [0,2,0,0,0,0|2,0,0]=4 2419 B9R0.39 CC(=O)N[C@H](CO)C(C)C 7badafc47e5ecc5a8804af3f7904c4d6 [0,2,0,0,0,0|2,0,0]=4 2420 B9R0.39 CC(=O)N[C@H](CO)[C@@H](C)O 9cce28155d60826295d78c62984f128a [0,2,0,0,0,0|2,0,0]=4 2421 B9R0.39 CC(=O)N[C@H](CO)[C@H](C)O 168538a28f02bcb2a950f8d7465bfbeb [0,2,0,0,0,0|2,0,0]=4 2422 B9R0.39 CC(C)N(CF)CC(=O)O fbcfb98f04e11cc85da91bf250fbdda7 [0,2,0,0,0,0|1,0,0]=3 2423 B9R0.39 CC(C)N(CO)CC(=O)O e1dd4cae1a1fde80fd16a2a4a1b81f5e [0,2,0,0,0,0|1,0,0]=3 2424 B9R0.39 CCC(NC(=O)C)C(C)C 253d178d4b990459a13ddcfb33937234 [0,2,0,0,0,0|2,0,0]=4 2425 B9R0.39 CCN(CC(=O)N)C(C)C 50d82a5a4d24004f09a0a0b41451a2fb [0,2,0,0,0,0|2,0,0]=4 2426 B9R0.39 CCN(CC(=O)O)C(C)C 493d0b65e3adcfa496122a54c1201266 [0,2,0,0,0,0|1,0,0]=3 2427 B9R0.39 CC[C@@H](NC(=O)C)[C@@H](C)O 921739c4a8a492f7cfef35d0bff38d7e [0,2,0,0,0,0|2,0,0]=4 2428 B9R0.39 CC[C@@H](NC(=O)C)[C@H](C)O 201113a7b2ad8782f3c591af74095c66 [0,2,0,0,0,0|2,0,0]=4 2429 B9R0.39 CC[C@H](NC(=O)C)[C@@H](C)O 7ad059423e88b28831a5095f24ca1743 [0,2,0,0,0,0|2,0,0]=4 2430 B9R0.63 C#CC(C)(CC)NC(=O)C ff0a13195ecc244b3be28340f93e3489 [0,2,0,0,0,0|2,0,0]=4 2431 B9R0.63 CCC(C)(C#N)NC(=O)C 8e9de1472a9b026300e0ed4ab98d2ea1 [0,2,0,0,0,0|2,0,0]=4 2432 B9R0.63 CCC(C)(CC)NC(=O)C e531833667d78c7544d0ceeec6cf7519 [0,2,0,0,0,0|2,0,0]=4 2433 B9R0.63 CCC(C)(CO)NC(=O)C 40dda0256826aa748f94013087dcf5fc [0,2,0,0,0,0|2,0,0]=4 2434 B9R0.22 C#CC(=O)NC(C)(C)CC 13ef9dae6bf0dcc4a48be908017306a4 [0,2,0,0,0,0|2,0,0]=4 2435 B9R0.22 C=CC(=O)NC(C)(C)CC 38af9fdcdb9244d5568d45958d42929c [0,2,0,0,0,0|2,0,0]=4 2436 B9R0.22 CC(C)(CF)NC(=O)CO 6816c15ff91ae4b5c437c85120768592 [0,2,0,0,0,0|2,0,0]=4 2437 B9R0.22 CC(C)(CO)NC(=O)CO 75164e27418190b4e78e41ad35c5df97 [0,2,0,0,0,0|2,0,0]=4 2438 B9R0.22 CCC(=O)NC(C)(C)CC 547e266e0f971a5e467eaf793ba67e6b [0,2,0,0,0,0|2,0,0]=4 2439 B9R0.22 CCC(C)(C)NC(=O)C=O 2138d40b3a899317bc18ee4695519d66 [0,2,0,0,0,0|1,0,1]=4 2440 B9R0.22 CCC(C)(C)NC(=O)CF 0bfca66cef7cd4828f314023815fe8d5 [0,2,0,0,0,0|2,0,0]=4 2441 B9R0.22 CCC(C)(C)NC(=O)CO c523c81c90e00be947966f3fb4981f63 [0,2,0,0,0,0|1,0,0]=3 2442 B9R0.22 CCC(C)(C)NC(=O)CS 99263b4b85cddab7ce4ab285f7462fbd [0,2,0,0,0,0|1,1,0]=4 2443 B9R0.10 CC(=O)NC(C)C(C)(C)C a4bf66246dcf2107b144dd840725ce6c [0,2,0,0,0,0|2,0,0]=4 2444 B9R0.10 CC(=O)NC(C)C(C)(C)O d96104c7cf3d8380347ad859afbe482b [0,2,0,0,0,0|2,0,0]=4 2445 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)C d66f5e93c4bbb588d9e68fd8491a21c3 [0,2,0,0,0,0|2,0,0]=4 2446 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 1111eec15fbbb43cec42d2e095e2a297 [0,2,0,0,0,0|2,0,0]=4 2447 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 71e4c597c94beed3be03b4fa243d07cd [0,2,0,0,0,0|2,0,0]=4 2448 B9R0.10 CC(=O)N[C@H](C)C(C)(C)O cd35a2da994d3179ff856be18c18fa92 [0,2,0,0,0,0|2,0,0]=4 2449 B9R0.10 CN(CC(=O)N)C(C)(C)C 81ca6dbcd593219b93bf94bb144e8778 [0,2,0,0,0,0|2,0,0]=4 2450 B9R0.10 CN(CC(=O)O)C(C)(C)C c7cbcdbd59bc98528a6d52b866d8c1bd [0,2,0,0,0,0|1,0,0]=3 2451 B9R0.11 CC(=O)NC(C)(C)C(C)C e5ae815a6bb001488060d134ecd0d7a8 [0,2,0,0,0,0|2,0,0]=4 2452 B9R0.11 CC(=O)NC(C)(C)C(C)O 6329b1c8dd9e1addeff362c5cd7e7be8 [0,2,0,0,0,0|2,0,0]=4 2453 B9R0.57 CC(C)N(C)CS(=O)(=O)O d2bdd1ab5d4397adc90b38f97a56dbea [0,2,0,0,0,0|2,0,0]=4 2454 B7R1.1 CCN1CC=CC1 6c4c19a4974c3e71b2e06f869bc9eb5b [1,0,0,1,0,0|2,0,0]=4 2455 B7R1.5 CC1CC1NC=O 11d2e4098455fa895a61be5d2e846089 [1,0,0,1,0,0|1,0,0]=3 2456 B7R1.5 CC1CC1NCO d401c45702bc5f310a419d102b35b78c [1,0,0,1,0,0|1,0,1]=4 2457 B7R1.6 C=CCN1CCC1 e2cc8c962668cfacc8166017adc3ac9b [1,0,0,1,0,0|2,0,0]=4 2458 B7R1.6 O=CCN1CCC1 c2093fa3a09c779905e30743087db6d6 [1,0,0,1,0,0|1,0,0]=3 2459 B7R1.6 O=CNC1COC1 910edb395eecbce8af210d974d8d054c [1,0,0,1,0,0|2,0,0]=4 2460 B7R1.6 OCCN1CCC1 1d260cf3c54be4529d167a32e498c498 [1,0,0,1,0,0|1,0,1]=4 2461 B7R1.6 OCNC1CCC1 8514f35646cacb22efc5d7fadc2f3b2f [1,0,0,1,0,0|1,0,1]=4 2462 B7R1.10 CCN1CC(C1)O 64169be24f24ac0d0d4e63cfda9c5a6f [1,0,0,1,0,0|1,0,1]=4 2463 B7R1.21 CC1(CC1)NC=O 07b8dc5a3dd0a56dffd330aa7b75c69f [1,0,0,1,0,0|1,0,0]=3 2464 B7R1.21 CC1(CC1)NCO 531fb08d002be0f82ba9f2a9eeb36d37 [1,0,0,1,0,0|1,0,1]=4 2465 B7R1.20 CC(=O)NC1CC1 d75fb765a64005f603eb0ff25694647c [1,0,0,1,0,0|2,0,0]=4 2466 B7R1.18 CC(=O)N1CCC1 8143f596a7f046e54d5db8a61549ab26 [1,0,0,1,0,0|2,0,0]=4 2467 B9R1.35 CC(=O)N1CCC(C1)C 62fae45163ab5fc8df8ad46633eee0ac [0,0,0,1,0,1|1,0,0]=3 2468 B9R1.35 CC(=O)N1CCC(C1)F a6d7f64dfc4ae3923d1e882541a80fe0 [0,0,0,1,0,1|2,0,0]=4 2469 B9R1.35 CC(=O)N1CCC(C1)O d6f7e3e992ee3d9bc88f42beae2651f4 [0,0,0,1,0,1|2,0,0]=4 2470 B9R1.35 CC(=O)N1CCN(C1)C 5a30c81e7d4d94bbb4d67833191502c6 [0,0,0,1,0,1|2,0,0]=4 2471 B9R1.35 CC(=O)N1CC[C@@H](C1)F 1016d6a16006ef8ebfa1a324326808d5 [0,0,0,1,0,1|2,0,0]=4 2472 B9R1.35 CC(=O)N1CC[C@@H](C1)O eba103538f34c1984ba106a2ce04ce40 [0,0,0,1,0,1|2,0,0]=4 2473 B9R1.35 CC(=O)N1CC[C@H](C1)F 286010f93b872d924c1e32cdd70d17f3 [0,0,0,1,0,1|2,0,0]=4 2474 B9R1.35 CC(=O)N1CC[C@H](C1)O a7a4738d457ef17a95fd7f51dd477d8d [0,0,0,1,0,1|2,0,0]=4 2475 B9R1.46 C=C(Br)CNC1CC1C 6a21ba73831e8c995c5be343bd73ffab [0,0,0,1,0,1|2,0,0]=4 2476 B9R1.46 C=C(C)CNC1CC1C 2b9ed88b52a9db253a701d69a05910c6 [0,0,0,1,0,1|2,0,0]=4 2477 B9R1.46 C=C(Cl)CNC1CC1C 41939aef17647277c90201ff2ab0dbe1 [0,0,0,1,0,1|2,0,0]=4 2478 B9R1.46 C=C(F)CNC1CC1C 9a99a8fc778f2902c8674b440d7aa4db [0,0,0,1,0,1|2,0,0]=4 2479 B9R1.46 CC(O)CNC1CC1C 65a3dce9b80b7e6073fecc0b82a4278c [0,0,0,1,0,1|1,0,1]=4 2480 B9R1.46 CC1CC1NCC(=O)N 0f761d58efdd237db8c0f17aea937594 [0,0,0,1,0,1|1,0,0]=3 2481 B9R1.46 CC1CC1NCC(=O)O 3bfaf8234ce2a2ce9175fc2c1a135a09 [0,0,0,1,0,1|0,0,0]=2 2482 B9R1.46 CC1CC1NC[C@@H](C)O e235a82f857b1ad469c64953d9779c93 [0,0,0,1,0,1|1,0,1]=4 2483 B9R1.46 CC1CC1NC[C@H](C)O 1ffb1a76a30a6fa9c1940857f79ab76f [0,0,0,1,0,1|1,0,1]=4 2484 B9R1.46 CC1CC1NC[N+](=O)[O-] e62512da68fa2e001869e91cd0ad930b [0,0,0,1,0,1|1,0,1]=4 2485 B9R1.46 NC(=O)CN[C@@H]1C[C@H]1F 3b2b6520b4ae83ab4e1ce2b8b3b6429a [0,0,0,1,0,1|2,0,0]=4 2486 B9R1.46 NC(=O)CN[C@H]1C[C@@H]1F 69bd8c1f10a36ab70a4088bf55d26d09 [0,0,0,1,0,1|2,0,0]=4 2487 B9R1.46 NC(=O)CN[C@H]1C[C@H]1F 2794dd04c73e89c247d26f60b9701a61 [0,0,0,1,0,1|2,0,0]=4 2488 B9R1.46 O=C(O)CN[C@@H]1C[C@H]1F a6c43cdb6b93e8ffb5565a60fb69e134 [0,0,0,1,0,1|1,0,0]=3 2489 B9R1.46 O=C(O)CN[C@H]1C[C@@H]1F 69d5a409f8843b0b8e9804d9f047552d [0,0,0,1,0,1|1,0,0]=3 2490 B9R1.46 O=C(O)CN[C@H]1C[C@H]1F cedd2a80fac675c783fcb497e5c8c7a7 [0,0,0,1,0,1|1,0,0]=3 2491 B9R1.67 CC(=O)NC1CCC1F 55e0226d065f98903a565e96ead37deb [0,0,0,1,0,1|2,0,0]=4 2492 B9R1.67 CC(=O)NC1CCC1O d5d791e34b0dd746abea58e641e7eb71 [0,0,0,1,0,1|2,0,0]=4 2493 B9R1.67 CC(=O)NC1COC1C 8a920b5eb5f4182753f432fdd48c3fbd [0,0,0,1,0,1|2,0,0]=4 2494 B9R1.67 CC(=O)N[C@@H]1CC[C@@H]1O 4643b690b6b53ddad1b5aeb87bd8a349 [0,0,0,1,0,1|2,0,0]=4 2495 B9R1.67 CC(=O)N[C@@H]1CC[C@H]1C 5c49b9b8f08f59f55b778fc02f7c64d4 [0,0,0,1,0,1|1,0,0]=3 2496 B9R1.67 CC(=O)N[C@@H]1CC[C@H]1O fba29ddb8346f550c0015141c61e8c98 [0,0,0,1,0,1|2,0,0]=4 2497 B9R1.67 CC(=O)N[C@H]1CC[C@@H]1O 263fe95019aba723bed92cdedf021005 [0,0,0,1,0,1|2,0,0]=4 2498 B9R1.67 CC(=O)N[C@H]1CC[C@H]1C c339870f892b73bf50fa9d649fc76de5 [0,0,0,1,0,1|1,0,0]=3 2499 B9R1.67 CC(=O)N[C@H]1CC[C@H]1O 2992e307b4aa4b78fb6fc80c541a013f [0,0,0,1,0,1|2,0,0]=4 2500 B9R1.82 CCC(C)N1CC(C1)O 1ab5e58649c4b06a2bd439a382cd3530 [0,0,0,1,0,1|1,0,1]=4 2501 B9R1.84 C=C(Br)CNC1CCC1 b5332afd557992b85a5b176b740e7ead [0,0,0,1,0,1|2,0,0]=4 2502 B9R1.84 C=C(Br)COC1CCC1 f0299dc579956f565c871cc427746846 [0,0,0,1,0,1|2,0,0]=4 2503 B9R1.84 C=C(C)CNC1CCC1 4a23e4c060f1fb43861ecdae16709370 [0,0,0,1,0,1|2,0,0]=4 2504 B9R1.84 C=C(C)COC1CCC1 543c9c519279dd68009467313a91bb34 [0,0,0,1,0,1|2,0,0]=4 2505 B9R1.84 C=C(Cl)CNC1CCC1 fd97072f13db5e9d4614f7e2de2ea754 [0,0,0,1,0,1|2,0,0]=4 2506 B9R1.84 C=C(Cl)COC1CCC1 0ed4ba90e018bc78f519c36cbf723e49 [0,0,0,1,0,1|2,0,0]=4 2507 B9R1.84 C=C(F)CNC1CCC1 4937bd35b62cb510ffde34809b286e41 [0,0,0,1,0,1|2,0,0]=4 2508 B9R1.84 C=C(F)COC1CCC1 4e2e517366406bc26b5321085d6c13f4 [0,0,0,1,0,1|2,0,0]=4 2509 B9R1.84 C=C(I)COC1CCC1 f7e50cec6d8c94d518e081f2313fe81f [0,0,0,1,0,1|2,0,0]=4 2510 B9R1.84 CC(=O)CCN1CCC1 c956718020bd2b18bed19cbea6541b6f [0,0,0,1,0,1|2,0,0]=4 2511 B9R1.84 CC(=O)CNC1CCC1 bd7acdba40fc474c96d220c49c50bbfc [0,0,0,1,0,1|1,0,0]=3 2512 B9R1.84 CC(=O)CNC1COC1 34b9c76c982929db7f109f80d0c4fd5e [0,0,0,1,0,1|2,0,0]=4 2513 B9R1.84 CC(=O)COC1CCC1 d88d952edae987109b22eaffa67aceef [0,0,0,1,0,1|1,0,0]=3 2514 B9R1.84 CC(=O)COC1COC1 5801aa7efbf00c0e367deacdd1b9cb40 [0,0,0,1,0,1|2,0,0]=4 2515 B9R1.84 CC(=O)NCC1CCC1 49ba76efa54494cc240e1d7dd1323f42 [0,0,0,1,0,1|1,0,0]=3 2516 B9R1.84 CC(=O)NCC1CCO1 74e9962ae59f4502bd57c52161ee5de6 [0,0,0,1,0,1|2,0,0]=4 2517 B9R1.84 CC(=O)NCC1COC1 06f36132d2ba2aaa4f8f4e9acac72ed3 [0,0,0,1,0,1|2,0,0]=4 2518 B9R1.84 CC(=O)NC[C@@H]1CCO1 baaf61a8c2cd88fd09af18fef905e8f1 [0,0,0,1,0,1|2,0,0]=4 2519 B9R1.84 CC(=O)NC[C@H]1CCO1 089f4a24e0b07350837a3d7a33ecfc52 [0,0,0,1,0,1|2,0,0]=4 2520 B9R1.84 CC(=O)OCN1CCC1 638bb9b9bb086da0d3d66884a5e5b05c [0,0,0,1,0,1|2,0,0]=4 2521 B9R1.84 CC(O)CNC1CCC1 96bd5539a723730488cc31c0d270b12a [0,0,0,1,0,1|1,0,1]=4 2522 B9R1.84 C[C@@H](O)CNC1CCC1 4d88206ac709e75f636226694fa1d13f [0,0,0,1,0,1|1,0,1]=4 2523 B9R1.84 C[C@H](O)CNC1CCC1 5643d23a46e4aad5f7f358d5677f0135 [0,0,0,1,0,1|1,0,1]=4 2524 B9R1.84 NC(=O)CCN1CCC1 7c7dcf2beb6babc71bb570ae0577e033 [0,0,0,1,0,1|2,0,0]=4 2525 B9R1.84 NC(=O)CNC1CCC1 22d17700eecb0c06f3b842c18a223914 [0,0,0,1,0,1|1,0,0]=3 2526 B9R1.84 NC(=O)CNC1COC1 a8c2e3a30adc74103bfe0a6e7bc55c70 [0,0,0,1,0,1|2,0,0]=4 2527 B9R1.84 NC(=O)COC1CCC1 2e70bd2c52f1b1ce8734b1f0deba9c6c [0,0,0,1,0,1|1,0,0]=3 2528 B9R1.84 NC(=O)COC1COC1 bc67e502b04ada45953557a5c7290473 [0,0,0,1,0,1|2,0,0]=4 2529 B9R1.84 NC(=O)COC1CSC1 b2fb3a99e520396fb80d4daaad793056 [0,0,0,1,0,1|2,0,0]=4 2530 B9R1.84 NC(=O)SCN1CCC1 27cb4cd83017a3127f67b165efda134e [0,0,0,1,0,1|2,0,0]=4 2531 B9R1.84 NC(=S)COC1CCC1 2859db688683b26698d3d7e03074b26a [0,0,0,1,0,1|1,1,0]=4 2532 B9R1.84 O=C(O)CCN1CCC1 c7456b9216b4090bb9138555bed1407a [0,0,0,1,0,1|1,0,0]=3 2533 B9R1.84 O=C(O)CNC1CCC1 cd102a6a388082590edc8eed5830f2b0 [0,0,0,1,0,1|0,0,0]=2 2534 B9R1.84 O=C(O)CNC1COC1 6bb06b4c2db0ff27bdfc2db31b9d0a43 [0,0,0,1,0,1|1,0,0]=3 2535 B9R1.84 O=C(O)COC1CCC1 6ea2b5eaf8c15cb47b19add287442093 [0,0,0,1,0,1|0,0,0]=2 2536 B9R1.84 O=C(O)COC1COC1 018c9639a2203f1b493d64da9ef6e678 [0,0,0,1,0,1|1,0,0]=3 2537 B9R1.84 O=C(O)COC1CSC1 386bd6c5f64faff25702916ce2fff970 [0,0,0,1,0,1|1,0,0]=3 2538 B9R1.84 O=S(O)COC1CCC1 41f090ccc207301c7067fca8add75b7b [0,0,0,1,0,1|1,0,0]=3 2539 B9R1.84 O=[N+]([O-])CNC1CCC1 f1e5213872773fd463505dddc18fadf3 [0,0,0,1,0,1|1,0,1]=4 2540 B9R1.84 O=[N+]([O-])COC1CCC1 a48e089ba01b1bd1072131689cc3ec6e [0,0,0,1,0,1|1,0,1]=4 2541 B9R1.86 CC(=O)N[C@@H]1C[C@H]1CO 0ac341c281dc9252b106f5d7b9e0551f [0,0,0,1,0,1|2,0,0]=4 2542 B9R1.86 CC(=O)N[C@H]1C[C@@H]1CO 228632cfd2f8d7f21118d84b7904f197 [0,0,0,1,0,1|2,0,0]=4 2543 B9R1.86 CC(=O)N[C@H]1C[C@H]1CO 38116f4ae17d91e0551dbf756c4676ef [0,0,0,1,0,1|2,0,0]=4 2544 B9R1.86 CO[C@H]1C[C@H]1NC(=O)C b71e84ef949a92b8a12e539c63f6f21c [0,0,0,1,0,1|2,0,0]=4 2545 B9R1.95 CC(=O)N1CC(C1)CF 7e226eb25a37d0ef716532b073f9bc17 [0,0,0,1,0,1|2,0,0]=4 2546 B9R1.95 CC(=O)N1CC(C1)CO 85101a47431a7260906a7aae57e2dae8 [0,0,0,1,0,1|2,0,0]=4 2547 B9R1.95 CCC1CN(C1)C(=O)C bab914ace2e180340bf5a20b479d0aae [0,0,0,1,0,1|1,0,0]=3 2548 B9R1.95 CCN1CC(C1)C(=O)N 9f7db4592c3ec9a62c68649606469901 [0,0,0,1,0,1|2,0,0]=4 2549 B9R1.95 CCN1CC(C1)C(=O)O 081311d3c14b920e24630a696a7ba3f7 [0,0,0,1,0,1|1,0,0]=3 2550 B9R1.95 COC1CN(C1)C(=O)C 8d5807765a4dcadf973d1cf1977d8745 [0,0,0,1,0,1|2,0,0]=4 2551 B9R1.95 CSC1CN(C1)C(=O)C 2894d9912f5f4ff944df13b23e87b7f5 [0,0,0,1,0,1|2,0,0]=4 2552 B9R1.95 O=C(O)C1CN(C1)CF 5858d7f931a4d75f836d678fe2360033 [0,0,0,1,0,1|2,0,0]=4 2553 B9R1.95 O=C(O)C1CN(C1)CO 464a11c339a26b6ec21bbe92982237ee [0,0,0,1,0,1|2,0,0]=4 2554 B9R1.147 C=C(Br)CNC1(CC1)C 813301f6693daef9931af99cc13371b9 [0,0,0,1,0,1|2,0,0]=4 2555 B9R1.147 C=C(C)CNC1(CC1)C 2fc1dbe716578680ff0fde6458bdccf0 [0,0,0,1,0,1|2,0,0]=4 2556 B9R1.147 C=C(Cl)CNC1(CC1)C d19347995a89caa1be02f31d9e8af7a3 [0,0,0,1,0,1|2,0,0]=4 2557 B9R1.147 C=C(F)CNC1(CC1)C fc5d3deff98bd2783e7197f86a634176 [0,0,0,1,0,1|2,0,0]=4 2558 B9R1.147 CC(=O)NCC1(CC1)F a14b14ba22a98917bd71440d108400f9 [0,0,0,1,0,1|2,0,0]=4 2559 B9R1.147 CC(=O)NCC1(CC1)O d545e148c8e5a1bc54e3d5cdc886cdb3 [0,0,0,1,0,1|2,0,0]=4 2560 B9R1.147 CC(O)CNC1(CC1)C fbe973e56e5b0db461a234a0f374e3f6 [0,0,0,1,0,1|1,0,1]=4 2561 B9R1.147 CC1(CC1)NCC(=O)N 5520a845dfeb47eb234a7ac329e973b0 [0,0,0,1,0,1|1,0,0]=3 2562 B9R1.147 CC1(CC1)NCC(=O)O 791305df7ecb343fa5b5da54e63f6381 [0,0,0,1,0,1|0,0,0]=2 2563 B9R1.147 CC1(CC1)NC[N+](=O)[O-] a93e8a95a08a7014de116c1941cf7c47 [0,0,0,1,0,1|1,0,1]=4 2564 B9R1.147 C[C@@H](O)CNC1(CC1)C 4feeb8106ac1ced4ac27a53546454438 [0,0,0,1,0,1|1,0,1]=4 2565 B9R1.147 C[C@H](O)CNC1(CC1)C 6ef19da8ad98c18435c1151aa600c40d [0,0,0,1,0,1|1,0,1]=4 2566 B9R1.41 CC(=O)N1CCCC1C f3ed72e102a18b3ca7365fff10aeb6f8 [0,1,0,1,0,0|2,0,0]=4 2567 B9R1.41 CC(=O)N1CCC[C@@H]1C 45c9778b44581f9933633398df3c02d2 [0,1,0,1,0,0|2,0,0]=4 2568 B9R1.41 CC(=O)N1CCC[C@H]1C 77e41bde24aa3c51a340cfebe6f455b1 [0,1,0,1,0,0|2,0,0]=4 2569 B9R1.41 CC(=O)N1CCSC1C 13a90b79e1eaed8ff645ef446550c0e3 [0,1,0,1,0,0|2,0,0]=4 2570 B9R1.96 CC(=O)N1CCC1CO 4d698f746732a35d30d4a2a283dfba7a [0,1,0,1,0,0|2,0,0]=4 2571 B9R1.96 CC(=O)N1CC[C@@H]1CO 03a3cbc0642d664b630044c6f3081dfc [0,1,0,1,0,0|2,0,0]=4 2572 B9R1.96 CC(=O)N1CC[C@H]1CO e8831b596318a484a992d94f488d625a [0,1,0,1,0,0|2,0,0]=4 2573 B9R1.96 CCC1CCN1C(=O)C f8a8c2660e185a53a38bd009b5fd9a1e [0,1,0,1,0,0|2,0,0]=4 2574 B9R1.96 CCN1CCC1C(=O)N 1cfe5ebf987ecebafa868cbdeb4b7422 [0,1,0,1,0,0|2,0,0]=4 2575 B9R1.96 CCN1CCC1C(=O)O ca0bbfd670281167636f7e4dd4cc56bf [0,1,0,1,0,0|1,0,0]=3 2576 B9R1.96 CCN1CC[C@@H]1C(=O)N d26915c9d0e6ed65803bfdf786a1b1ce [0,1,0,1,0,0|2,0,0]=4 2577 B9R1.96 CCN1CC[C@@H]1C(=O)O e809f9b39a76e5f73ee720d520f2d8da [0,1,0,1,0,0|1,0,0]=3 2578 B9R1.96 CCN1CC[C@H]1C(=O)N 32f8eb51fb894d3b554c30dd0433e814 [0,1,0,1,0,0|2,0,0]=4 2579 B9R1.96 CCN1CC[C@H]1C(=O)O 90d4ef3b77b2d2edfd444739e71a1146 [0,1,0,1,0,0|1,0,0]=3 2580 B9R1.96 NC(=O)C1CCN1CF 7e26fbd4c0256bdec99f2bbb3baf2130 [0,1,0,1,0,0|2,0,0]=4 2581 B9R1.96 NC(=O)C1CCN1CO f4000c84d952eade99020a829f553245 [0,1,0,1,0,0|2,0,0]=4 2582 B9R1.96 NC(=O)[C@@H]1CCN1CF e88364b41becd763b132e401e03969af [0,1,0,1,0,0|2,0,0]=4 2583 B9R1.96 NC(=O)[C@@H]1CCN1CO 2441a2a8cc07592b331fc68f9d6b6291 [0,1,0,1,0,0|2,0,0]=4 2584 B9R1.96 NC(=O)[C@H]1CCN1CF 65e3b1f4166374d1a9fab6df019a123e [0,1,0,1,0,0|2,0,0]=4 2585 B9R1.96 NC(=O)[C@H]1CCN1CO df672a69977a513555269b135b27e07d [0,1,0,1,0,0|2,0,0]=4 2586 B9R1.96 O=C(O)C1CCN1CF a73c50a5747fbf1c9dcb89ff140eef56 [0,1,0,1,0,0|1,0,0]=3 2587 B9R1.96 O=C(O)C1CCN1CO dcd47fec92d7cd22c146c2f982367c0e [0,1,0,1,0,0|1,0,0]=3 2588 B9R1.96 O=C(O)[C@@H]1CCN1CF 33bf6032edb12ba6e0c6af4b3ab637c5 [0,1,0,1,0,0|1,0,0]=3 2589 B9R1.96 O=C(O)[C@@H]1CCN1CO 2d3df4b77e74f2ed1add2f1fa0f35f44 [0,1,0,1,0,0|1,0,0]=3 2590 B9R1.96 O=C(O)[C@H]1CCN1CF 732a43f42ed58b977b82331718d13123 [0,1,0,1,0,0|1,0,0]=3 2591 B9R1.96 O=C(O)[C@H]1CCN1CO 49245c491708831bcf451e59d5634aff [0,1,0,1,0,0|1,0,0]=3 2592 B9R1.110 CC(=O)C(C)N1CCC1 9f219de39e89ec6f8e9e33807d8dd477 [0,1,0,1,0,0|2,0,0]=4 2593 B9R1.110 CC(=O)N(C)C1CCC1 a2c06594b7418a1a27e295f2f752df67 [0,1,0,1,0,0|2,0,0]=4 2594 B9R1.110 CC(C(=O)N)N1CCC1 a1dc9b019a6e9acad5c67a5e190ec480 [0,1,0,1,0,0|2,0,0]=4 2595 B9R1.110 CC(C(=O)O)N1CCC1 ec88a5e0123d5408898cf9e078ab2e9b [0,1,0,1,0,0|1,0,0]=3 2596 B9R1.110 C[C@@H](C(=O)N)N1CCC1 dd4f35b4b6ab8335efe58846193101fd [0,1,0,1,0,0|2,0,0]=4 2597 B9R1.110 C[C@@H](C(=O)O)N1CCC1 6d9f8aa04608a34debfa26472baad0e1 [0,1,0,1,0,0|1,0,0]=3 2598 B9R1.110 C[C@H](C(=O)N)N1CCC1 b9d6d0dceb5dec389ff05336a36af3fb [0,1,0,1,0,0|2,0,0]=4 2599 B9R1.110 C[C@H](C(=O)O)N1CCC1 b83116f410ba3b08b132985605530e43 [0,1,0,1,0,0|1,0,0]=3 2600 B9R1.111 CC(=O)N(C)C1(CC1)C 909fc378e24ad2f8e2bdea930f458528 [0,1,0,1,0,0|2,0,0]=4 2601 B9R1.7 CCCN1CNC(=O)C1 3c5d5a0187668e5f708d17c495c62e95 [0,1,0,1,0,0|2,0,0]=4 2602 B9R1.7 CCNC1CCC(C1)O 628356fc89e19ef9e05dade55232a5bb [0,1,0,1,0,0|1,0,1]=4 2603 B9R1.7 CCNC1CNC(=O)C1 f034b1c0e5aa31eff338453bd1cde7f9 [0,1,0,1,0,0|1,0,0]=3 2604 B9R1.7 CCN[C@@H]1CC[C@@H](C1)O 7c8c53e111793be80ad4cc673241d07f [0,1,0,1,0,0|1,0,1]=4 2605 B9R1.7 CCN[C@@H]1CC[C@H](C1)O ff712e2d7c8949b18071ff107f2beb24 [0,1,0,1,0,0|1,0,1]=4 2606 B9R1.7 CCN[C@@H]1CNC(=O)C1 53d087e66deab9a5a56ba2147c98eebb [0,1,0,1,0,0|1,0,0]=3 2607 B9R1.7 CCN[C@H]1CC[C@@H](C1)O 2a978cf4fc6aa50fa68ee6171c076414 [0,1,0,1,0,0|1,0,1]=4 2608 B9R1.7 CCN[C@H]1CC[C@H](C1)O 32fb3339fe7260cc6eb8ef4293a46d46 [0,1,0,1,0,0|1,0,1]=4 2609 B9R1.7 CCN[C@H]1CNC(=O)C1 a0f226362b35f34e32c6ff7f460edeb1 [0,1,0,1,0,0|1,0,0]=3 2610 B9R1.7 CCOC1=COC(=O)C1 d9f8c57e71131e87788948985bfcb55f [0,1,0,1,0,0|0,0,2]=4 2611 B9R1.7 CCOC1C=CC(=O)C1 cf7dcc6d5bb52c2dbe964e53d7a14001 [0,1,0,1,0,0|1,0,1]=4 2612 B9R1.7 CCOC1CCC(=O)C1 20f868b46959ea3477a4c5711e7faca7 [0,1,0,1,0,0|1,0,0]=3 2613 B9R1.7 CCOC1CNC(=O)C1 5dfdd0a06ecc1692efd79633b6c9fdb4 [0,1,0,1,0,0|1,0,0]=3 2614 B9R1.7 CCOC1COC(=O)C1 a14609c36cb4911f4d4f0326be24482c [0,1,0,1,0,0|0,0,0]=2 2615 B9R1.7 CCOC1COC(C1)C 3e91a0d24859f42f4cfd5c657a58260e [0,1,0,1,0,0|1,0,1]=4 2616 B9R1.7 CCO[C@@H]1CNC(=O)C1 a15700fb6c9d37d8c11af797ede2320b [0,1,0,1,0,0|1,0,0]=3 2617 B9R1.7 CCO[C@@H]1COC(=O)C1 f08fd85a64aaf6d51d762bf437e965d8 [0,1,0,1,0,0|0,0,0]=2 2618 B9R1.7 CCO[C@H]1C=CC(=O)C1 b0e331b85aadab1f09429088fdf1cc58 [0,1,0,1,0,0|1,0,1]=4 2619 B9R1.7 CCO[C@H]1CNC(=O)C1 442cd5fabba5f8376815e4dbe7155a78 [0,1,0,1,0,0|1,0,0]=3 2620 B9R1.7 CCO[C@H]1COC(=O)C1 b5b6c1c9b0e94e583c1e7d2706c4af7c [0,1,0,1,0,0|0,0,0]=2 2621 B9R1.7 COCN1CNC(=O)C1 4d18d6941c5616557bae4715cf80a3fe [0,1,0,1,0,0|2,0,0]=4 2622 B9R1.7 CSCN1CNC(=O)C1 8211b253328c1403ea89b1b99e3beec2 [0,1,0,1,0,0|2,0,0]=4 2623 B9R1.7 O=C1CC(CN1)NCF 980988dcb4ccee82cda1dab38be331e2 [0,1,0,1,0,0|2,0,0]=4 2624 B9R1.7 O=C1CC(CN1)NCO c052098805d668d6f4ada358e57e4112 [0,1,0,1,0,0|2,0,0]=4 2625 B9R1.7 O=C1CC(CN1)OCF 23b0d8d04434c7a4a01cc694371532a0 [0,1,0,1,0,0|2,0,0]=4 2626 B9R1.7 O=C1CC(CO1)OCF 6ccdee68b23c369d52f71b4fd0fa7d68 [0,1,0,1,0,0|1,0,0]=3 2627 B9R1.7 O=C1CCC(C1)OCF 98c190e459e55f64b9e25e39bcd16a19 [0,1,0,1,0,0|2,0,0]=4 2628 B9R1.7 O=C1CN(CN1)CCF d757934cfea094780b56173421a0001f [0,1,0,1,0,0|2,0,0]=4 2629 B9R1.7 O=C1CN(CN1)CCO 7dd773ba31e78145aab267af7b35d02f [0,1,0,1,0,0|2,0,0]=4 2630 B9R1.7 O=C1CN(CN1)CCS 843303fed7901f842425d8bab177d005 [0,1,0,1,0,0|2,0,0]=4 2631 B9R1.7 O=C1C[C@@H](CN1)NCF 411e6e79f87d54e44a2955c578af83cf [0,1,0,1,0,0|2,0,0]=4 2632 B9R1.7 O=C1C[C@@H](CN1)NCO b284e47e22d89750e99df8321f442760 [0,1,0,1,0,0|2,0,0]=4 2633 B9R1.7 O=C1C[C@@H](CN1)OCF 6723427409ff1f842102a48ad1f1d075 [0,1,0,1,0,0|2,0,0]=4 2634 B9R1.7 O=C1C[C@@H](CO1)OCF 51d79eb5dd5903751f5c379bd3b2cb3a [0,1,0,1,0,0|1,0,0]=3 2635 B9R1.7 O=C1C[C@H](CN1)NCF cd4abacc4820bcd0298dba28188d9f98 [0,1,0,1,0,0|2,0,0]=4 2636 B9R1.7 O=C1C[C@H](CN1)NCO 5fed0c6db4b7f4ec518dffff77ba236f [0,1,0,1,0,0|2,0,0]=4 2637 B9R1.7 O=C1C[C@H](CN1)OCF ef977050908cc65ab7cc2785915cf0cb [0,1,0,1,0,0|2,0,0]=4 2638 B9R1.7 O=C1C[C@H](CO1)OCF f528bbda1523620d35f6549c89ffa164 [0,1,0,1,0,0|1,0,0]=3 2639 B9R1.13 CC(=O)NC1CCCC1 a2d6bc9cfdeb39e26a278a42ee1d6324 [0,1,0,1,0,0|2,0,0]=4 2640 B9R1.13 CC(=O)NC1CCOC1 c5177dfe9e6c084a2da585e140eb24a0 [0,1,0,1,0,0|2,0,0]=4 2641 B9R1.13 CC(=O)NC1CCSC1 730ac5b1a87c9b477c5040aed194c284 [0,1,0,1,0,0|2,0,0]=4 2642 B9R1.13 CC(=O)N[C@@H]1CCOC1 a0946b6158cd267ecce33909819f831a [0,1,0,1,0,0|2,0,0]=4 2643 B9R1.13 CC(=O)N[C@H]1CCOC1 1f47913b87a63d932081a27afac44166 [0,1,0,1,0,0|2,0,0]=4 2644 B9R1.13 NC(=O)CN1CCSC1 22be898db8492311f4a4cae51daf2cd1 [0,1,0,1,0,0|2,0,0]=4 2645 B9R1.13 O=C(O)CN1CC=CC1 95a23d44a7c175c2727202d3f21e547e [0,1,0,1,0,0|1,0,1]=4 2646 B9R1.13 O=C(O)CN1CCSC1 3cee187b91b84407a74d8a64ddd2529a [0,1,0,1,0,0|1,0,0]=3 2647 B9R1.22 CCN1CC(=O)SC1S 37ca21c1e1816bfa530b6bbf2b2eaad2 [0,1,0,1,0,0|1,1,0]=4 2648 B9R1.22 CCN1C[C@@H](C[C@@H]1C)O 70f763f5b4a3235d3e4f2d196f00ccfe [0,1,0,1,0,0|1,0,1]=4 2649 B9R1.22 CCN1C[C@@H](C[C@H]1C)O c4bd7f96b36acd5e820f06999a11cb79 [0,1,0,1,0,0|1,0,1]=4 2650 B9R1.22 CCN1C[C@H](C[C@@H]1C)O aee11579e502fc16ec25d9210de9b942 [0,1,0,1,0,0|1,0,1]=4 2651 B9R1.22 CCN1C[C@H](C[C@H]1C)O ee2c873963ad0fba0e4d24d3860f441c [0,1,0,1,0,0|1,0,1]=4 2652 B9R1.52 CC(=O)N1C(CC1C)C d825f591833d5e0a442032eae5313b9d [0,1,0,1,0,0|2,0,0]=4 2653 B9R1.52 CC(=O)N1[C@@H](C[C@@H]1C)C 4e2229f8146ce5646a498c302183cf52 [0,1,0,1,0,0|2,0,0]=4 2654 B9R1.52 CC(=O)N1[C@@H](C[C@H]1C)C cade317e458702f2614a7905862507f2 [0,1,0,1,0,0|2,0,0]=4 2655 B9R1.52 CC(=O)N1[C@H](C[C@@H]1C)C 3b50e267751b2a24aac73ac831cd48fb [0,1,0,1,0,0|2,0,0]=4 2656 B9R1.53 CC(=O)NC1CC(C1)F 7223308b19c70b0e1bd9898cb652418c [0,1,0,1,0,0|2,0,0]=4 2657 B9R1.53 CC(=O)NC1CC(C1)O 8799f4af3e0b6d09fbf8b9528ac7ebaa [0,1,0,1,0,0|2,0,0]=4 2658 B9R1.53 CC(=O)NC1CN(C1)C 5352a1082a0de910e4849e8a20f416eb [0,1,0,1,0,0|2,0,0]=4 2659 B9R1.53 CC(=O)N[C@H]1C[C@@H](C1)F 181d91871be7f8e4efc6814a1c683243 [0,1,0,1,0,0|2,0,0]=4 2660 B9R1.53 CC(=O)N[C@H]1C[C@@H](C1)O 8a924b3dc097e65a33d640e85c34f83f [0,1,0,1,0,0|2,0,0]=4 2661 B9R1.53 CC(=O)N[C@H]1C[C@H](C1)F 44691e28cb286cfd51c0cab56e7261eb [0,1,0,1,0,0|2,0,0]=4 2662 B9R1.53 CC(=O)N[C@H]1C[C@H](C1)O fe9ddac170e9c08eaecbd11e2341ace8 [0,1,0,1,0,0|2,0,0]=4 2663 B9R1.53 NC(=O)CN1CC(C1)F 6f836876a332541e77d5af137d781077 [0,1,0,1,0,0|2,0,0]=4 2664 B9R1.53 NC(=O)CN1CC(C1)O 9049222e220fbd240264d7a67ff8edda [0,1,0,1,0,0|2,0,0]=4 2665 B9R1.53 O=C(O)CN1CC(C1)F bc7076e56d5dac9076928f37c7df6ae5 [0,1,0,1,0,0|1,0,0]=3 2666 B9R1.53 O=C(O)CN1CC(C1)O cd9cc5381132e3ab65c96da44eace8e8 [0,1,0,1,0,0|1,0,0]=3 2667 B9R1.59 N#CN[C@@H]1C[C@@H]1C(=O)O bc2cd394bc7f93c74e2e1f6226e999ad [0,1,0,1,0,0|1,0,1]=4 2668 B9R1.59 N#CN[C@H]1C[C@@H]1C(=O)O f659af02d3cbd2b97292473e1750f0f5 [0,1,0,1,0,0|1,0,1]=4 2669 B9R1.59 N#CN[C@H]1C[C@H]1C(=O)O b69df576ddf391e31209501cb99206b3 [0,1,0,1,0,0|1,0,1]=4 2670 B9R1.136 CCNC1CC(C1)(C)O 5d74f0f8f3e68ab8965524bade91e196 [0,1,0,1,0,0|1,0,1]=4 2671 B9R1.136 CCNC1CS(=O)(=O)C1 9de559bc56af0355ade56d9276998bcb [0,1,0,1,0,0|1,0,1]=4 2672 B9R1.136 CCN[C@H]1C[C@@](C1)(C)O 40ef3c077e108f519e8586541e299518 [0,1,0,1,0,0|1,0,1]=4 2673 B9R1.136 CCOC1CS(=O)(=O)C1 eb0c410b7692a4eb3b8d22f8e8ab38a8 [0,1,0,1,0,0|1,0,1]=4 2674 B9R1.137 CC(=O)N[C@@H](C)C1CC1 cb52c7f3ebe5aa8b915eead0d67bbb30 [0,1,0,1,0,0|2,0,0]=4 2675 B9R1.137 CC(=O)N[C@H](C)C1CC1 691d9804742e6e549d488040ae1ee5cb [0,1,0,1,0,0|2,0,0]=4 2676 B9R1.137 CN(CC(=O)N)C1CC1 e353d6cb022b6e315f0557db77d4879c [0,1,0,1,0,0|2,0,0]=4 2677 B9R1.137 CN(CC(=O)O)C1CC1 e912d9f2a96d438402b8e9e74437ecb9 [0,1,0,1,0,0|1,0,0]=3 2678 B9R1.171 CC(=O)NC1(CSC1)C 49d237f05f5c0abd511394bd42792a4c [0,1,0,1,0,0|2,0,0]=4 2679 B9R1.177 CCN[C@@]1(C[C@H](C1)O)C 9b2bca8e6123c865184df3ba0ae9a495 [0,1,0,1,0,0|1,0,1]=4 2680 B9R1.2 CC1CCCN(C1)C=O 5a06aa6b42e18f18aee9823269dae409 [0,1,0,1,0,0|2,0,0]=4 2681 B9R1.2 CC1CCCN(C1)CO 26652d230bcc9a1195d63435a97c512d [0,1,0,1,0,0|2,0,0]=4 2682 B9R1.2 CCN1CCCC(=O)C1 b0afeee675d5ec52ec51d9d2cdcf36a5 [0,1,0,1,0,0|2,0,0]=4 2683 B9R1.2 CCN1CCNC(=O)C1 8ee087b200f253c3cbe099e9fc72a94a [0,1,0,1,0,0|2,0,0]=4 2684 B9R1.2 CCN1CCOC(=O)C1 3f4941c9ffb61ce7dcae55397d747220 [0,1,0,1,0,0|1,0,0]=3 2685 B9R1.2 C[C@@H]1CCCN(C1)C=O b5e680c9235a8f69b3718f41b577e428 [0,1,0,1,0,0|2,0,0]=4 2686 B9R1.2 C[C@@H]1CCCN(C1)CO 6675ecf83c8b49544e3561e3282b0e83 [0,1,0,1,0,0|2,0,0]=4 2687 B9R1.2 C[C@H]1CCCN(C1)C=O 4dab749a75683c45748ebdcac3ae2c8b [0,1,0,1,0,0|2,0,0]=4 2688 B9R1.2 C[C@H]1CCCN(C1)CO 612f7806a77df61f3b60bf95e73ba9e6 [0,1,0,1,0,0|2,0,0]=4 2689 B9R1.2 O=C1CCCN(C1)CF 4a3aadad28924fa951595c84af73b014 [0,1,0,1,0,0|2,0,0]=4 2690 B9R1.2 O=C1CCCN(C1)CO 6d0678682a57a081022f992f70f98004 [0,1,0,1,0,0|2,0,0]=4 2691 B9R1.2 O=C1CN(CCN1)CF 5bafb41e77e8fcc47f20b3f5b7855411 [0,1,0,1,0,0|2,0,0]=4 2692 B9R1.2 O=C1CN(CCN1)CO 0ce2c3b0e7d808508a34999d9467140c [0,1,0,1,0,0|2,0,0]=4 2693 B9R1.2 O=C1CN(CCO1)CF c923694c0bf9f6f1496b855a5b8b01b2 [0,1,0,1,0,0|1,0,0]=3 2694 B9R1.2 O=C1CN(CCO1)CO 8db94e8adcec68c019e224a8c72e73db [0,1,0,1,0,0|1,0,0]=3 2695 B9R1.2 O=CN1CCOC(=O)C1 64e52dc909f50b8e1649c1cdcf0cde99 [0,1,0,1,0,0|1,0,1]=4 2696 B9R1.21 CCC1CCN(C1)C=O 511eb19254d8c6b5ffcb350a73123905 [0,1,0,1,0,0|2,0,0]=4 2697 B9R1.21 CCC1CCN(C1)CO d6731118e4ffc5593845df2f4ad3ee35 [0,1,0,1,0,0|2,0,0]=4 2698 B9R1.79 C#CC(=O)NC1CCC1 d1b6f9342d5f2d331fea3066cb6e81e7 [0,1,0,1,0,0|2,0,0]=4 2699 B9R1.79 C=C(C=O)OC1CCC1 3ce60f8c8bdab9f4b265cf15cc89a954 [0,1,0,1,0,0|2,0,0]=4 2700 B9R1.79 C=C(CN1CCC1)OC 23e2180b78c76bcf0541659ef038c4a5 [0,1,0,1,0,0|2,0,0]=4 2701 B9R1.79 C=C(CO)CN1CCC1 64bc6d515cd9739cc6d94aac10cec8fc [0,1,0,1,0,0|2,0,0]=4 2702 B9R1.79 C=CC(=O)NC1CCC1 c318e34de80e137dfb71a9410142317d [0,1,0,1,0,0|2,0,0]=4 2703 B9R1.79 CCC(=O)CN1CCC1 9b8a54515dd7b03c067360cc9113002b [0,1,0,1,0,0|2,0,0]=4 2704 B9R1.79 CCC(=O)NC1CCC1 269364fc2d30f4a38dda69b505509556 [0,1,0,1,0,0|2,0,0]=4 2705 B9R1.79 CN(C=O)CC1CCC1 7067673fcd6b5e288a96434bde2c4213 [0,1,0,1,0,0|2,0,0]=4 2706 B9R1.79 CN(CO)CC1CCC1 773b3747ae13621c99e8bb01ec83febb [0,1,0,1,0,0|2,0,0]=4 2707 B9R1.79 CNC(=O)CN1CCC1 34c940b2505425ba8a151c0b3e8838b6 [0,1,0,1,0,0|2,0,0]=4 2708 B9R1.79 COC(=O)CN1CCC1 a8f3fa2cf91e8163638e85cafd81936a [0,1,0,1,0,0|1,0,0]=3 2709 B9R1.79 O=C(CF)NC1CCC1 a9d2c830d70e4baef8d8ccbad12e86b4 [0,1,0,1,0,0|2,0,0]=4 2710 B9R1.79 O=C(CO)CN1CCC1 1812f82997ebe060276760730379ad88 [0,1,0,1,0,0|1,0,0]=3 2711 B9R1.79 O=C(CO)NC1CCC1 0966cf85b1996540e8450078e870cb20 [0,1,0,1,0,0|1,0,0]=3 2712 B9R1.79 O=C(CO)NC1COC1 726701ad5a455d4010a3c28e3ea84a4a [0,1,0,1,0,0|2,0,0]=4 2713 B9R1.79 O=CC(=O)NC1CCC1 42e01e0dbbe276ce23cdaf55d5bdf28d [0,1,0,1,0,0|1,0,1]=4 2714 B9R1.88 CCN1CC1C(=O)OC f034603aa7057edd7cbcbf568fb8f16a [0,1,0,1,0,0|1,0,0]=3 2715 B9R1.88 CCN1C[C@H]1C(=O)OC f91fd31959795f4d191be975337de98c [0,1,0,1,0,0|1,0,0]=3 2716 B9R1.88 COC(=O)C1CN1CF d8920555019a1b54b1f0294fbc450fb1 [0,1,0,1,0,0|2,0,0]=4 2717 B9R1.88 COC(=O)C1CN1CO 90cf4da76cb7c6fe31b6fb3dc60e8f6c [0,1,0,1,0,0|2,0,0]=4 2718 B9R1.88 COC(=O)[C@@H]1CN1CF fc01eb2b8dee62155c1b6ba0209f1261 [0,1,0,1,0,0|2,0,0]=4 2719 B9R1.88 COC(=O)[C@@H]1CN1CO 09a2b35b3698420a9a82ac9cd52accec [0,1,0,1,0,0|2,0,0]=4 2720 B9R1.113 C#CC(=O)NC1(CC1)C 6c7f4222b0709cd000c93abb5862f046 [0,1,0,1,0,0|2,0,0]=4 2721 B9R1.113 C=CC(=O)NC1(CC1)C 9ae59a0eb716b63b9d026d7450d12f86 [0,1,0,1,0,0|2,0,0]=4 2722 B9R1.113 CC1(CC1)NC(=O)C=O 2a0a51d27f12be65c020290a96b8d56b [0,1,0,1,0,0|1,0,1]=4 2723 B9R1.113 CC1(CC1)NC(=O)CF dd61ce65af85c64ae0da6eb2f7e6bb6e [0,1,0,1,0,0|2,0,0]=4 2724 B9R1.113 CCC(=O)NC1(CC1)C 1b8a936d0d1fabb5efa74f7843184644 [0,1,0,1,0,0|2,0,0]=4 2725 B9R1.113 CN(C=O)CC1(CC1)C 2394abf13a51e87ff3f294dab93cf3dd [0,1,0,1,0,0|2,0,0]=4 2726 B9R1.113 CN(CO)CC1(CC1)C b3a1a3fdb371ffbe1727ebed9631f336 [0,1,0,1,0,0|2,0,0]=4 2727 B9R1.170 CC(=O)NC1CC1(C)C 61c79b4e42c36bc7a9365ff180f14cdd [0,1,0,1,0,0|2,0,0]=4 2728 B9R1.170 CC(=O)N[C@@H]1CC1(C)C eba22b1ed44543f7d679da436f8b8d30 [0,1,0,1,0,0|2,0,0]=4 2729 B9R1.170 CC(=O)N[C@H]1CC1(C)C 8c767d53d5dfba1d912673d478483d51 [0,1,0,1,0,0|2,0,0]=4 2730 B9R1.170 CC1(CN1CC(=O)N)C 86e9bc4697c2603d8bce2ffd0971da9c [0,1,0,1,0,0|2,0,0]=4 2731 B9R1.170 CC1(CN1CC(=O)O)C 3ccf565e03ddb18b56e78099947f70c7 [0,1,0,1,0,0|1,0,0]=3 2732 B9R1.114 O=S(=O)(O)CN1CCC1 ad455adafb90a78e628b176ee026a442 [0,1,0,1,0,0|2,0,0]=4 2733 B9R0.1 C#CC(C)NCCC(=O)O b5fa8c47938cc1ab8b71133a233a8712 [0,0,0,0,0,2|0,0,2]=4 2734 B9R0.1 C#CC(C)OCCC(=O)O ca456cda53aab7a3e9ddc1555a141e4b [0,0,0,0,0,2|0,0,2]=4 2735 B9R0.1 C#C[C@@H](C)NCCC(=O)O 2c3e5d536ee20bb10e4a276f986c03f0 [0,0,0,0,0,2|0,0,2]=4 2736 B9R0.1 C#C[C@@H](C)OCCC(=O)O 5e9b30e37e8c265f10c7585c2f2ca95a [0,0,0,0,0,2|0,0,2]=4 2737 B9R0.1 C#C[C@H](C)NCCC(=O)O cc5bdbda6a0b246c6e6e23c2baac79c5 [0,0,0,0,0,2|0,0,2]=4 2738 B9R0.1 C#C[C@H](C)OCCC(=O)O 017cc2bf4609698c2e4663c93f9a5f21 [0,0,0,0,0,2|0,0,2]=4 2739 B9R0.1 C=C(Br)CCOC(C)CC 091e084d3b6d1f82050c012325f204dd [0,0,0,0,0,2|2,0,0]=4 2740 B9R0.1 C=C(Br)CNCC(C)CC 981fc4bb74e598a40b1ff531d96d951a [0,0,0,0,0,2|2,0,0]=4 2741 B9R0.1 C=C(Br)CNC[C@@H](C)CC 3d05347509c6f7b0b8ea2128766d5683 [0,0,0,0,0,2|2,0,0]=4 2742 B9R0.1 C=C(Br)CNC[C@H](C)CC 482805fb21b45b39bbaeb88c7242fa36 [0,0,0,0,0,2|2,0,0]=4 2743 B9R0.1 C=C(Br)COCC(C)CC e3c93140f7f9139cbd63ce3d8b91006f [0,0,0,0,0,2|2,0,0]=4 2744 B9R0.1 C=C(Br)COC[C@@H](C)CC 80766ee122c1e21cd3669d6da61c1402 [0,0,0,0,0,2|2,0,0]=4 2745 B9R0.1 C=C(Br)COC[C@H](C)CC 30d0d8ee9b254c321f85f05ca5650727 [0,0,0,0,0,2|2,0,0]=4 2746 B9R0.1 C=C(C)CCNC(C)CC 3e59254196aed313540af75c07c39315 [0,0,0,0,0,2|2,0,0]=4 2747 B9R0.1 C=C(C)CCN[C@@H](C)CC dd5db3d0315db4cd17c73027333e9aec [0,0,0,0,0,2|2,0,0]=4 2748 B9R0.1 C=C(C)CCN[C@H](C)CC 17f8689567b0cd30665489930711fefc [0,0,0,0,0,2|2,0,0]=4 2749 B9R0.1 C=C(C)CCOC(C)CC c1ab39b33b060b66872a7a99cb42b49c [0,0,0,0,0,2|2,0,0]=4 2750 B9R0.1 C=C(C)CCO[C@@H](C)CC 1a113e19745c74a32b97d0777a65f856 [0,0,0,0,0,2|2,0,0]=4 2751 B9R0.1 C=C(C)CCO[C@H](C)CC 10f668905abfc9df65d3d95b2b060ce8 [0,0,0,0,0,2|2,0,0]=4 2752 B9R0.1 C=C(C)CNCC(C)CC d4f1c6767e155a1fd81f2d6f4b177c23 [0,0,0,0,0,2|2,0,0]=4 2753 B9R0.1 C=C(C)CNC[C@@H](C)CC 6206249324b67e9f83a35f5c528b1179 [0,0,0,0,0,2|2,0,0]=4 2754 B9R0.1 C=C(C)CNC[C@H](C)CC cb261ab2a6f6774f97476ebf10cee194 [0,0,0,0,0,2|2,0,0]=4 2755 B9R0.1 C=C(C)COCC(C)CC 3adee05156cf1068a7c305dcd2622cc9 [0,0,0,0,0,2|2,0,0]=4 2756 B9R0.1 C=C(C)COC[C@@H](C)CC a9f511de537b539852049654668eb445 [0,0,0,0,0,2|2,0,0]=4 2757 B9R0.1 C=C(C)COC[C@H](C)CC 7d2830ec8db581fdaca9ec3884531144 [0,0,0,0,0,2|2,0,0]=4 2758 B9R0.1 C=C(CC)CNCC(=O)O 3494cd583a0b63f9a90da7dbe9a93496 [0,0,0,0,0,2|0,0,2]=4 2759 B9R0.1 C=C(CC)COCC(=O)O ee3b330f9d46b7ad6bddc2068ae1158b [0,0,0,0,0,2|0,0,2]=4 2760 B9R0.1 C=C(Cl)CNCC(C)CC 11c5950a5d91f0f0029477709543a1de [0,0,0,0,0,2|2,0,0]=4 2761 B9R0.1 C=C(Cl)CNC[C@@H](C)CC 98cafe9df3b2af14b613988adbe5a405 [0,0,0,0,0,2|2,0,0]=4 2762 B9R0.1 C=C(Cl)COCC(C)CC 8e12aa49282ca4c7aa5e587f6776b5d0 [0,0,0,0,0,2|2,0,0]=4 2763 B9R0.1 C=C(Cl)COC[C@@H](C)CC d6c8c8ec8af5460477d1adf7526bd82b [0,0,0,0,0,2|2,0,0]=4 2764 B9R0.1 C=C(Cl)COC[C@H](C)CC 26b9477bafe654353a35ccf76484b54b [0,0,0,0,0,2|2,0,0]=4 2765 B9R0.1 C=C(F)COCC(C)CC e971ce5b3a2f222771833358944ad7b1 [0,0,0,0,0,2|2,0,0]=4 2766 B9R0.1 C=C(F)COC[C@@H](C)CC 8754031d741b3a81e01246240a2af29d [0,0,0,0,0,2|2,0,0]=4 2767 B9R0.1 C=C(F)COC[C@H](C)CC 053b257de75e3ab9fbda44f561cf7b93 [0,0,0,0,0,2|2,0,0]=4 2768 B9R0.1 C=C(I)COCC(C)CC 6a37480b984d6a3a88d2a97c430f900f [0,0,0,0,0,2|2,0,0]=4 2769 B9R0.1 C=C(I)COC[C@@H](C)CC ebcd6aead02ff5da05d6692ec4f20a14 [0,0,0,0,0,2|2,0,0]=4 2770 B9R0.1 C=C(I)COC[C@H](C)CC 7cecb5a281b9320016babbf18a636c32 [0,0,0,0,0,2|2,0,0]=4 2771 B9R0.1 C=CC(C)COCC(=O)O b37de9a6da072d47f216f61c5cd125d6 [0,0,0,0,0,2|0,0,2]=4 2772 B9R0.1 C=CC(C)NCCC(=O)O 79ff7d3cdb6746c9598fe1cfb61269b1 [0,0,0,0,0,2|0,0,2]=4 2773 B9R0.1 C=CC(C)OCCC(=O)O 715e83dec8bd7b5ea255c0588e4ec66b [0,0,0,0,0,2|0,0,2]=4 2774 B9R0.1 C=C[C@H](C)OCCC(=O)O 713b61bf87b3acb53853822b10178bd4 [0,0,0,0,0,2|0,0,2]=4 2775 B9R0.1 CC(=O)CCNC(C)CO 01ba95f6b1e359cb3c703695e54af8f9 [0,0,0,0,0,2|2,0,0]=4 2776 B9R0.1 CC(=O)CCN[C@@H](C)CO cfee917e546e694eb8cfec1ddb21f4ff [0,0,0,0,0,2|2,0,0]=4 2777 B9R0.1 CC(=O)CCN[C@H](C)CO 6a8f8df3011cfcce7cd31192a422cdd8 [0,0,0,0,0,2|2,0,0]=4 2778 B9R0.1 CC(=O)CCOC(C)CF 2b40c92c280f522bdc6bcc23530c56f2 [0,0,0,0,0,2|2,0,0]=4 2779 B9R0.1 CC(=O)CCOC(C)CS 727af9312bf0bae1f3dfb371a20f5514 [0,0,0,0,0,2|2,0,0]=4 2780 B9R0.1 CC(=O)CCO[C@H](C)CS ca9c10e49fb951095de6ae1c1ca5c0e6 [0,0,0,0,0,2|2,0,0]=4 2781 B9R0.1 CC(=O)CNCC(C)CO 687573d47da7078f008452b6941cfbb6 [0,0,0,0,0,2|2,0,0]=4 2782 B9R0.1 CC(=O)CNC[C@@H](C)CO 83d4361a5af389dd1a51e847e0c228db [0,0,0,0,0,2|2,0,0]=4 2783 B9R0.1 CC(=O)CNC[C@H](C)CO 0c7d13a9c50e9968d7e5477a482d94c3 [0,0,0,0,0,2|2,0,0]=4 2784 B9R0.1 CC(=O)NCCC(C)CO bebfc27f0403b0ff17a662d28cff0e43 [0,0,0,0,0,2|2,0,0]=4 2785 B9R0.1 CC(=O)NCC[C@@H](C)CO caf7a94637e8711be8cab6e4c356b0b6 [0,0,0,0,0,2|2,0,0]=4 2786 B9R0.1 CC(=O)OCNC(C)CO 76053288c472e8736169c869174d9dc3 [0,0,0,0,0,2|2,0,0]=4 2787 B9R0.1 CC(=O)OCN[C@@H](C)CO 68403b70a82968dbe1b7522f781c5509 [0,0,0,0,0,2|2,0,0]=4 2788 B9R0.1 CC(=O)OCN[C@H](C)CO 008f51ea2e0cae1cf2db292c7d138dfd [0,0,0,0,0,2|2,0,0]=4 2789 B9R0.1 CC(=O)OCOC(C)CF a5e979ebacdbe532aeb2dcf04f90f101 [0,0,0,0,0,2|2,0,0]=4 2790 B9R0.1 CC(=O)OCOC(C)CS 1fb13d69d3259da5f281e5d0f3dd8413 [0,0,0,0,0,2|2,0,0]=4 2791 B9R0.1 CC(=O)OCO[C@H](C)CS 0166b5f40ddcbd81555f2e3e10f08ecd [0,0,0,0,0,2|2,0,0]=4 2792 B9R0.1 CC(C#N)CNCC(=O)O 690b9c42e94c9bde7fbf2cdbf8d4eca2 [0,0,0,0,0,2|1,0,1]=4 2793 B9R0.1 CC(C#N)COCC(=O)O 5e1e962d1c3a873fc728b08a62a84674 [0,0,0,0,0,2|1,0,1]=4 2794 B9R0.1 CC(C#N)NCCC(=O)O a71e77ce50f1b855f7d576c5d6f6289e [0,0,0,0,0,2|1,0,1]=4 2795 B9R0.1 CC(C=O)NCCC(=O)O c047f24fc3d15f3badbf76260054cc9f [0,0,0,0,0,2|1,0,1]=4 2796 B9R0.1 CC(C=O)OCCC(=O)O 056bb2d7d93cc893e2815e75c928f63b [0,0,0,0,0,2|1,0,1]=4 2797 B9R0.1 CC(CF)OCCC(=O)N 77e5540c955a9bd5601c5ff0437ec4f8 [0,0,0,0,0,2|2,0,0]=4 2798 B9R0.1 CC(CF)OCCC(=O)O e6767e000962bf0da8753ce7298bf1cf [0,0,0,0,0,2|1,0,0]=3 2799 B9R0.1 CC(CF)OCSC(=O)N a30aaa929550ad3346699b7af68be5dd [0,0,0,0,0,2|2,0,0]=4 2800 B9R0.1 CC(CO)CNCC(=O)N 1515f5dca39d8974b65c9c8e576ba458 [0,0,0,0,0,2|2,0,0]=4 2801 B9R0.1 CC(CO)CNCC(=O)O 545002bd59f1a831ceb97793e95beb08 [0,0,0,0,0,2|1,0,0]=3 2802 B9R0.1 CC(CO)NCCC(=O)N b00aad0bfd7caa3a7945ce46f42cbd7d [0,0,0,0,0,2|2,0,0]=4 2803 B9R0.1 CC(CO)NCCC(=O)O 7af196631507732ccee08e53dff47c19 [0,0,0,0,0,2|1,0,0]=3 2804 B9R0.1 CC(CO)NCCS(=O)O ffb21d9235aff6fcb4d16a8dd5a43574 [0,0,0,0,0,2|2,0,0]=4 2805 B9R0.1 CC(CO)NCSC(=O)N a7cc03e721340bfc080e2f154fc627f0 [0,0,0,0,0,2|2,0,0]=4 2806 B9R0.1 CC(CS)OCCC(=O)N 084f32928b5b0a54f93fef70f63ed831 [0,0,0,0,0,2|2,0,0]=4 2807 B9R0.1 CC(CS)OCSC(=O)N d3eb1834933b6123d6843ad137121ed4 [0,0,0,0,0,2|2,0,0]=4 2808 B9R0.1 CCC(=O)CNCC(=O)O 7018cc82507b5cf3388be4a1b0a3b91b [0,0,0,0,0,2|1,0,1]=4 2809 B9R0.1 CCC(=O)COCC(=O)O 1a72a234de91ee3fa394daead68a119d [0,0,0,0,0,2|1,0,1]=4 2810 B9R0.1 CCC(C)CCNC(=O)C 2da423144efbc22bf5c1e3503bb1535e [0,0,0,0,0,2|1,0,0]=3 2811 B9R0.1 CCC(C)CNCC(=O)C 38219368305ac283b328948de524c748 [0,0,0,0,0,2|1,0,0]=3 2812 B9R0.1 CCC(C)CNCC(=O)N 16522a2e22028faf802074861520249b [0,0,0,0,0,2|1,0,0]=3 2813 B9R0.1 CCC(C)CNCC(=O)O 87c69323a9e1a04a6ee6d76377703b82 [0,0,0,0,0,2|0,0,0]=2 2814 B9R0.1 CCC(C)CNCC(C)O 2565fefe893fb592504bf3eb9b9f9263 [0,0,0,0,0,2|1,0,1]=4 2815 B9R0.1 CCC(C)CNC[C@@H](C)O 3206056fc3d595c27a3727eeef23ed1b [0,0,0,0,0,2|1,0,1]=4 2816 B9R0.1 CCC(C)CNC[C@H](C)O 7518c3737ca09a588caddc5048aac33b [0,0,0,0,0,2|1,0,1]=4 2817 B9R0.1 CCC(C)CNC[N+](=O)[O-] 068de4f8b1ca53a43e6540741dc39a8b [0,0,0,0,0,2|1,0,1]=4 2818 B9R0.1 CCC(C)COCC(=O)C bd04825963a18a80e53433b8af338adb [0,0,0,0,0,2|1,0,0]=3 2819 B9R0.1 CCC(C)COCC(=O)N 2a0ba5bb8f81333cdbeea70ace57393a [0,0,0,0,0,2|1,0,0]=3 2820 B9R0.1 CCC(C)COCC(=O)O 1a5759c434f27c176d5bad2fa82f04ef [0,0,0,0,0,2|0,0,0]=2 2821 B9R0.1 CCC(C)COCC(=S)N 55ef566efc4ab6e72735313e0e433e49 [0,0,0,0,0,2|1,1,0]=4 2822 B9R0.1 CCC(C)COCS(=O)O aa2f448e10aac758f905eaea4ded0bb5 [0,0,0,0,0,2|1,0,0]=3 2823 B9R0.1 CCC(C)COC[N+](=O)[O-] 745f15624642a882da5b732a4eee2a0b [0,0,0,0,0,2|1,0,1]=4 2824 B9R0.1 CCC(C)NC/C=C(/C)\I 69ff5123bcc9b423d1a12ead3d7b5741 [0,0,0,0,0,2|2,0,0]=4 2825 B9R0.1 CCC(C)NC/C=C(\C)/Cl e6bee879eb873a8d5a28aea08fbb2f02 [0,0,0,0,0,2|2,0,0]=4 2826 B9R0.1 CCC(C)NCC=C(C)C a2f44659c461ef615ce082ecc587ff75 [0,0,0,0,0,2|2,0,0]=4 2827 B9R0.1 CCC(C)NCC=C(C)Cl f374ca4387c233f83fa37dfd2cd07001 [0,0,0,0,0,2|2,0,0]=4 2828 B9R0.1 CCC(C)NCC=C(C)I 07b02cf5a59f531c33d8774f57f92bda [0,0,0,0,0,2|2,0,0]=4 2829 B9R0.1 CCC(C)NCC=C(Cl)Cl 2fb5ee7b4e8a126618e197051f24661a [0,0,0,0,0,2|2,0,0]=4 2830 B9R0.1 CCC(C)NCCC(=O)C 553b77e78208b9e578091ff5b7a7dbdb [0,0,0,0,0,2|1,0,0]=3 2831 B9R0.1 CCC(C)NCCC(=O)N 1a4e576a5df92bfad9c34a96c5e494ae [0,0,0,0,0,2|1,0,0]=3 2832 B9R0.1 CCC(C)NCCC(=O)O a58859ee191bb6759b209bcd54bebe4e [0,0,0,0,0,2|0,0,0]=2 2833 B9R0.1 CCC(C)NCCC(=S)N a908450007e25a71c98e5e23ec373b39 [0,0,0,0,0,2|1,1,0]=4 2834 B9R0.1 CCC(C)NCCC(C)O dda59110f1c0fb7493f1aaff05307dd4 [0,0,0,0,0,2|1,0,1]=4 2835 B9R0.1 CCC(C)NCCS(=O)C fa17ca3cf9f3eaf4d4c144b34f44cd9a [0,0,0,0,0,2|2,0,0]=4 2836 B9R0.1 CCC(C)NCCS(=O)O 72c84b7af723b02c5376adf14512bab4 [0,0,0,0,0,2|1,0,0]=3 2837 B9R0.1 CCC(C)NCC[C@@H](C)O fb3a959625849719803d70bc59f6fd53 [0,0,0,0,0,2|1,0,1]=4 2838 B9R0.1 CCC(C)NCC[C@H](C)O b64181209b00f8f962601d14c2173d61 [0,0,0,0,0,2|1,0,1]=4 2839 B9R0.1 CCC(C)NCOC(=O)C 23aa0ac2e47ba04a5a139a2e1c0bf0de [0,0,0,0,0,2|1,0,0]=3 2840 B9R0.1 CCC(C)NCSC(=O)N 99818846aaffb2d6958455e86b9a4762 [0,0,0,0,0,2|1,0,0]=3 2841 B9R0.1 CCC(C)OC/C=C(/C)\Cl c5537c0fac51bb48273759e804163d31 [0,0,0,0,0,2|2,0,0]=4 2842 B9R0.1 CCC(C)OC/C=C(/C)\I 21a0a19624c38b1f519fbd071de19bef [0,0,0,0,0,2|2,0,0]=4 2843 B9R0.1 CCC(C)OC/C=C(\C)/Cl 8aec6e70c5f16f8e64da9dcb3914cf6d [0,0,0,0,0,2|2,0,0]=4 2844 B9R0.1 CCC(C)OCC=C(C)C f1a856dad648c67c3199ced8e645ed40 [0,0,0,0,0,2|2,0,0]=4 2845 B9R0.1 CCC(C)OCC=C(C)Cl 301c625b7a6eff64de9657876805093d [0,0,0,0,0,2|2,0,0]=4 2846 B9R0.1 CCC(C)OCC=C(C)I d5abc656bcdc0ac26794e208243fe109 [0,0,0,0,0,2|2,0,0]=4 2847 B9R0.1 CCC(C)OCC=C(Cl)Cl e2b05f3d8deae9b80478b339e2fddff2 [0,0,0,0,0,2|2,0,0]=4 2848 B9R0.1 CCC(C)OCCC(=O)C 3c4819c84edde006647b7f4661484ff1 [0,0,0,0,0,2|1,0,0]=3 2849 B9R0.1 CCC(C)OCCC(=O)N c80df9816dad84b994c7ec7d952479b6 [0,0,0,0,0,2|1,0,0]=3 2850 B9R0.1 CCC(C)OCCC(=O)O 861df1c98ebd5a3521ba6de3206bc80e [0,0,0,0,0,2|0,0,0]=2 2851 B9R0.1 CCC(C)OCCS(=O)C e67f403f4904a01e724c3d61f00e1775 [0,0,0,0,0,2|2,0,0]=4 2852 B9R0.1 CCC(C)OCC[N+](=O)[O-] 2ed110549f6c3bf31f3ceb6d374ed380 [0,0,0,0,0,2|1,0,1]=4 2853 B9R0.1 CCC(C)OCNC(=O)C 8183d13cbf9d8c857b25fb9915a8e602 [0,0,0,0,0,2|1,0,0]=3 2854 B9R0.1 CCC(C)OCNC(=O)N 8bdf4dea8e83697fdf038441dcfc0b21 [0,0,0,0,0,2|1,0,0]=3 2855 B9R0.1 CCC(C)OCOC(=O)C f818c8d88ded73092c135f186b34a6ed [0,0,0,0,0,2|1,0,0]=3 2856 B9R0.1 CCC(C)OCSC(=O)N 10be0faea3701cb21a8b6267ba5f766e [0,0,0,0,0,2|1,0,0]=3 2857 B9R0.1 CCC(O)CNCC(=O)C ede59564767224e151ba36bea1af43f8 [0,0,0,0,0,2|2,0,0]=4 2858 B9R0.1 CCC(O)CNCC(=O)N 0115c55aa91aa51240c8355946838a03 [0,0,0,0,0,2|2,0,0]=4 2859 B9R0.1 CCC(O)CNCC(=O)O 03d5356d375bf79d740c17da46436b7f [0,0,0,0,0,2|1,0,0]=3 2860 B9R0.1 CCN(C)C/C=C/C(=O)O c59393b71dfbf874e824ace25c6dde8a [0,0,0,0,0,2|1,0,0]=3 2861 B9R0.1 CCN(C)CC=CC(=O)O 2b5cd669133f9500117e44a88402af2e [0,0,0,0,0,2|1,0,0]=3 2862 B9R0.1 CCN(C)CCCC(=O)C 41478ee9c5261856d551150317f5e6d2 [0,0,0,0,0,2|2,0,0]=4 2863 B9R0.1 CCN(C)CCCC(=O)N 5457b0b5f3c627b5bbae3b3b0443c3e6 [0,0,0,0,0,2|2,0,0]=4 2864 B9R0.1 CCN(C)CCCC(=O)O 95bc41ded99741417784aba721ce87aa [0,0,0,0,0,2|1,0,0]=3 2865 B9R0.1 CCN(C)CCNC(=O)C 8261fd541df04ed3dee9f95b587853cd [0,0,0,0,0,2|2,0,0]=4 2866 B9R0.1 CCN(C)CCNC(=O)N bafdb7984409d28d75edcbc4894db829 [0,0,0,0,0,2|2,0,0]=4 2867 B9R0.1 CCN(C)CCOC(=O)C 2e72695c8766aa8c6dd0fb8fcaa7e65d [0,0,0,0,0,2|2,0,0]=4 2868 B9R0.1 CCN(C)CCSC(=O)C 6e1d069dc9e4f41572e9ef79797ac9c0 [0,0,0,0,0,2|2,0,0]=4 2869 B9R0.1 CC[C@@H](C)CNCC(=O)C 57a59e48f50a2bc35515a82d8a8c3a79 [0,0,0,0,0,2|1,0,0]=3 2870 B9R0.1 CC[C@@H](C)CNCC(=O)N 86fe84e58c34c31bc79a8f984286262c [0,0,0,0,0,2|1,0,0]=3 2871 B9R0.1 CC[C@@H](C)CNCC(=O)O 98f2dd2d2950413d052b4cb7e53dbe2b [0,0,0,0,0,2|0,0,0]=2 2872 B9R0.1 CC[C@@H](C)CNCC(C)O 0edb135055cb737a4bc90c1f8270c4d7 [0,0,0,0,0,2|1,0,1]=4 2873 B9R0.1 CC[C@@H](C)CNC[C@@H](C)O 06548bb51537ad4c28c0633d716d339d [0,0,0,0,0,2|1,0,1]=4 2874 B9R0.1 CC[C@@H](C)CNC[C@H](C)O cab093f359def90f74c49583fd552bc4 [0,0,0,0,0,2|1,0,1]=4 2875 B9R0.1 CC[C@@H](C)COCC(=O)C 3ea96dffd188de143cbb785260b39e0c [0,0,0,0,0,2|1,0,0]=3 2876 B9R0.1 CC[C@@H](C)COCC(=O)N 740f240e3f600ed639946b1e0e9b224f [0,0,0,0,0,2|1,0,0]=3 2877 B9R0.1 CC[C@@H](C)COCC(=O)O 8b143e0422b6a9e950b67a2c284bdd65 [0,0,0,0,0,2|0,0,0]=2 2878 B9R0.1 CC[C@@H](C)COCC(=S)N 845d22901c19e52b71204759841b42b4 [0,0,0,0,0,2|1,1,0]=4 2879 B9R0.1 CC[C@@H](C)COCS(=O)O 19b9a9e681b592b4e47910d2bc3144b8 [0,0,0,0,0,2|1,0,0]=3 2880 B9R0.1 CC[C@@H](C)COC[N+](=O)[O-] d5053705678f945de7746ecae1a09b1d [0,0,0,0,0,2|1,0,1]=4 2881 B9R0.1 CC[C@@H](C)NC/C=C(/C)\I b3d8c9b1e0bea5da48fbcd71d2ac62fe [0,0,0,0,0,2|2,0,0]=4 2882 B9R0.1 CC[C@@H](C)NC/C=C(\C)/Cl bed990e0311e2b612ad6663a21c908f2 [0,0,0,0,0,2|2,0,0]=4 2883 B9R0.1 CC[C@@H](C)NCC=C(C)C 9805440ec95291712dd9e091ff4d0ac8 [0,0,0,0,0,2|2,0,0]=4 2884 B9R0.1 CC[C@@H](C)NCC=C(C)Cl a491e0e301b818ce9b86e53453358269 [0,0,0,0,0,2|2,0,0]=4 2885 B9R0.1 CC[C@@H](C)NCC=C(C)I 92693c5dd2f30b5887db434beb11a77c [0,0,0,0,0,2|2,0,0]=4 2886 B9R0.1 CC[C@@H](C)NCC=C(Cl)Cl b5a28203d0975e06ebc745f97fd012fc [0,0,0,0,0,2|2,0,0]=4 2887 B9R0.1 CC[C@@H](C)NCCC(=O)C ee2823585fbc4d880fa3f68fe921eb3d [0,0,0,0,0,2|1,0,0]=3 2888 B9R0.1 CC[C@@H](C)NCCC(=O)N b6b2677e5edf0741bd651bdbb3611804 [0,0,0,0,0,2|1,0,0]=3 2889 B9R0.1 CC[C@@H](C)NCCC(=O)O 1e341985822ae038516e7d3d57e3d5f1 [0,0,0,0,0,2|0,0,0]=2 2890 B9R0.1 CC[C@@H](C)NCCC(C)O b7f70e273fce08932540a42165eb9d86 [0,0,0,0,0,2|1,0,1]=4 2891 B9R0.1 CC[C@@H](C)NCCS(=O)C ef3dd5974ed506c6358962ab3726809b [0,0,0,0,0,2|2,0,0]=4 2892 B9R0.1 CC[C@@H](C)NCOC(=O)C a711d08f12460f2a76c41395ffc9ec65 [0,0,0,0,0,2|1,0,0]=3 2893 B9R0.1 CC[C@@H](C)NCSC(=O)N 4296f6a08650c5d681b93398b84c69ae [0,0,0,0,0,2|1,0,0]=3 2894 B9R0.1 CC[C@@H](C)OC/C=C(/C)\I f0a869a268ee8cc3515809ca9a9aceff [0,0,0,0,0,2|2,0,0]=4 2895 B9R0.1 CC[C@@H](C)OC/C=C(\C)/Cl fc9e006b4c631daee2cdda8e494874a1 [0,0,0,0,0,2|2,0,0]=4 2896 B9R0.1 CC[C@@H](C)OCC=C(C)C e4a6022f8d02a4c12c0cd2cf54a88045 [0,0,0,0,0,2|2,0,0]=4 2897 B9R0.1 CC[C@@H](C)OCC=C(C)Cl a1d516a2c53df935a6799fb4a0d3b4d7 [0,0,0,0,0,2|2,0,0]=4 2898 B9R0.1 CC[C@@H](C)OCC=C(C)I 5807f19f39ff9efdd551bafd3976b1bd [0,0,0,0,0,2|2,0,0]=4 2899 B9R0.1 CC[C@@H](C)OCC=C(Cl)Cl c0b6d33403bc8231f46e037088e8a4fb [0,0,0,0,0,2|2,0,0]=4 2900 B9R0.1 CC[C@@H](C)OCCC(=O)C 49267d242cdea675a244728a918e9b2e [0,0,0,0,0,2|1,0,0]=3 2901 B9R0.1 CC[C@@H](C)OCCC(=O)N 94e454e36f118d64a2660378253d5f3a [0,0,0,0,0,2|1,0,0]=3 2902 B9R0.1 CC[C@@H](C)OCCC(=O)O 460df0b016032744699dec10515440f9 [0,0,0,0,0,2|0,0,0]=2 2903 B9R0.1 CC[C@@H](C)OCCS(=O)C 9b9f925e3813153ad01d285336dc42b0 [0,0,0,0,0,2|2,0,0]=4 2904 B9R0.1 CC[C@@H](C)OCOC(=O)C 65fc54324ee0a95629ae5ef18322eb78 [0,0,0,0,0,2|1,0,0]=3 2905 B9R0.1 CC[C@@H](C)OCSC(=O)N 3b0c60f54d867c23b33abb1c316c2aca [0,0,0,0,0,2|1,0,0]=3 2906 B9R0.1 CC[C@@H](O)CNCC(=O)N 8d91f413ccf87ad2db7b150f686cd85b [0,0,0,0,0,2|2,0,0]=4 2907 B9R0.1 CC[C@@H](O)CNCC(=O)O 03733baf1864df61afe14ccbe323ed3e [0,0,0,0,0,2|1,0,0]=3 2908 B9R0.1 CC[C@H](C)CNCC(=O)C f6e69c2b87b1b94a0f2513a65f560c31 [0,0,0,0,0,2|1,0,0]=3 2909 B9R0.1 CC[C@H](C)CNCC(=O)N 1896affdbe0b42f4fa2702bb9fa0f52c [0,0,0,0,0,2|1,0,0]=3 2910 B9R0.1 CC[C@H](C)CNCC(=O)O 3004fae72bd867afedf99bbbfea959f0 [0,0,0,0,0,2|0,0,0]=2 2911 B9R0.1 CC[C@H](C)CNCC(C)O acb0f2f402bde2189761235f28bd8537 [0,0,0,0,0,2|1,0,1]=4 2912 B9R0.1 CC[C@H](C)CNC[C@@H](C)O 8c9a2e8bd3820ab9cbf6410eab31b4a5 [0,0,0,0,0,2|1,0,1]=4 2913 B9R0.1 CC[C@H](C)CNC[C@H](C)O 23768e5495769b3c846ea18f18258f86 [0,0,0,0,0,2|1,0,1]=4 2914 B9R0.1 CC[C@H](C)CNC[N+](=O)[O-] 9bee9049907540f7b558160946c6eae0 [0,0,0,0,0,2|1,0,1]=4 2915 B9R0.1 CC[C@H](C)COCC(=O)C 80eb9e48ec554962e19de8a0a5190a68 [0,0,0,0,0,2|1,0,0]=3 2916 B9R0.1 CC[C@H](C)COCC(=O)N 618c87bafaf60a39a5844b8445445aab [0,0,0,0,0,2|1,0,0]=3 2917 B9R0.1 CC[C@H](C)COCC(=O)O d94c701382e65cef3df369dbbe944763 [0,0,0,0,0,2|0,0,0]=2 2918 B9R0.1 CC[C@H](C)COCC(=S)N 9993ad6712ea9aa5c90bd28da11fa8ea [0,0,0,0,0,2|1,1,0]=4 2919 B9R0.1 CC[C@H](C)COCS(=O)O 39955f728c40bf5dcc7b4871cd9bc9b3 [0,0,0,0,0,2|1,0,0]=3 2920 B9R0.1 CC[C@H](C)COC[N+](=O)[O-] 19c8793d4a01be6830c7dfc381098174 [0,0,0,0,0,2|1,0,1]=4 2921 B9R0.1 CC[C@H](C)NC/C=C(/C)\I 8645570a726d53e09404ea0b52f36cc0 [0,0,0,0,0,2|2,0,0]=4 2922 B9R0.1 CC[C@H](C)NC/C=C(\C)/Cl ef3b5be6344896df4a79c1265dfbcfd0 [0,0,0,0,0,2|2,0,0]=4 2923 B9R0.1 CC[C@H](C)NCC=C(C)C c96aecba3a4b1c0206c17da9f4870ccc [0,0,0,0,0,2|2,0,0]=4 2924 B9R0.1 CC[C@H](C)NCC=C(C)Cl 1539fda1ca7b09824b48bd36d6671e6b [0,0,0,0,0,2|2,0,0]=4 2925 B9R0.1 CC[C@H](C)NCC=C(C)I c117f2c939ad3f9f59e87e615c53bcbb [0,0,0,0,0,2|2,0,0]=4 2926 B9R0.1 CC[C@H](C)NCC=C(Cl)Cl 58725e2dcf73aab5b521d4627cbffaa2 [0,0,0,0,0,2|2,0,0]=4 2927 B9R0.1 CC[C@H](C)NCCC(=O)C 5a9b435e46c65397c3b77d227f6c8d6d [0,0,0,0,0,2|1,0,0]=3 2928 B9R0.1 CC[C@H](C)NCCC(=O)N 20e8289367182a2a107c4742c2451855 [0,0,0,0,0,2|1,0,0]=3 2929 B9R0.1 CC[C@H](C)NCCC(=O)O 9ce7a4b5931e874b441152425137209a [0,0,0,0,0,2|0,0,0]=2 2930 B9R0.1 CC[C@H](C)NCCC(C)O 2749dbaaf30a780792b4813830b0935f [0,0,0,0,0,2|1,0,1]=4 2931 B9R0.1 CC[C@H](C)NCCS(=O)C 0f8fbcfee0e31d449c9a62890f9930d1 [0,0,0,0,0,2|2,0,0]=4 2932 B9R0.1 CC[C@H](C)NCOC(=O)C ec462d5afb28a22cfec47297688b8d5f [0,0,0,0,0,2|1,0,0]=3 2933 B9R0.1 CC[C@H](C)NCSC(=O)N d95b5607ccbac595df027faddf664742 [0,0,0,0,0,2|1,0,0]=3 2934 B9R0.1 CC[C@H](C)OC/C=C(/C)\I ba23318c2a9db37b3d5e2acd1e9d8333 [0,0,0,0,0,2|2,0,0]=4 2935 B9R0.1 CC[C@H](C)OC/C=C(\C)/Cl 3fc9a9e4a8071cca7f0c063d0a37ed5f [0,0,0,0,0,2|2,0,0]=4 2936 B9R0.1 CC[C@H](C)OCC=C(C)C d2053192ca51a631dfb1bf706824d85b [0,0,0,0,0,2|2,0,0]=4 2937 B9R0.1 CC[C@H](C)OCC=C(C)Cl 0b392c9a9fcf9501beb994dbfcb82461 [0,0,0,0,0,2|2,0,0]=4 2938 B9R0.1 CC[C@H](C)OCC=C(C)I 608a0bb7803c6068bfdc1f6935d4b329 [0,0,0,0,0,2|2,0,0]=4 2939 B9R0.1 CC[C@H](C)OCC=C(Cl)Cl 962ea7d582af1fb4f0b03efad8e6a99f [0,0,0,0,0,2|2,0,0]=4 2940 B9R0.1 CC[C@H](C)OCCC(=O)C 57f743174dad87e641f434790222523a [0,0,0,0,0,2|1,0,0]=3 2941 B9R0.1 CC[C@H](C)OCCC(=O)N 13ca221b762a4b3d6b0303649fde7620 [0,0,0,0,0,2|1,0,0]=3 2942 B9R0.1 CC[C@H](C)OCCC(=O)O 8aec70cd34e530a63d290d1ba3130012 [0,0,0,0,0,2|0,0,0]=2 2943 B9R0.1 CC[C@H](C)OCCS(=O)C 565808f685a16233d5f19d85e2024055 [0,0,0,0,0,2|2,0,0]=4 2944 B9R0.1 CC[C@H](C)OCOC(=O)C f590ede741d93a99ae3c6a1bb1672402 [0,0,0,0,0,2|1,0,0]=3 2945 B9R0.1 CC[C@H](C)OCSC(=O)N 26fb1e031263c83f28320f3d7239855b [0,0,0,0,0,2|1,0,0]=3 2946 B9R0.1 CN(CF)CCCC(=O)O ca2d2af989107fbb2003dee075ad73ef [0,0,0,0,0,2|2,0,0]=4 2947 B9R0.1 CN(CO)CCCC(=O)O 15d2d5e0a3745bcbc8af1be8c111eca1 [0,0,0,0,0,2|2,0,0]=4 2948 B9R0.1 COC(C)CNCC(=O)C a496551dd3631b02d91d02c1cf1f9a01 [0,0,0,0,0,2|2,0,0]=4 2949 B9R0.1 COC(C)CNCC(=O)N c406d754cedf46f953aabf5f2b6c5f83 [0,0,0,0,0,2|2,0,0]=4 2950 B9R0.1 COC(C)CNCC(=O)O dbf8e5faee7152132e5d4bb3bd4e4843 [0,0,0,0,0,2|1,0,0]=3 2951 B9R0.1 COC(C)COCC(=O)C 3142f37743266362b2effa0bced7ba98 [0,0,0,0,0,2|2,0,0]=4 2952 B9R0.1 COC(C)COCC(=O)N 043fe304acc48d7988a07ed3f995965a [0,0,0,0,0,2|2,0,0]=4 2953 B9R0.1 COC(C)COCC(=O)O 80e727ea49a776af207e2b913ddb7306 [0,0,0,0,0,2|1,0,0]=3 2954 B9R0.1 COC(C)COCS(=O)O 5e5ef287229ea40bbf39a36b32c895f6 [0,0,0,0,0,2|2,0,0]=4 2955 B9R0.1 CO[C@@H](C)CNCC(=O)C 7198624c11de30df71b09e1e81cad62d [0,0,0,0,0,2|2,0,0]=4 2956 B9R0.1 CO[C@@H](C)CNCC(=O)N e607cb12070ca1a41a2d7ac47b7100ff [0,0,0,0,0,2|2,0,0]=4 2957 B9R0.1 CO[C@@H](C)CNCC(=O)O 65dd78747dc8a0d82266cff86cc9f8ee [0,0,0,0,0,2|1,0,0]=3 2958 B9R0.1 CO[C@@H](C)COCC(=O)C 8fa47a19787c56e3041f0099c3b9f382 [0,0,0,0,0,2|2,0,0]=4 2959 B9R0.1 CO[C@@H](C)COCC(=O)N 606070aa116c4601f0bb391f8a9522c6 [0,0,0,0,0,2|2,0,0]=4 2960 B9R0.1 CO[C@@H](C)COCC(=O)O a1f6e6081969a90d511bdcf1d36c7fb3 [0,0,0,0,0,2|1,0,0]=3 2961 B9R0.1 CO[C@@H](C)COCS(=O)O 9ca31fa9648066bf445522028cd02f8a [0,0,0,0,0,2|2,0,0]=4 2962 B9R0.1 CO[C@H](C)CNCC(=O)C 8d7b3f7b6bbe18398470ba66d5033f7d [0,0,0,0,0,2|2,0,0]=4 2963 B9R0.1 CO[C@H](C)CNCC(=O)N 6f53ca4bf47d6016b38536d82bb3bea6 [0,0,0,0,0,2|2,0,0]=4 2964 B9R0.1 CO[C@H](C)CNCC(=O)O 84e5827c180a6cfe438de358774cfb15 [0,0,0,0,0,2|1,0,0]=3 2965 B9R0.1 CO[C@H](C)COCC(=O)C 925cd39e23e3c2b6a4f7853c64166350 [0,0,0,0,0,2|2,0,0]=4 2966 B9R0.1 CO[C@H](C)COCC(=O)N ca233f244286a0b7232c14b3d8ba2757 [0,0,0,0,0,2|2,0,0]=4 2967 B9R0.1 CO[C@H](C)COCC(=O)O 1bc7d85404b0152996a2e6730e1ced0b [0,0,0,0,0,2|1,0,0]=3 2968 B9R0.1 CO[C@H](C)COCS(=O)O 19475c8640a8c02734eb8ca4e49bb7ed [0,0,0,0,0,2|2,0,0]=4 2969 B9R0.1 C[C@@H](CO)CNCC(=O)N 95d4f46f098a8874b30eaaa2710258a6 [0,0,0,0,0,2|2,0,0]=4 2970 B9R0.1 C[C@@H](CO)CNCC(=O)O f57e9d31ced751b25fdd665565e647c4 [0,0,0,0,0,2|1,0,0]=3 2971 B9R0.1 C[C@@H](CO)NCCC(=O)N 81eea7dbe7f903d97595b667a60b47f9 [0,0,0,0,0,2|2,0,0]=4 2972 B9R0.1 C[C@@H](CO)NCCC(=O)O b5ac644d36a232bdd1950d74e0718263 [0,0,0,0,0,2|1,0,0]=3 2973 B9R0.1 C[C@@H](CO)NCCS(=O)O 1e1fd01bdcf7dd1461208ea5f8e01cea [0,0,0,0,0,2|2,0,0]=4 2974 B9R0.1 C[C@@H](CO)NCSC(=O)N 1f91c2772e5ac2a2bdfb3044758a38ec [0,0,0,0,0,2|2,0,0]=4 2975 B9R0.1 C[C@H](C=O)NCCC(=O)O 568b307ebcb4ab5b4df113dd91c9a6dc [0,0,0,0,0,2|1,0,1]=4 2976 B9R0.1 C[C@H](C=O)OCCC(=O)O 6123759046df411af3794a1ca6644131 [0,0,0,0,0,2|1,0,1]=4 2977 B9R0.1 C[C@H](CO)CNCC(=O)N 54d59c4b8d1eedf9603fa590919322a3 [0,0,0,0,0,2|2,0,0]=4 2978 B9R0.1 C[C@H](CO)CNCC(=O)O ce3fe074090d41b3d881458baf420cde [0,0,0,0,0,2|1,0,0]=3 2979 B9R0.1 C[C@H](CO)NCCC(=O)N 9104073cf14f07aa3bfbe209e7cf4529 [0,0,0,0,0,2|2,0,0]=4 2980 B9R0.1 C[C@H](CO)NCCC(=O)O a31ff9e016b023eff4f0af52b348f8ec [0,0,0,0,0,2|1,0,0]=3 2981 B9R0.1 C[C@H](CO)NCCS(=O)O bc5457376529f9b425df01e6c2085a40 [0,0,0,0,0,2|2,0,0]=4 2982 B9R0.1 C[C@H](CO)NCSC(=O)N 6b3cba2db784fea63cd80b279b8c8884 [0,0,0,0,0,2|2,0,0]=4 2983 B9R0.1 C[C@H](CS)OCCC(=O)N b70342dff22e2acfef39f97500e9adb6 [0,0,0,0,0,2|2,0,0]=4 2984 B9R0.1 C[C@H](CS)OCSC(=O)N 7b21992cd5b638bbb1e4b23fd957ad40 [0,0,0,0,0,2|2,0,0]=4 2985 B9R0.1 O=C(O)CNCC(Br)CBr ef99ec62c4dafd35d1f7c73687c4dec8 [0,0,0,0,0,2|2,0,0]=4 2986 B9R0.1 O=C(O)CNCC(F)CO 85480065cb6f22ce4951c43a5529025b [0,0,0,0,0,2|2,0,0]=4 2987 B9R0.1 O=C(O)CNCC(O)CF 7fd10536ea2bd1a0c281f0149c46efaf [0,0,0,0,0,2|2,0,0]=4 2988 B9R0.1 O=C(O)CNCC(O)CO 5f4a685d53a0215015208fab45cb0871 [0,0,0,0,0,2|2,0,0]=4 2989 B9R0.1 O=C(O)CNC[C@@H](F)CO b256d92caab1484241eb0944f0d426c8 [0,0,0,0,0,2|2,0,0]=4 2990 B9R0.1 O=C(O)CNC[C@@H](O)CO 2e94e974e33de52da795c25edb2b7b46 [0,0,0,0,0,2|2,0,0]=4 2991 B9R0.1 O=C(O)CNC[C@H](F)CO 88b9d73cd1b06b779c0e456bbf2e093b [0,0,0,0,0,2|2,0,0]=4 2992 B9R0.1 O=C(O)CNC[C@H](O)CO 54e6a925352e55eb05de7ec2030c642a [0,0,0,0,0,2|2,0,0]=4 2993 B9R0.1 O=C(O)COCC(Br)CBr c9888022ccc9e04c0d413c09e25a4398 [0,0,0,0,0,2|2,0,0]=4 2994 B9R0.1 O=C(O)COCC(Cl)CCl 994d616ba6176a710bbd4f21d078567d [0,0,0,0,0,2|2,0,0]=4 2995 B9R0.1 O=C(O)COCC(O)CO 250d3f6a92b33993adc8c4afdc32ab2a [0,0,0,0,0,2|2,0,0]=4 2996 B9R0.1 O=C(O)COCC(S)CS b6b6009a9d63c8f64670de6b0713a6af [0,0,0,0,0,2|2,0,0]=4 2997 B9R0.1 O=C(O)COC[C@@H](O)CO 60e0a11559d7478c0b36eb2f406dfa86 [0,0,0,0,0,2|2,0,0]=4 2998 B9R0.1 O=C(O)COC[C@H](O)CO 846143e05728715a8a55aff47672ac25 [0,0,0,0,0,2|2,0,0]=4