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[1,0,0,0,0,0|2,0,0]=3 129 B8R0.15 CC[C@@H](NC#N)C(=O)O 88a898e4203ef234e769571e9f416da9 [1,0,0,0,0,0|2,0,1]=4 130 B8R0.15 CC[C@@H](NCF)C(=O)O 9592ba18488e06d007c56e3bb749b243 [1,0,0,0,0,0|2,0,0]=3 131 B8R0.15 CC[C@@H](NCO)C(=O)O 97715112de1ce5ecb2509133cc9cdaa1 [1,0,0,0,0,0|2,0,0]=3 132 B8R0.15 CC[C@@H](OCF)C(=O)O 04c614c037a7fb2cad756976721bea17 [1,0,0,0,0,0|2,0,0]=3 133 B8R0.15 CC[C@H](NC#N)C(=O)O 980ab87570d499158253b3f0ba64409b [1,0,0,0,0,0|2,0,1]=4 134 B8R0.15 CC[C@H](NCF)C(=O)N 75c0f415f49388ef58931a8345c05589 [1,0,0,0,0,0|3,0,0]=4 135 B8R0.15 CC[C@H](NCF)C(=O)O 92c72ae7fc2c9386004189c4ccda19a9 [1,0,0,0,0,0|2,0,0]=3 136 B8R0.15 CC[C@H](NCO)C(=O)N 447f79d1a4a79d049ea2d6100ab9facb [1,0,0,0,0,0|3,0,0]=4 137 B8R0.15 CC[C@H](NCO)C(=O)O 095847387652246d94b75d260940e322 [1,0,0,0,0,0|2,0,0]=3 138 B8R0.15 CC[C@H](OCF)C(=O)O c3e3503168943a92d052ee029c13c59a [1,0,0,0,0,0|2,0,0]=3 139 B8R0.15 O=C(O)C(CCl)NCF 345f20f31e3e9323b766d08f3e4d0312 [1,0,0,0,0,0|3,0,0]=4 140 B8R0.15 O=C(O)C(CCl)NCO 87909341b2a2401adb94a3e449acbeeb [1,0,0,0,0,0|3,0,0]=4 141 B8R0.15 O=C(O)C(CF)NCF 3c68b2ec2d74233cffc4fb4e71bbb94b [1,0,0,0,0,0|3,0,0]=4 142 B8R0.15 O=C(O)C(CF)NCO 8882ba16164d78cec81fe4b00fda2ae1 [1,0,0,0,0,0|3,0,0]=4 143 B8R0.15 O=C(O)C(CO)NCF 9eea1e72a00cd3dd12c33ca4052b702a [1,0,0,0,0,0|3,0,0]=4 144 B8R0.15 O=C(O)C(CO)NCO 81ff67930a96f8f373a876534f5a354d [1,0,0,0,0,0|3,0,0]=4 145 B8R0.15 O=C(O)C(CS)NCF d2bcc921a07d6c66ec8feced8008b3d2 [1,0,0,0,0,0|3,0,0]=4 146 B8R0.15 O=C(O)C(CS)NCO b3a632b39e14452fb76e40a3b45f1330 [1,0,0,0,0,0|3,0,0]=4 147 B8R0.15 O=C(O)[C@@H](CCl)NCF 0f4882ad0f84646d0776c613bf998da9 [1,0,0,0,0,0|3,0,0]=4 148 B8R0.15 O=C(O)[C@@H](CCl)NCO a657e82377b90be09b01db5df6746084 [1,0,0,0,0,0|3,0,0]=4 149 B8R0.15 O=C(O)[C@@H](CF)OCF 5ca8d51c8b5d5b379a86da0372761524 [1,0,0,0,0,0|3,0,0]=4 150 B8R0.15 O=C(O)[C@@H](CO)NCF b58ae15b4649cf9eff033a92ba589b35 [1,0,0,0,0,0|3,0,0]=4 151 B8R0.15 O=C(O)[C@@H](CO)NCO cfec0a60446fa32f24138a7f54bc9bb8 [1,0,0,0,0,0|3,0,0]=4 152 B8R0.15 O=C(O)[C@@H](CS)NCF f755fd948c7a145e65bf11358747b457 [1,0,0,0,0,0|3,0,0]=4 153 B8R0.15 O=C(O)[C@@H](CS)NCO 0f499f5952378dffba3785ff4ae4c019 [1,0,0,0,0,0|3,0,0]=4 154 B8R0.15 O=C(O)[C@H](CCl)NCF 750706009ff6f282f1ca980848f7e16b [1,0,0,0,0,0|3,0,0]=4 155 B8R0.15 O=C(O)[C@H](CCl)NCO 45f6f42413f314b49f1c79dfa3cea815 [1,0,0,0,0,0|3,0,0]=4 156 B8R0.15 O=C(O)[C@H](CO)NCF e3967553d1a093cbd0dce0f9d6a1e608 [1,0,0,0,0,0|3,0,0]=4 157 B8R0.15 O=C(O)[C@H](CO)NCO 08a1cdec07261d180e41b733dfd606d7 [1,0,0,0,0,0|3,0,0]=4 158 B8R0.15 O=C(O)[C@H](CS)NCF acd5dd73331d3e22705923fab1a8feaf [1,0,0,0,0,0|3,0,0]=4 159 B8R0.15 O=C(O)[C@H](CS)NCO 1ed62aac1780461a449b2c14b61eaf37 [1,0,0,0,0,0|3,0,0]=4 160 B8R0.22 C#CC(CCC)OCC f22d8bf31fea2adfe9fa207ed6558425 [1,0,0,0,0,0|2,0,1]=4 161 B8R0.22 C=CC(CCC)OCC 83f7ef8d30a51e1e5c4db64e2faf14e7 [1,0,0,0,0,0|2,0,0]=3 162 B8R0.22 C=CC(CCC)OCF f2ad51c370e6c1e95441feeeebf65549 [1,0,0,0,0,0|3,0,0]=4 163 B8R0.22 C=CCN(C=O)CCC 8915f0bd4ca3257466688dc7b8e97b40 [1,0,0,0,0,0|1,0,2]=4 164 B8R0.22 CCCC(C#N)OCC a338cf0a28ea8309ca076bf548560d98 [1,0,0,0,0,0|2,0,1]=4 165 B8R0.22 CCCC(CC)OCC 2f33f90cfe6f34bcef6403a269e3e2c2 [1,0,0,0,0,0|2,0,1]=4 166 B8R0.22 CCCC(CO)NCC b8c7f0be112f24c01dd7f8415b0a6e3f [1,0,0,0,0,0|1,0,1]=3 167 B8R0.22 CCCC(CO)NCF 599320bd2be0747b8bed7df28621facb [1,0,0,0,0,0|2,0,1]=4 168 B8R0.22 CCCC(CO)NCO 9c3e40eec7a20c9c6bcd4b99ddb42413 [1,0,0,0,0,0|2,0,1]=4 169 B8R0.22 CCCN(C=O)CCC b8d16e0fe5e219991097fa7af52168fc [1,0,0,0,0,0|1,0,0]=2 170 B8R0.22 CCCN(C=O)CCO 05c7e3c748b410d220017381f77da8d3 [1,0,0,0,0,0|2,0,0]=3 171 B8R0.22 CCCN(CC)CCC fbdeabbee1b9c3e90ce0dba0622f60e1 [1,0,0,0,0,0|2,0,1]=4 172 B8R0.22 CCCN(CF)CCC 13308840e37fb0db9101f8040f290680 [1,0,0,0,0,0|2,0,1]=4 173 B8R0.22 CCCN(CO)CCC 8895812a51d2f9ffd61abab1a697cc71 [1,0,0,0,0,0|1,0,1]=3 174 B8R0.22 CCCN(CO)CCO a9884a3b6c19ddd60ead7c1eabb3daee [1,0,0,0,0,0|2,0,1]=4 175 B8R0.22 CCC[C@@H](CC)OCC b58a52b0075a76b2b518807461776ed4 [1,0,0,0,0,0|2,0,1]=4 176 B8R0.22 CCC[C@@H](CO)NCC 56ab3d096c6223ec587ad816d0445356 [1,0,0,0,0,0|1,0,1]=3 177 B8R0.22 CCC[C@@H](CO)NCF b4bd85eb9c57e1dedb8d9d2040f14dab [1,0,0,0,0,0|2,0,1]=4 178 B8R0.22 CCC[C@@H](CO)NCO 4ac90204e4f97fc46e69b3f0ded63d81 [1,0,0,0,0,0|2,0,1]=4 179 B8R0.22 CCC[C@H](CO)NCC 9c47d0227f2e89819e7d2ecbd9f9d4a0 [1,0,0,0,0,0|1,0,1]=3 180 B8R0.22 CCC[C@H](CO)NCF 105c0bc98bbce77139d17902b348729a [1,0,0,0,0,0|2,0,1]=4 181 B8R0.22 CCC[C@H](CO)NCO e0683eee624d27f46b1a3348d30863a7 [1,0,0,0,0,0|2,0,1]=4 182 B8R0.22 CCNC(CO)CCO 236b212c9afd3f6159230d9b4b9c0ea7 [1,0,0,0,0,0|2,0,1]=4 183 B8R0.22 CCNC(CO)COC dc5a421175bec4d1104a8cefc3c5c193 [1,0,0,0,0,0|2,0,1]=4 184 B8R0.22 CCNC(CO)CSC 0e65411c385155047d82063e7040c80c [1,0,0,0,0,0|2,0,1]=4 185 B8R0.22 CCN[C@@H](CO)CCO e7b1ee3f6445a52557c502ec712e1ce8 [1,0,0,0,0,0|2,0,1]=4 186 B8R0.22 O=CN(CCCl)CCCl 054ac3afb7fe32e280913aeabd7450cf [1,0,0,0,0,0|3,0,0]=4 187 B8R0.22 O=CN(CCO)CCO c0fe14cb4fe87b0f51f8507a4f962117 [1,0,0,0,0,0|3,0,0]=4 188 B10R0.23 C#CCC(NC(C)C)C(=O)O 7d3a895a661582a3c66fbad28e4d92ee [0,1,0,0,0,0|1,0,2]=4 189 B10R0.23 C#CCC(OC(C)C)C(=O)O 9a32336194da7a0e1bc051465a74811b [0,1,0,0,0,0|1,0,2]=4 190 B10R0.23 C#CC[C@@H](NC(C)C)C(=O)O 39621e4b9b663f2b70b61743e125ec63 [0,1,0,0,0,0|1,0,2]=4 191 B10R0.23 C#CC[C@H](NC(C)C)C(=O)O 6aea11c01ee91472998d42152358d856 [0,1,0,0,0,0|1,0,2]=4 192 B10R0.23 C=C(Br)CC(NCC)C(=O)O 384d820349571762b7d589eb1a0387de [0,1,0,0,0,0|1,0,2]=4 193 B10R0.23 C=C(Br)C[C@@H](NCC)C(=O)O 9f9c4aa094d33f690322dc2b7812b5f7 [0,1,0,0,0,0|1,0,2]=4 194 B10R0.23 C=C(Br)C[C@H](NCC)C(=O)O e068d92fccb033a2060a864d8f7ed4e0 [0,1,0,0,0,0|1,0,2]=4 195 B10R0.23 C=C(C)CC(NCC)C(=O)O 2eca2034c808f95f90cb400140b6d31e [0,1,0,0,0,0|1,0,1]=3 196 B10R0.23 C=C(C)CC(NCF)C(=O)O 16b4aa6ed593eadcf231214bd7115985 [0,1,0,0,0,0|2,0,1]=4 197 B10R0.23 C=C(C)CC(NCO)C(=O)O 21bd846742871347d606f49bae49cce0 [0,1,0,0,0,0|2,0,1]=4 198 B10R0.23 C=C(C)C[C@@H](NCC)C(=O)O 880e45a2990ec8168498ef85588b7787 [0,1,0,0,0,0|1,0,1]=3 199 B10R0.23 C=C(C)C[C@@H](NCF)C(=O)O 9fa8ac0df68c706fc7e3a1499f604233 [0,1,0,0,0,0|2,0,1]=4 200 B10R0.23 C=C(C)C[C@@H](NCO)C(=O)O 2863ee5ae1d870720d82afa3bad9f01d [0,1,0,0,0,0|2,0,1]=4 201 B10R0.23 C=C(C)C[C@H](NCC)C(=O)O 0fe5183e4ab50215fdc9e56b3be89a36 [0,1,0,0,0,0|1,0,1]=3 202 B10R0.23 C=C(C)C[C@H](NCF)C(=O)O 32c392f3948167c8f86f23eebf083162 [0,1,0,0,0,0|2,0,1]=4 203 B10R0.23 C=C(C)C[C@H](NCO)C(=O)O 27e4117e5a2a9d8247a3d4e3975b61a3 [0,1,0,0,0,0|2,0,1]=4 204 B10R0.23 C=CCC(NC(C)C)C(=O)O c8f1f103ce5bb6669c67669ff102fced [0,1,0,0,0,0|1,0,2]=4 205 B10R0.23 C=CC[C@@H](NC(C)C)C(=O)O c9344d09df064fa77fef6130d2361108 [0,1,0,0,0,0|1,0,2]=4 206 B10R0.23 C=CC[C@H](NC(C)C)C(=O)O 3bf23e66a4cb2d6bbe514df9c8ab6468 [0,1,0,0,0,0|1,0,2]=4 207 B10R0.23 CC(=O)N(CCO)CC(C)O bf050a8669664657077ee2cd74416220 [0,1,0,0,0,0|3,0,0]=4 208 B10R0.23 CC(C)CC(NC#N)C(=O)O 7c6bfaff3e183b5403d55b17d218ecab [0,1,0,0,0,0|2,0,1]=4 209 B10R0.23 CC(C)CC(NCF)C(=O)N 365bf2513042a77c1f9a4fe1934ea080 [0,1,0,0,0,0|3,0,0]=4 210 B10R0.23 CC(C)CC(NCF)C(=O)O 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CSCC(NCC#N)C(=O)O 1dff72eccb469aa23daac28f5b47799c [0,1,0,0,0,0|2,0,1]=4 657 B10R0.88 CSCC(NCC=O)C(=O)O c767d0404207f2a48c2b5cf8094f661d [0,1,0,0,0,0|2,0,1]=4 658 B10R0.88 CSCC(NCCF)C(=O)O 387e2c34edd3c4f31d4d6c1714e3a613 [0,1,0,0,0,0|2,0,0]=3 659 B10R0.88 CSCC(NCCO)C(=O)O 9b0246152425508ef45691f8df60c478 [0,1,0,0,0,0|2,0,0]=3 660 B10R0.88 CSCC(NCCS)C(=O)O 70bed0232b19f6d97f6c500a45655bd4 [0,1,0,0,0,0|2,0,0]=3 661 B10R0.88 CSCC(OCC#N)C(=O)O b426ac4b31c9845bd80feefd64c21197 [0,1,0,0,0,0|2,0,1]=4 662 B10R0.88 CSCC(OCC=O)C(=O)O fd2e4cb81c8b931146dac711dd1b18b5 [0,1,0,0,0,0|2,0,1]=4 663 B10R0.88 CSCC(OCCF)C(=O)O e50858eb69190b237940ac60b5e8c13e [0,1,0,0,0,0|2,0,0]=3 664 B10R0.88 CSCC(OCCS)C(=O)O d2f79da8d4a0f5d44b4b08d42fbed0b3 [0,1,0,0,0,0|2,0,0]=3 665 B10R0.88 CSCCC(NCF)C(=O)O 0c886b73faabbd0b0069934c6a32b004 [0,1,0,0,0,0|2,0,0]=3 666 B10R0.88 CSCCC(NCO)C(=O)O 6e5a81214f86db9f27b5ff3a42c7381a [0,1,0,0,0,0|2,0,0]=3 667 B10R0.88 CSCCC(OCF)C(=O)N 073a70193e54499964f77d2f2a3b0453 [0,1,0,0,0,0|3,0,0]=4 668 B10R0.88 CSCCC(OCF)C(=O)O 186c11e4386295b5dbff8378fc2f594b [0,1,0,0,0,0|2,0,0]=3 669 B10R0.88 CSCC[C@@H](NCF)C(=O)O d9b7ca4fa2852a050059a1f69879eaa8 [0,1,0,0,0,0|2,0,0]=3 670 B10R0.88 CSCC[C@@H](NCO)C(=O)O cfe1b330a9d04d7bbee42e773919874f [0,1,0,0,0,0|2,0,0]=3 671 B10R0.88 CSCC[C@H](NCF)C(=O)N 124473b46df64f34c9a047eebb73f84d [0,1,0,0,0,0|3,0,0]=4 672 B10R0.88 CSCC[C@H](NCF)C(=O)O 7a45bb08ad4052f001315259fa153a10 [0,1,0,0,0,0|2,0,0]=3 673 B10R0.88 CSCC[C@H](NCO)C(=O)N 069e2eb56aa6805fcac2b635ff869b46 [0,1,0,0,0,0|3,0,0]=4 674 B10R0.88 CSCC[C@H](NCO)C(=O)O 5343fc90446948f8f7453c75ed67c8a5 [0,1,0,0,0,0|2,0,0]=3 675 B10R0.88 CSCNC(CC#N)C(=O)O fa2aa52a9047d2ee55eaf1b6900116cb [0,1,0,0,0,0|2,0,1]=4 676 B10R0.88 CSCNC(CCO)C(=O)O 0f861be9f3327dca9fbcca271bbf822e [0,1,0,0,0,0|2,0,0]=3 677 B10R0.88 CSCNC(CCS)C(=O)O 35b1ac35fe92a2d41b0439bf0bb4380d [0,1,0,0,0,0|2,0,0]=3 678 B10R0.88 CSCNC(CSC)C(=O)O 6bf3dfbdf28278664db4dfbe958e8ab8 [0,1,0,0,0,0|2,0,0]=3 679 B10R0.88 CSCN[C@@H](CC#N)C(=O)O f43055684f04597bb0019963478ca92a [0,1,0,0,0,0|2,0,1]=4 680 B10R0.88 CSCN[C@@H](CCO)C(=O)O 399c4bbfa5d6b0fabeb41fae34c11236 [0,1,0,0,0,0|2,0,0]=3 681 B10R0.88 CSCN[C@@H](CCS)C(=O)O a76da271b32f04c1455d3492de2c8969 [0,1,0,0,0,0|2,0,0]=3 682 B10R0.88 CSCN[C@@H](CSC)C(=O)O 08ba77ef27db18c76ebd24ec81324895 [0,1,0,0,0,0|2,0,0]=3 683 B10R0.88 CSCN[C@H](CCO)C(=O)O 2821e9de670f09abbba35a1a4a4e4de5 [0,1,0,0,0,0|2,0,0]=3 684 B10R0.88 CSCN[C@H](CCS)C(=O)O 0c6da1cc1faffad35e1f70227574a9a0 [0,1,0,0,0,0|2,0,0]=3 685 B10R0.88 CSCN[C@H](CSC)C(=O)O c2db35c9b6861dede067cf45c446effa [0,1,0,0,0,0|2,0,0]=3 686 B10R0.88 CSCOC(CSC)C(=O)O ae04146b7dbb41398491f31e30294abb [0,1,0,0,0,0|2,0,0]=3 687 B10R0.88 CSC[C@@H](NCC#N)C(=O)O ef28d743ad76671d0802b80959614025 [0,1,0,0,0,0|2,0,1]=4 688 B10R0.88 CSC[C@@H](NCC=O)C(=O)O 7f1fe8036b50b9cc3ba7ef7102c0dfea [0,1,0,0,0,0|2,0,1]=4 689 B10R0.88 CSC[C@@H](NCCF)C(=O)O 6bdefff7d62d109cab3646ce91bda116 [0,1,0,0,0,0|2,0,0]=3 690 B10R0.88 CSC[C@@H](NCCO)C(=O)O db744468c2e6ba224895cdb1d32dee97 [0,1,0,0,0,0|2,0,0]=3 691 B10R0.88 CSC[C@@H](NCCS)C(=O)O 62a4ad55a1dd0aaba40a9f9be9e7b284 [0,1,0,0,0,0|2,0,0]=3 692 B10R0.88 CSC[C@H](NCC#N)C(=O)O 4c2962523cfec18433681bedcd612f97 [0,1,0,0,0,0|2,0,1]=4 693 B10R0.88 CSC[C@H](NCC=O)C(=O)O 80ec6b72ce46da8c2fc659fa2edc7c30 [0,1,0,0,0,0|2,0,1]=4 694 B10R0.88 CSC[C@H](NCCF)C(=O)O 4f4b5a02bb07cf070a8c4556699c2035 [0,1,0,0,0,0|2,0,0]=3 695 B10R0.88 CSC[C@H](NCCO)C(=O)O 4564bc800b036ecce5622569ae4a4510 [0,1,0,0,0,0|2,0,0]=3 696 B10R0.88 CSC[C@H](NCCS)C(=O)O 3e761028d9edaf60a4e394137f1047a2 [0,1,0,0,0,0|2,0,0]=3 697 B10R0.88 N#CCC(NCCF)C(=O)O b598e6d17b4973b75fdacc96f655d637 [0,1,0,0,0,0|2,0,1]=4 698 B10R0.88 N#CCC(NCCO)C(=O)O db7200941b32fc57148ba77f9c710493 [0,1,0,0,0,0|2,0,1]=4 699 B10R0.88 N#CCC(NCCS)C(=O)O 4ec20c55e1bf70db63c0fa7cf44eb4dc [0,1,0,0,0,0|2,0,1]=4 700 B10R0.88 N#CCNC(CCO)C(=O)O 97087304eb624446b7d26993ceb7fb73 [0,1,0,0,0,0|2,0,1]=4 701 B10R0.88 N#CCNC(CCS)C(=O)O 6b214bb18e3e9627e3f422fd409fd259 [0,1,0,0,0,0|2,0,1]=4 702 B10R0.88 N#CCN[C@@H](CCO)C(=O)O 9b03d4ca98b86dcd3f323c6f4db88a34 [0,1,0,0,0,0|2,0,1]=4 703 B10R0.88 N#CCN[C@@H](CCS)C(=O)O 5142f5a62c86802ad799dfcd0c95d155 [0,1,0,0,0,0|2,0,1]=4 704 B10R0.88 N#CCN[C@H](CCO)C(=O)O 9f991e2352e91e8b8e4a42cbda6c2466 [0,1,0,0,0,0|2,0,1]=4 705 B10R0.88 N#CCN[C@H](CCS)C(=O)O e452fc9ba22b12c555f793130b0794cf [0,1,0,0,0,0|2,0,1]=4 706 B10R0.88 N#CC[C@H](NCCF)C(=O)O 62cd6f838a9ec95d767ba0b6bcecca20 [0,1,0,0,0,0|2,0,1]=4 707 B10R0.88 N#CC[C@H](NCCO)C(=O)O 1e6b8a89d725811c5531f7d2d78b894e [0,1,0,0,0,0|2,0,1]=4 708 B10R0.88 N#CC[C@H](NCCS)C(=O)O 8d9036ed64cf224e79dcb258c18f92e8 [0,1,0,0,0,0|2,0,1]=4 709 B10R0.88 O=C(O)C(CCO)NCCF 000a8e7289778bb871127105b40ad620 [0,1,0,0,0,0|2,0,0]=3 710 B10R0.88 O=C(O)C(CCO)NCCO c4c67840f23c85187b7f17c89e8edfb1 [0,1,0,0,0,0|2,0,0]=3 711 B10R0.88 O=C(O)C(CCO)NCCS 8948f5d3ae8b3d17e441b596e57c73cf [0,1,0,0,0,0|2,0,0]=3 712 B10R0.88 O=C(O)C(CCS)NCCF d7891406a82d72d02d0e8d281c3298dd [0,1,0,0,0,0|2,0,0]=3 713 B10R0.88 O=C(O)C(CCS)NCCO a6236ab3ba9d1e6ed37c5d3fa2513f47 [0,1,0,0,0,0|2,0,0]=3 714 B10R0.88 O=C(O)C(CCS)NCCS 03ca108751a50fc7be0d11affb7a8e42 [0,1,0,0,0,0|2,0,0]=3 715 B10R0.88 O=C(O)[C@@H](CCCO)NCF fbdad64688e550098251346ad0438f08 [0,1,0,0,0,0|2,0,0]=3 716 B10R0.88 O=C(O)[C@@H](CCCO)NCO 383a86a2b4ad761ce6f8767c971513b5 [0,1,0,0,0,0|2,0,0]=3 717 B10R0.88 O=C(O)[C@@H](CCO)NCCF 6252e913eba1ab613af203e3027e4453 [0,1,0,0,0,0|2,0,0]=3 718 B10R0.88 O=C(O)[C@@H](CCO)NCCO cc2f275c78530474fd2159db4a7b8080 [0,1,0,0,0,0|2,0,0]=3 719 B10R0.88 O=C(O)[C@@H](CCO)NCCS 22530aab9cc849970e0990813054e6f2 [0,1,0,0,0,0|2,0,0]=3 720 B10R0.88 O=C(O)[C@@H](CCS)NCCF 10968fa8e3b03cdcaff1f99c2cf9ee7e [0,1,0,0,0,0|2,0,0]=3 721 B10R0.88 O=C(O)[C@@H](CCS)NCCO 2ac44b31304344fe314eeab1ea05853a [0,1,0,0,0,0|2,0,0]=3 722 B10R0.88 O=C(O)[C@@H](CCS)NCCS 46f76b2697acfd12d3352d96153c5db0 [0,1,0,0,0,0|2,0,0]=3 723 B10R0.88 O=C(O)[C@H](CCCO)NCF 06a6a559ad6581cffdc6124692b5fd3b [0,1,0,0,0,0|2,0,0]=3 724 B10R0.88 O=C(O)[C@H](CCCO)NCO 889a19ec250ff9002c88d94420bc98b7 [0,1,0,0,0,0|2,0,0]=3 725 B10R0.88 O=C(O)[C@H](CCO)NCCF 1e474b8b849e202ca82ab2a1202c8931 [0,1,0,0,0,0|2,0,0]=3 726 B10R0.88 O=C(O)[C@H](CCO)NCCO 2ac563b654b5beb9c7753b9004901818 [0,1,0,0,0,0|2,0,0]=3 727 B10R0.88 O=C(O)[C@H](CCO)NCCS 395f1e3f4592d54aa140e17d4e65368d [0,1,0,0,0,0|2,0,0]=3 728 B10R0.88 O=C(O)[C@H](CCS)NCCF 138cc9494e9a099b3c0db409beeccd82 [0,1,0,0,0,0|2,0,0]=3 729 B10R0.88 O=C(O)[C@H](CCS)NCCO 04ce1faf1e85c512a8ee1634d6e2d4fd [0,1,0,0,0,0|2,0,0]=3 730 B10R0.88 O=C(O)[C@H](CCS)NCCS 5a0e4f7ab6b5fbb6f43b7e6a69c6cc51 [0,1,0,0,0,0|2,0,0]=3 731 B10R0.88 O=CCNC(CCO)C(=O)O a745504052ffb795877b7fb081a06c5b [0,1,0,0,0,0|2,0,1]=4 732 B10R0.88 O=CCNC(CCS)C(=O)O 67a125d021cdf3705f8cefa63dbbb541 [0,1,0,0,0,0|2,0,1]=4 733 B10R0.88 O=CCN[C@@H](CCO)C(=O)O 9d21aaa69e92e4f274cd6c60e602b88d [0,1,0,0,0,0|2,0,1]=4 734 B10R0.88 O=CCN[C@@H](CCS)C(=O)O 3002911a2d62c474611626605418372f [0,1,0,0,0,0|2,0,1]=4 735 B10R0.88 O=CCN[C@H](CCO)C(=O)O f0007df51f62c8b8490bac1a0b43f953 [0,1,0,0,0,0|2,0,1]=4 736 B10R0.88 O=CCN[C@H](CCS)C(=O)O 4a88a5887bc8e48e233bb2f9610c955e [0,1,0,0,0,0|2,0,1]=4 737 B10R0.103 C#CC[C@](C)(NCC)C(=O)O 6c96871f46da216489d8766d79609444 [0,1,0,0,0,0|1,0,2]=4 738 B10R0.103 C=CCC(C)(NCC)C(=O)O c8a8841833b123e25efb8f0730e733b7 [0,1,0,0,0,0|1,0,2]=4 739 B10R0.103 C=CC[C@@](C)(NCC)C(=O)O 804b6a85ad360d42abcd78194581af74 [0,1,0,0,0,0|1,0,2]=4 740 B10R0.103 C=CC[C@](C)(NCC)C(=O)O 4b6652197a15caa78eb8c5bfbc55ac0c [0,1,0,0,0,0|1,0,2]=4 741 B10R0.103 CCCC(C)(NCC)C(=O)O 24ced4f1c219c5b634e2a84640fad5de [0,1,0,0,0,0|1,0,0]=2 742 B10R0.103 CCCC(C)(NCF)C(=O)O fed7d77be6b4e58c3ee4ec310842dccb [0,1,0,0,0,0|2,0,0]=3 743 B10R0.103 CCCC(C)(NCO)C(=O)O 4f77fce9fbaaa2cd6b3630c87b468f86 [0,1,0,0,0,0|2,0,0]=3 744 B10R0.103 CCC[C@@](C)(NCC)C(=O)O 39674ba7d5b0b81b2d6a701cb96a3d1a [0,1,0,0,0,0|1,0,0]=2 745 B10R0.103 CCC[C@@](C)(NCF)C(=O)O a752deeb1b5183c004a72f2167f28173 [0,1,0,0,0,0|2,0,0]=3 746 B10R0.103 CCC[C@@](C)(NCO)C(=O)O 47696fd68ebef53e899dfe962308a5aa [0,1,0,0,0,0|2,0,0]=3 747 B10R0.103 CCC[C@](C)(NCC)C(=O)O 3b78987b8c243f1a63aa722c651d8150 [0,1,0,0,0,0|1,0,0]=2 748 B10R0.103 CCC[C@](C)(NCF)C(=O)O 1f0b05b7bafec99809fde4df126400d7 [0,1,0,0,0,0|2,0,0]=3 749 B10R0.103 CCC[C@](C)(NCO)C(=O)O 45df2b27c9b2d5144f8c0b7f163edd91 [0,1,0,0,0,0|2,0,0]=3 750 B10R1.4 CCNC1CCCCC1O cab70b0d7048631dfdcbfe71841f0fdb [0,0,0,1,0,0|2,0,1]=4 751 B10R1.4 CCNC1CCCNC1=O 2611d2046d7c302d155fa2575da996cf [0,0,0,1,0,0|2,0,0]=3 752 B10R1.4 CCN[C@@H]1CCCC[C@H]1O 3560f2039731995ef233caf22329f344 [0,0,0,1,0,0|2,0,1]=4 753 B10R1.4 CCN[C@@H]1CCCNC1=O cc017d9a7d93a52deca7f6d6027f7b45 [0,0,0,1,0,0|2,0,0]=3 754 B10R1.4 CCN[C@H]1CCCC[C@@H]1O f5999981aedc57da02406a7fea523d0c [0,0,0,1,0,0|2,0,1]=4 755 B10R1.4 CCN[C@H]1CCCC[C@H]1O 82496c56f17d72e49ca2b5b4b02bb9b0 [0,0,0,1,0,0|2,0,1]=4 756 B10R1.4 CCN[C@H]1CCCNC1=O b5bc0fce4a04ce1c92ba3448cfe5c3bb [0,0,0,1,0,0|2,0,0]=3 757 B10R1.4 CCOC1CCCC=C1Br 8b5ae23691a1fd3707eb4fe503b17e25 [0,0,0,1,0,0|3,0,0]=4 758 B10R1.4 CCOC1CCCCC1=O 507ef4f19e89191dc15f42fb27f687ef [0,0,0,1,0,0|2,0,0]=3 759 B10R1.4 CCOC1CCCNC1=O d77b412772c0bf6233d2065933079649 [0,0,0,1,0,0|2,0,0]=3 760 B10R1.4 CCOC1CCCOC1=O d4265b269bf6c6ab661ef37336fd46b1 [0,0,0,1,0,0|1,0,0]=2 761 B10R1.4 CCO[C@@H]1CCCNC1=O 425707dc065418b7f6f48728d932be31 [0,0,0,1,0,0|2,0,0]=3 762 B10R1.4 CCO[C@H]1CCCNC1=O 03374b88ae99bfae5d66eeefabf3b11e [0,0,0,1,0,0|2,0,0]=3 763 B10R1.4 O=C1CCCCC1OCF 935910af5320d7ec6c2da0e4043d7c6e [0,0,0,1,0,0|3,0,0]=4 764 B10R1.4 O=C1NCCCC1NCF 0948a0b0430aa0f93f600eae7cddccf4 [0,0,0,1,0,0|3,0,0]=4 765 B10R1.4 O=C1NCCCC1NCO 0c3210b0aaca148eb6f9fff1b309a8c4 [0,0,0,1,0,0|3,0,0]=4 766 B10R1.4 O=C1NCCCC1OCF 2058ddc76c2cbf637d970446ba63e17d [0,0,0,1,0,0|3,0,0]=4 767 B10R1.4 O=C1NCCC[C@@H]1NCF 0dad1bca212e7bad3bdbaba1f9d9effd [0,0,0,1,0,0|3,0,0]=4 768 B10R1.4 O=C1NCCC[C@@H]1NCO 73a5739cccf1b6b2527004147a50f775 [0,0,0,1,0,0|3,0,0]=4 769 B10R1.4 O=C1NCCC[C@@H]1OCF 032d266f3a30445d37c629933183c649 [0,0,0,1,0,0|3,0,0]=4 770 B10R1.4 O=C1NCCC[C@H]1NCF f8df881e1e1c15c3f47f78bee058dd8b [0,0,0,1,0,0|3,0,0]=4 771 B10R1.4 O=C1NCCC[C@H]1NCO 79696dbad388f2cb24bc8983defb5243 [0,0,0,1,0,0|3,0,0]=4 772 B10R1.4 O=C1NCCC[C@H]1OCF ac32f0de6ed196519a099ba29298bb9b [0,0,0,1,0,0|3,0,0]=4 773 B10R1.4 O=C1OCCCC1OCF f9fa5b1f733f20ac404f1515fd8b666d [0,0,0,1,0,0|2,0,0]=3 774 B10R1.39 CC(=O)N1CCCC1CO 3663634b7abd18cbb84622ae336fba13 [0,0,0,1,0,0|3,0,0]=4 775 B10R1.39 CC(=O)N1CCC[C@@H]1CF ab1f1a9f7b90c6246d4807fce03f01b9 [0,0,0,1,0,0|3,0,0]=4 776 B10R1.39 CC(=O)N1CCC[C@@H]1CO c30953bbf0b814708ca046a841e82ee1 [0,0,0,1,0,0|3,0,0]=4 777 B10R1.39 CC(=O)N1CCC[C@H]1CF 974fcba5c623f0b18c298ca4cec034a9 [0,0,0,1,0,0|3,0,0]=4 778 B10R1.39 CC(=O)N1CCC[C@H]1CO 01de1a97629848b07160f2d0111b2996 [0,0,0,1,0,0|3,0,0]=4 779 B10R1.39 CCC1CCCN1C(=O)C af5184853a2fc139326aceb69f54587c [0,0,0,1,0,0|2,0,0]=3 780 B10R1.39 CCN1CC=CC1C(=O)O 89bda72f1795ce7a5213b1771e1a2eff [0,0,0,1,0,0|1,0,2]=4 781 B10R1.39 CCN1CC=C[C@H]1C(=O)O 1bffb48288adbee6e99329e108e2b55e [0,0,0,1,0,0|1,0,2]=4 782 B10R1.39 CCN1CCCC1C(=O)N e3638aebd20ecc50fb364eeffd06aad6 [0,0,0,1,0,0|2,0,0]=3 783 B10R1.39 CCN1CCCC1C(=O)O c3983076958b8fb46558aab447120d49 [0,0,0,1,0,0|1,0,0]=2 784 B10R1.39 CCN1CCCC1C(C)O 2fe3ff32d123d261dc32a6b4f6dd875a [0,0,0,1,0,0|2,0,1]=4 785 B10R1.39 CCN1CCC[C@@H]1C(=O)N c904ceb8698f14197bc2e2ed45042711 [0,0,0,1,0,0|2,0,0]=3 786 B10R1.39 CCN1CCC[C@@H]1C(=O)O 349d3c609c75982b622124f07b341c44 [0,0,0,1,0,0|1,0,0]=2 787 B10R1.39 CCN1CCC[C@@H]1C(C)O 2fcc2db5a9ea947bbbe3b9ddb7004abd [0,0,0,1,0,0|2,0,1]=4 788 B10R1.39 CCN1CCC[C@H]1C(=O)N 5dfa8ecf2b36963e9bcf6d81738e87bd [0,0,0,1,0,0|2,0,0]=3 789 B10R1.39 CCN1CCC[C@H]1C(=O)O cf8e675da710a8a6e34bef600c46b98f [0,0,0,1,0,0|1,0,0]=2 790 B10R1.39 CCN1CCC[C@H]1[C@H](C)O d149234dfbaffe72611b5ed16adf7902 [0,0,0,1,0,0|2,0,1]=4 791 B10R1.39 CCN1CCSC1C(=O)O 23a71743abd51412d8c2f2a54d122163 [0,0,0,1,0,0|2,0,0]=3 792 B10R1.39 CCN1CSCC1C(=O)O 9d58ce7de7d6dc337784b1a458991004 [0,0,0,1,0,0|2,0,0]=3 793 B10R1.39 CCN1CSC[C@@H]1C(=O)O 62a29e6620e574cccad9193dfa1f259a [0,0,0,1,0,0|2,0,0]=3 794 B10R1.39 CCN1CSC[C@H]1C(=O)O c44babec2d6380179adcb6ad018902f6 [0,0,0,1,0,0|2,0,0]=3 795 B10R1.39 CC[C@@H]1CCCN1C(=O)C c75eb2201906f8faab97d30a9bca11c4 [0,0,0,1,0,0|2,0,0]=3 796 B10R1.39 COC1CCCN1C(=O)C 34fe16e8654158db2f38d068503fb822 [0,0,0,1,0,0|3,0,0]=4 797 B10R1.39 NC(=O)C1CCCN1CF 42364bf3efa4f733bbeea2eac179e186 [0,0,0,1,0,0|3,0,0]=4 798 B10R1.39 NC(=O)C1CCCN1CO 798b53a860086bd46413e83881150d01 [0,0,0,1,0,0|3,0,0]=4 799 B10R1.39 NC(=O)[C@@H]1CCCN1CF 5b6e560b5ed03c2cc3ba75bcf9aafe65 [0,0,0,1,0,0|3,0,0]=4 800 B10R1.39 NC(=O)[C@@H]1CCCN1CO ff51148b59c35835bbeab3b8f5088f9f [0,0,0,1,0,0|3,0,0]=4 801 B10R1.39 NC(=O)[C@H]1CCCN1CF 7b625afccb6ca0677b1ebd9c8280efe2 [0,0,0,1,0,0|3,0,0]=4 802 B10R1.39 NC(=O)[C@H]1CCCN1CO 883914c0be6a7acbf4e6e7118ba7a0fc [0,0,0,1,0,0|3,0,0]=4 803 B10R1.39 O=C(O)C1CCCN1CF 2df1b628c3ddddb71f4d9897e6b47849 [0,0,0,1,0,0|2,0,0]=3 804 B10R1.39 O=C(O)C1CCCN1CO 7f02135e9c4c82c9ed8efa6b28dba1a4 [0,0,0,1,0,0|2,0,0]=3 805 B10R1.39 O=C(O)C1CSCN1CF e280dce981ae51d0065753b840b39952 [0,0,0,1,0,0|3,0,0]=4 806 B10R1.39 O=C(O)C1CSCN1CO 2106acef386e3a50e95413bdf5d796ef [0,0,0,1,0,0|3,0,0]=4 807 B10R1.39 O=C(O)C1SCCN1CF d857bdccd90e1a451a9ff359b0359df7 [0,0,0,1,0,0|3,0,0]=4 808 B10R1.39 O=C(O)C1SCCN1CO 6660fe84f679d9f0e1c6807e92c798fa [0,0,0,1,0,0|3,0,0]=4 809 B10R1.39 O=C(O)[C@@H]1CCCN1CF a758da829a884a388b4dac859185ee61 [0,0,0,1,0,0|2,0,0]=3 810 B10R1.39 O=C(O)[C@@H]1CCCN1CO ab593d24831e51749594a3241b86071f [0,0,0,1,0,0|2,0,0]=3 811 B10R1.39 O=C(O)[C@@H]1CSCN1CF 9197deef9b38df9dfc6ff97e22793010 [0,0,0,1,0,0|3,0,0]=4 812 B10R1.39 O=C(O)[C@@H]1CSCN1CO 9e15b3f0ca59bb5648e96edeed1ab489 [0,0,0,1,0,0|3,0,0]=4 813 B10R1.39 O=C(O)[C@H]1CCCN1CF b1270dfad6d1aac80c0fd1f1ac2f6f0d [0,0,0,1,0,0|2,0,0]=3 814 B10R1.39 O=C(O)[C@H]1CCCN1CO cbdfa18e1cbf673fbc79c7d3904d4492 [0,0,0,1,0,0|2,0,0]=3 815 B10R1.39 O=C(O)[C@H]1CSCN1CF e74629e6ec47004dabdb153ad5f5dd02 [0,0,0,1,0,0|3,0,0]=4 816 B10R1.39 O=C(O)[C@H]1CSCN1CO e89e2cd6d57a419293f0a445a727e832 [0,0,0,1,0,0|3,0,0]=4 817 B10R1.52 CCN1[C@@H](C[C@H]1C(=O)O)C 5f5aa26be35ed1f44aefda10af58567a [0,0,0,1,0,0|1,0,0]=2 818 B10R1.52 CCN1[C@H](C[C@H]1C(=O)O)C 028748a9e43d8ce1841fc02a66be6e31 [0,0,0,1,0,0|1,0,0]=2 819 B10R1.52 C[C@@H]1C[C@H](N1CF)C(=O)O 6b5f952a28f541cbd535751406902d70 [0,0,0,1,0,0|2,0,0]=3 820 B10R1.52 C[C@@H]1C[C@H](N1CO)C(=O)O 0fc0644f362cca53024d84d0ec684ad3 [0,0,0,1,0,0|2,0,0]=3 821 B10R1.52 C[C@H]1C[C@H](N1CF)C(=O)O 7fd927463fbb4fc09bab4262eb6a5d1e [0,0,0,1,0,0|2,0,0]=3 822 B10R1.52 C[C@H]1C[C@H](N1CO)C(=O)O 071d92267a48a118c2cc5b3f9d89aa2e [0,0,0,1,0,0|2,0,0]=3 823 B10R1.58 CC(=O)N1CC(C(C1)O)C 3f93682b3b4b4dd42a81bc52163b0f4b [0,0,0,1,0,0|3,0,0]=4 824 B10R1.58 CC(=O)N1C[C@H]([C@H](C1)O)C 4a9d28546cb98f50b9d513f444b98c5b [0,0,0,1,0,0|3,0,0]=4 825 B10R1.113 CC(=O)N1CCCC(C1)C 0e9a46771d1161daa776ff1d4221f7fe [0,0,0,1,0,0|2,0,0]=3 826 B10R1.113 CC(=O)N1CCCC(C1)F ecfd90044ded717974c316fb37c4acae [0,0,0,1,0,0|3,0,0]=4 827 B10R1.113 CC(=O)N1CCCC(C1)O ee540cedaa1a73223284cbbba0d7cd09 [0,0,0,1,0,0|3,0,0]=4 828 B10R1.113 CC(=O)N1CCC[C@@H](C1)C b765ed1c62124058c9e1d3ef1c7b9e7a [0,0,0,1,0,0|2,0,0]=3 829 B10R1.113 CC(=O)N1CCC[C@@H](C1)F 8eefb09c059e9a4a8a9ca29f030a2153 [0,0,0,1,0,0|3,0,0]=4 830 B10R1.113 CC(=O)N1CCC[C@@H](C1)O 7fdf4d521b5ee53ca37891b5a4dd6495 [0,0,0,1,0,0|3,0,0]=4 831 B10R1.113 CC(=O)N1CCC[C@H](C1)C 69b5ef44bfcf1188d639c1f277bb097d [0,0,0,1,0,0|2,0,0]=3 832 B10R1.113 CC(=O)N1CCC[C@H](C1)F 7833fe84784a72fa516bed041bd9bac2 [0,0,0,1,0,0|3,0,0]=4 833 B10R1.113 CC(=O)N1CCC[C@H](C1)O 45f5d9af1194bdf7e75f97a0993057a0 [0,0,0,1,0,0|3,0,0]=4 834 B10R1.113 CC(=O)N1CCOC(C1)C 2b7fd14b8d30a5a11b2e13ef0a74a0cd [0,0,0,1,0,0|3,0,0]=4 835 B10R1.113 CC(=O)N1CCO[C@@H](C1)C 5da3f6f4fd12dc4ae6d56debd02449c5 [0,0,0,1,0,0|3,0,0]=4 836 B10R1.113 CC(=O)N1CCO[C@H](C1)C b8b08f92cddab8fa4532c89b84685382 [0,0,0,1,0,0|3,0,0]=4 837 B10R1.130 CC1CC(C(=O)O1)NC#N 4d188651b9b178f9e7e4ca8d8c0fbacc [0,0,0,1,0,0|2,0,1]=4 838 B10R1.130 CCO[C@@H]1C[C@@H](NC1=O)C d86bcd2eaeb3743a117de1040ae16bf1 [0,0,0,1,0,0|2,0,0]=3 839 B10R1.130 C[C@H]1C[C@H](C(=O)N1)OCF ba275423b4fa1cfa59e588d34d2d1c92 [0,0,0,1,0,0|3,0,0]=4 840 B10R1.133 CCNC1CCCC1(C)O cef76a298faa75cf20392298d986d951 [0,0,0,1,0,0|2,0,1]=4 841 B10R1.133 CCN[C@@H]1CCC[C@@]1(C)O bb030e6801f2bac0e3f3a29bdda6709a [0,0,0,1,0,0|2,0,1]=4 842 B10R1.133 CCN[C@H]1CCC[C@]1(C)O aa09fdd71ee71868360caa9a438eac03 [0,0,0,1,0,0|2,0,1]=4 843 B10R1.290 CC(=O)N(CCO)C1CC1 59d7d63b6675705311c64f3951fabb44 [0,0,0,1,0,0|3,0,0]=4 844 B10R1.290 CCCN(C(=O)C)C1CC1 de1f8ed03a8b339d2f7b330d1f1e3b68 [0,0,0,1,0,0|2,0,0]=3 845 B10R1.290 CCNC(C(=O)N)C1CC1 37d75cf65c2c88c87a057e7662e0a107 [0,0,0,1,0,0|2,0,0]=3 846 B10R1.290 CCNC(C(=O)O)C1CC1 04647a60d5f6da703cda0de0975fbe1b [0,0,0,1,0,0|1,0,0]=2 847 B10R1.290 CCN[C@@H](C(=O)N)C1CC1 772c57558ddc391728c93dbf5c5463f3 [0,0,0,1,0,0|2,0,0]=3 848 B10R1.290 CCN[C@@H](C(=O)O)C1CC1 ac01834af48b8163255c66fe0be060b1 [0,0,0,1,0,0|1,0,0]=2 849 B10R1.290 CCN[C@H](C(=O)N)C1CC1 3bd793fcaef87024bb782114d486d8cc [0,0,0,1,0,0|2,0,0]=3 850 B10R1.290 CCN[C@H](C(=O)O)C1CC1 81123d55b8698d619b894becb3295997 [0,0,0,1,0,0|1,0,0]=2 851 B10R1.290 CCOC(C(=O)N)C1CC1 70d099bf27e905cd378f34bdd2ef27bc [0,0,0,1,0,0|2,0,0]=3 852 B10R1.290 CCOC(C(=O)O)C1CC1 da5cd3e9102524b8e7e2f227743f53a8 [0,0,0,1,0,0|1,0,0]=2 853 B10R1.290 CCO[C@@H](C(=O)O)C1CC1 039ccbe37e61281ba914cc56d1a6579a [0,0,0,1,0,0|1,0,0]=2 854 B10R1.290 CCO[C@H](C(=O)O)C1CC1 5ce6dfe9e47625f6088c839e74dd5031 [0,0,0,1,0,0|1,0,0]=2 855 B10R1.290 NC(=O)C(NCF)C1CC1 1a84b733dac74ac96b7a4f2bc1de0b19 [0,0,0,1,0,0|3,0,0]=4 856 B10R1.290 NC(=O)C(NCO)C1CC1 3c58870d28dd5dcac94a51754a541775 [0,0,0,1,0,0|3,0,0]=4 857 B10R1.290 NC(=O)C(OCF)C1CC1 feae0dc9a0b16b745f2ab3ef758e25a9 [0,0,0,1,0,0|3,0,0]=4 858 B10R1.290 NC(=O)[C@@H](NCF)C1CC1 9999c5ce0897f9726f3257b725d329f3 [0,0,0,1,0,0|3,0,0]=4 859 B10R1.290 NC(=O)[C@@H](NCO)C1CC1 099306e30a8eaaa4cf39bf6f7b50d3a1 [0,0,0,1,0,0|3,0,0]=4 860 B10R1.290 NC(=O)[C@H](NCF)C1CC1 9afb4c266443765e869c1fca286b5ec8 [0,0,0,1,0,0|3,0,0]=4 861 B10R1.290 NC(=O)[C@H](NCO)C1CC1 08681f92b25339a81a5822f1b3a178ca [0,0,0,1,0,0|3,0,0]=4 862 B10R1.290 O=C(O)C(NCF)C1CC1 c6077c4c1ce4808e3f963a764987a9dd [0,0,0,1,0,0|2,0,0]=3 863 B10R1.290 O=C(O)C(NCO)C1CC1 1e3e39d3f5a35df9b0eb4c0f0acb8227 [0,0,0,1,0,0|2,0,0]=3 864 B10R1.290 O=C(O)C(OCF)C1CC1 c80d9b65effcf56c291577efc7f227ef [0,0,0,1,0,0|2,0,0]=3 865 B10R1.290 O=C(O)[C@@H](NCF)C1CC1 b292985816338201cb799e0f34f7c304 [0,0,0,1,0,0|2,0,0]=3 866 B10R1.290 O=C(O)[C@@H](NCO)C1CC1 b40e6bfaa73f97ec33157002cb7697d8 [0,0,0,1,0,0|2,0,0]=3 867 B10R1.290 O=C(O)[C@@H](OCF)C1CC1 9cdfe4cb3912797cf793e2ed8aa91eae [0,0,0,1,0,0|2,0,0]=3 868 B10R1.290 O=C(O)[C@H](NCF)C1CC1 05a16e249516fec89489a9f6e8604bb9 [0,0,0,1,0,0|2,0,0]=3 869 B10R1.290 O=C(O)[C@H](NCO)C1CC1 a4b3aebb5d7a42d4cd74ad71e5e009f2 [0,0,0,1,0,0|2,0,0]=3 870 B10R1.290 O=C(O)[C@H](OCF)C1CC1 aeb2d476ce59eaa98dfb7a8884f78240 [0,0,0,1,0,0|2,0,0]=3 871 B10R1.348 CC(=O)N1CCCCCC1 bd008ed1d89241423499eab40b9ddd3a [0,0,0,1,0,0|2,0,0]=3 872 B10R1.348 CC(=O)N1CCCOCC1 a2dffbfa21961387a7917a6b3f119be9 [0,0,0,1,0,0|3,0,0]=4 873 B10R1.381 CCNC1(CCC1)C(=O)N 773186e071cd6a24d96cfc9a6cc55454 [0,0,0,1,0,0|2,0,0]=3 874 B10R1.381 CCNC1(CCC1)C(=O)O b0365cf85bbf5222626cb76523e7f9b1 [0,0,0,1,0,0|1,0,0]=2 875 B10R1.381 CCNC1(CCC1)C(=S)N 414fceddf4321deeedffa527111c3e65 [0,0,0,1,0,0|2,1,0]=4 876 B10R1.381 CCNC1(COC1)C(=O)N ca5635953bf2e281991a76c3028b4285 [0,0,0,1,0,0|3,0,0]=4 877 B10R1.381 CCNC1(COC1)C(=O)O 579d2bb6309c060440590de859e136b9 [0,0,0,1,0,0|2,0,0]=3 878 B10R1.381 CCNC1(CSC1)C(=O)O 72d7365ee3ab3646e0937ca0b2932569 [0,0,0,1,0,0|2,0,0]=3 879 B10R1.381 NC(=O)C1(CCC1)NCF ac6781ae4802b5cbf098455af2cd0955 [0,0,0,1,0,0|3,0,0]=4 880 B10R1.381 NC(=O)C1(CCC1)NCO 25681a075b390613ab70f24cf7c9dab4 [0,0,0,1,0,0|3,0,0]=4 881 B10R1.381 O=C(O)C1(CCC1)NCF aad1c348d1a6db6985810bb4856b1fa7 [0,0,0,1,0,0|2,0,0]=3 882 B10R1.381 O=C(O)C1(CCC1)NCO 12291d427097b9a1037713fc898f2cc2 [0,0,0,1,0,0|2,0,0]=3 883 B10R1.381 O=C(O)C1(COC1)NCO c0ab3f88e4bc56e4570259ba65970a3f [0,0,0,1,0,0|3,0,0]=4 884 B10R1.381 O=C(O)C1(CSC1)NCF 67b9da0ac563b1eb317d237dfd6ee7f8 [0,0,0,1,0,0|3,0,0]=4 885 B10R1.381 O=C(O)C1(CSC1)NCO cc793e18307a1d13e544e4d434624a26 [0,0,0,1,0,0|3,0,0]=4 886 B10R0.79 C#CCN(CCC)CC(=O)O 3e5d15f6c30edf6aaee1c166d5819a92 [0,0,0,0,0,1|1,0,2]=4 887 B10R0.79 C=C(Br)CN(CCC)CCC 3de8f895a47f48e37aad07a027814d49 [0,0,0,0,0,1|3,0,0]=4 888 B10R0.79 C=C(C)CN(CCC)CCC eab5bc88d22e97f5b3a0b6f0b06565fb [0,0,0,0,0,1|3,0,0]=4 889 B10R0.79 C=C(Cl)CN(CCC)CCC f135bb8bfc512c508fd187d4976fec9c [0,0,0,0,0,1|3,0,0]=4 890 B10R0.79 C=CCC(CC(=O)O)NCC ccaf93bbc715f8a4e217549e1843ab6b [0,0,0,0,0,1|1,0,2]=4 891 B10R0.79 C=CCN(CCC)CC(=O)O 9fe10e5e12b7fca5c04cb31221ff7b72 [0,0,0,0,0,1|1,0,2]=4 892 B10R0.79 CCCC(CC(=O)O)NCC e59378123eb1fadb964cce170d4f9118 [0,0,0,0,0,1|1,0,0]=2 893 B10R0.79 CCCC(CC(=O)O)NCF d5518e7884b6ea763009464201608719 [0,0,0,0,0,1|2,0,0]=3 894 B10R0.79 CCCC(CC(=O)O)NCO fb653fedf51ac98ab9c4e119e7679872 [0,0,0,0,0,1|2,0,0]=3 895 B10R0.79 CCCC(CC(=O)O)OCC be1b338ef9e1f58acc61d9b5829ad340 [0,0,0,0,0,1|1,0,0]=2 896 B10R0.79 CCCC(CC(=O)O)OCF f5064e00b541c547f9fe617a5e13e23e [0,0,0,0,0,1|2,0,0]=3 897 B10R0.79 CCCC(CCC)NC(=O)C cd5d084b76d6d8d41e9213aa9546d2e7 [0,0,0,0,0,1|1,0,0]=2 898 B10R0.79 CCCC(CCC)NC(C)C d793789ec6b3adcbb5e7169039e7619d [0,0,0,0,0,1|2,0,1]=4 899 B10R0.79 CCCC(CCC)OC(C)C ded3b496596c73657daf709428073d3a [0,0,0,0,0,1|2,0,1]=4 900 B10R0.79 CCCC(CCO)NC(=O)C f2edef0c748dbc9ed9335627f12a1a76 [0,0,0,0,0,1|2,0,0]=3 901 B10R0.79 CCCC(C[N+](=O)[O-])OCC a840245ba7f5a391d52ff22beaff4478 [0,0,0,0,0,1|2,0,1]=4 902 B10R0.79 CCCN(CC#N)CC(=O)O 527ec9985e1d1f6366929401a44ab9d9 [0,0,0,0,0,1|2,0,1]=4 903 B10R0.79 CCCN(CC=O)CC(=O)O 8232e2d52b833d79e2afb42169fecbb8 [0,0,0,0,0,1|2,0,1]=4 904 B10R0.79 CCCN(CCC)CC(=O)N 938517d2799fc2dc2fd33c33965fd486 [0,0,0,0,0,1|2,0,0]=3 905 B10R0.79 CCCN(CCC)CC(=O)O 6f49b5514638e7beb3fa0bda77e2d23f [0,0,0,0,0,1|1,0,0]=2 906 B10R0.79 CCCN(CCC)CC(C)O fb8194175fa90248e812428b4d6a93c0 [0,0,0,0,0,1|2,0,1]=4 907 B10R0.79 CCCN(CCC)C[C@@H](C)O 8a1a14f72602b61f45de891bd7c16694 [0,0,0,0,0,1|2,0,1]=4 908 B10R0.79 CCCN(CCC)C[C@H](C)O 6cc8246c830a9340c402498f62a7eb15 [0,0,0,0,0,1|2,0,1]=4 909 B10R0.79 CCCN(CCC)C[N+](=O)[O-] 08166c606b2d5486ea9b8afed7318555 [0,0,0,0,0,1|2,0,1]=4 910 B10R0.79 CCCN(CCF)CC(=O)O 6ccfaa5156218e55696ddd98a958bec4 [0,0,0,0,0,1|2,0,0]=3 911 B10R0.79 CCCN(CCO)CC(=O)N 56088b7b268c64ede02496d34450de8c [0,0,0,0,0,1|3,0,0]=4 912 B10R0.79 CCCN(CCO)CC(=O)O 5c5e7a26716c36b9649ce049e97f4038 [0,0,0,0,0,1|2,0,0]=3 913 B10R0.79 CCCN(CCS)CC(=O)O 0d9f0b32fae0a5d4bdba1a9703fff8e2 [0,0,0,0,0,1|2,0,0]=3 914 B10R0.79 CCCN(COC)CC(=O)O fcf60fc94813e09f3a161df48d1551de [0,0,0,0,0,1|2,0,0]=3 915 B10R0.79 CCCN(CSC)CC(=O)O c822aceb022e7e54374b8583c21b8f27 [0,0,0,0,0,1|2,0,0]=3 916 B10R0.79 CCC[C@@H](CC(=O)O)NCC 183c17e00acdb7ca61739a44ee5f2332 [0,0,0,0,0,1|1,0,0]=2 917 B10R0.79 CCC[C@@H](CC(=O)O)NCF 50e59391eb4d25f21cb04172adeecf05 [0,0,0,0,0,1|2,0,0]=3 918 B10R0.79 CCC[C@@H](CC(=O)O)NCO eac7bdd177272d94df853bada326ea88 [0,0,0,0,0,1|2,0,0]=3 919 B10R0.79 COCC(CCO)NC(=O)C ed078335554549fddb31ea77da40ff9a [0,0,0,0,0,1|3,0,0]=4 920 B10R0.79 COCC(COC)NC(=O)C d988be264d089f946257fd6207331c25 [0,0,0,0,0,1|3,0,0]=4 921 B10R0.79 COCN(CCO)CC(=O)O 33d0898bcb7a12ab1315e0b1159ea785 [0,0,0,0,0,1|3,0,0]=4 922 B10R0.79 CSCN(CCO)CC(=O)O b26b880affe6b01daa4b2af4606c8383 [0,0,0,0,0,1|3,0,0]=4 923 B10R0.79 O=C(O)CN(CCCl)CCCl 700adbb470b44f796dd079ff814b02e0 [0,0,0,0,0,1|3,0,0]=4 924 B10R0.79 O=C(O)CN(CCO)CCF 15aa5978462f427bf37cf2bcf6aa75b3 [0,0,0,0,0,1|3,0,0]=4 925 B10R0.79 O=C(O)CN(CCO)CCO 05445930b81b968f0b95fab7f8b3e0c5 [0,0,0,0,0,1|3,0,0]=4 926 B10R0.79 O=C(O)CN(CCO)CCS 5173d41487490086c16ce299d789c12f [0,0,0,0,0,1|3,0,0]=4 927 B7R0.5 CC(NCF)C(=O)O 678d57d218e04263cf06f7d55d31cd1d [2,0,0,0,0,0|2,0,0]=4 928 B7R0.5 CC(NCO)C(=O)O fe4a7856b889669392c300fb3cd4873c [2,0,0,0,0,0|2,0,0]=4 929 B7R0.5 CC(OCF)C(=O)O 98938b6366d5b1644ffb60bc89cae3d5 [2,0,0,0,0,0|2,0,0]=4 930 B7R0.5 CCCN(C)C(=O)C 2d9bc06e064dcb0b82800ab570f2482e [2,0,0,0,0,0|2,0,0]=4 931 B7R0.5 CCNC(C)C(=O)N 7d9101ed45213ee882e4c1680fbf78d8 [2,0,0,0,0,0|2,0,0]=4 932 B7R0.5 CCNC(C)C(=O)O a9b19181316f90f96751c71a39f085a0 [2,0,0,0,0,0|1,0,0]=3 933 B7R0.5 CCNC(O)C(=O)O e57bdce4aa01317f2f019ff8528e5629 [2,0,0,0,0,0|2,0,0]=4 934 B7R0.5 CCN[C@@H](C)C(=O)N d3ef0fda784c6fd3be35dd07570fe081 [2,0,0,0,0,0|2,0,0]=4 935 B7R0.5 CCN[C@@H](C)C(=O)O fcc04b18ffb8702755c5613065d53d85 [2,0,0,0,0,0|1,0,0]=3 936 B7R0.5 CCN[C@H](C)C(=O)N ced1ae1ac0990c4f7a1ff4ddde70a04d [2,0,0,0,0,0|2,0,0]=4 937 B7R0.5 CCN[C@H](C)C(=O)O 461a17ce9e067f5c1d30933bc07d8775 [2,0,0,0,0,0|1,0,0]=3 938 B7R0.5 CCOC(C)C(=O)C 04432572fe22b740e86ca5259d0a3bbf [2,0,0,0,0,0|2,0,0]=4 939 B7R0.5 CCOC(C)C(=O)N 3ce53fe24b247e6bbc8d0161ba8adc8b [2,0,0,0,0,0|2,0,0]=4 940 B7R0.5 CCOC(C)C(=O)O 1968a3bf4eb23bbce80f27001c40e3aa [2,0,0,0,0,0|1,0,0]=3 941 B7R0.5 CCO[C@@H](C)C(=O)N 886b096e99d61dadf66cd020bfb7d1de [2,0,0,0,0,0|2,0,0]=4 942 B7R0.5 CCO[C@@H](C)C(=O)O f2b03ca68b0ab7d2700716b8fff09b6d [2,0,0,0,0,0|1,0,0]=3 943 B7R0.5 CCO[C@H](C)C(=O)N 8689cd95b03a5d9ff73691cd92fc4b07 [2,0,0,0,0,0|2,0,0]=4 944 B7R0.5 CCO[C@H](C)C(=O)O 156314018bee2c048aecc9ba30245a68 [2,0,0,0,0,0|1,0,0]=3 945 B7R0.5 C[C@@H](NCF)C(=O)O 17fa37c81497338871dce635035053b9 [2,0,0,0,0,0|2,0,0]=4 946 B7R0.5 C[C@@H](NCO)C(=O)O a97b9962f90d67259e383605fc714644 [2,0,0,0,0,0|2,0,0]=4 947 B7R0.5 C[C@@H](OCF)C(=O)O eca3562769119aefebca30b8cb46ef3d [2,0,0,0,0,0|2,0,0]=4 948 B7R0.5 C[C@H](NCF)C(=O)O 8f95fb8302879a9840726de50eb63034 [2,0,0,0,0,0|2,0,0]=4 949 B7R0.5 C[C@H](NCO)C(=O)O 22dff04db3c7b130eddc4a545a3e505d [2,0,0,0,0,0|2,0,0]=4 950 B7R0.5 C[C@H](OCF)C(=O)O 3b1dcb29a34b79a18541896ae618cad0 [2,0,0,0,0,0|2,0,0]=4 951 B7R0.12 C=CC(CC)OCC 3384f4e6ac585bde2972dae19026fd2c [2,0,0,0,0,0|2,0,0]=4 952 B7R0.12 CCCN(C=O)CC c9c4d92e42201b75307332d9c7692aa9 [2,0,0,0,0,0|1,0,0]=3 953 B7R0.12 CCCN(CC)CO 0db6153d76ded508e5655e9e69753d11 [2,0,0,0,0,0|1,0,1]=4 954 B7R0.12 CCN(C=O)CCCl 03512ce3018e8845973ab6d439faef81 [2,0,0,0,0,0|2,0,0]=4 955 B7R0.12 CCN(C=O)CCO f06d113e63228ddd0fbad99b8e842127 [2,0,0,0,0,0|2,0,0]=4 956 B7R0.12 CCNC(CC)CO 69eb8cb0bab039daf9654224be723bd4 [2,0,0,0,0,0|1,0,1]=4 957 B7R0.12 CCN[C@@H](CC)CO 58754a8a804d698e6257db6bc4cb95b3 [2,0,0,0,0,0|1,0,1]=4 958 B7R0.12 CCN[C@H](CC)CO 5b608cb220323f541c9afa99df78f847 [2,0,0,0,0,0|1,0,1]=4 959 B7R0.7 CCCC(C)NCC 30687af6c4de8dad0ff98831d5157fbe [2,0,0,0,0,0|1,0,1]=4 960 B7R0.7 CCCC(C)OCC f8a13dff786165aad9d4cfd77470c868 [2,0,0,0,0,0|1,0,1]=4 961 B7R0.7 CCCN(C)CCC e4ba1afb5991f60dfc5178c264d147ac [2,0,0,0,0,0|1,0,1]=4 962 B7R0.7 CCC[C@@H](C)OCC ad566fabe40b68a5eff8830d607c6d5f [2,0,0,0,0,0|1,0,1]=4 963 B7R0.7 CCC[C@H](C)NCC 753d5a7572fe2b9f2fd164a2491a308c [2,0,0,0,0,0|1,0,1]=4 964 B7R0.7 CCC[C@H](C)OCC 1fee3bcf808f20e21cce64abf5182523 [2,0,0,0,0,0|1,0,1]=4 965 B9R0.12 C#CC(=O)N(CC)CCC a3ef3c531a80ffd27139b60458c30b9c [1,1,0,0,0,0|2,0,0]=4 966 B9R0.12 C=CC(=O)N(CC)CCC 65eb831993d87b34fe266e3220a8d19b [1,1,0,0,0,0|2,0,0]=4 967 B9R0.12 CCC(NCF)C(=O)NO d1288e73761138de1874c0d00b064ecf [1,1,0,0,0,0|2,0,0]=4 968 B9R0.12 CCC(NCO)C(=O)NO 328ad804c05b893753f5e98994727068 [1,1,0,0,0,0|2,0,0]=4 969 B9R0.12 CCC(OCF)C(=O)OC 55687e90d4b2f1392f8b02b104acbf03 [1,1,0,0,0,0|2,0,0]=4 970 B9R0.12 CCCN(CC)C(=O)C=O a19f97e09aa2fe0ef98428a0a9f1811e [1,1,0,0,0,0|1,0,1]=4 971 B9R0.12 CCCN(CC)C(=O)CC cb71ae41710f8d3a5ad167a9d95c6ac7 [1,1,0,0,0,0|2,0,0]=4 972 B9R0.12 CCCN(CC)C(=O)CF 3d2f2763b8a620aa56d6ebbecfb48f96 [1,1,0,0,0,0|2,0,0]=4 973 B9R0.12 CCCN(CC)C(=O)CO 560b89c92582f9173a4199876e21858a [1,1,0,0,0,0|1,0,0]=3 974 B9R0.12 CCCN(CC)C(=O)CS f1a6f4306ac96c5ec9491d28032a38ac [1,1,0,0,0,0|1,1,0]=4 975 B9R0.12 CCN(CCCl)C(=O)CO 23f47ce523979d586745acfe6892faf0 [1,1,0,0,0,0|2,0,0]=4 976 B9R0.12 CCN(CCO)C(=O)CO 8b9c20fafbba720038e4305ee509853b [1,1,0,0,0,0|2,0,0]=4 977 B9R0.12 CCNC(CC)C(=O)NC 2e9e59786ec48c057ad8574cac760264 [1,1,0,0,0,0|2,0,0]=4 978 B9R0.12 CCNC(CC)C(=O)NO 3c750cdb20865e825ba5bda1da9e8f2a [1,1,0,0,0,0|1,0,0]=3 979 B9R0.12 CCNC(CO)C(=O)NO 58673d142b30f61f6d9ff737ce2ae32d [1,1,0,0,0,0|2,0,0]=4 980 B9R0.12 CCNC(CO)C(=O)OC 70d20069b7c2c33b6735ce5c2d2d9890 [1,1,0,0,0,0|2,0,0]=4 981 B9R0.12 CCN[C@@H](CC)C(=O)OC 999d31d45781ad98aaae06f410e03277 [1,1,0,0,0,0|1,0,0]=3 982 B9R0.12 CCN[C@@H](CO)C(=O)OC 783f1436070e4ef27e239c2bc5ae76f8 [1,1,0,0,0,0|2,0,0]=4 983 B9R0.12 CCN[C@@H](CS)C(=O)OC a3ae20d2eca73c3d6eb7c5baec80f314 [1,1,0,0,0,0|2,0,0]=4 984 B9R0.12 CCN[C@H](CC)C(=O)OC 56b2ee816420f8b5360e16d9be2a9530 [1,1,0,0,0,0|1,0,0]=3 985 B9R0.12 CCN[C@H](CO)C(=O)OC 7e7907490e3448d34d068e96647db937 [1,1,0,0,0,0|2,0,0]=4 986 B9R0.12 CCOC(CC)C(=O)CC dc229763be7b8d495a3c742a2765e48c [1,1,0,0,0,0|2,0,0]=4 987 B9R0.12 CCOC(CC)C(=O)OC dafeac8a9e49a0ca9bcc192bdedd1ece [1,1,0,0,0,0|1,0,0]=3 988 B9R0.12 CCOC(OC)C(=O)OC 739d4987749edc9d825824bfb39658eb [1,1,0,0,0,0|2,0,0]=4 989 B9R0.12 CCO[C@@H](CC)C(=O)OC 5a2831785b533bb4fd647aebbcb4d403 [1,1,0,0,0,0|1,0,0]=3 990 B9R0.12 CCO[C@H](CC)C(=O)OC 46c21ea7eed63401aa22bf6ce0cd90ba [1,1,0,0,0,0|1,0,0]=3 991 B9R0.12 CC[C@@H](NCF)C(=O)OC b99a81de7d006795f75701e16779bfe5 [1,1,0,0,0,0|2,0,0]=4 992 B9R0.12 CC[C@@H](NCO)C(=O)OC e3105b67df5bad4f92666a3b6e1173c4 [1,1,0,0,0,0|2,0,0]=4 993 B9R0.12 CC[C@@H](OCF)C(=O)OC 45b802a0d43e9cd94252abf26ce09d6a [1,1,0,0,0,0|2,0,0]=4 994 B9R0.12 CC[C@H](NCF)C(=O)OC fe09686712e657a883068fd953ef01ba [1,1,0,0,0,0|2,0,0]=4 995 B9R0.12 CC[C@H](NCO)C(=O)OC 8463a4624e847aa288aa293e75dbf577 [1,1,0,0,0,0|2,0,0]=4 996 B9R0.12 CC[C@H](OCF)C(=O)OC d6495aac60b87cd28fd4ef32e8fedf64 [1,1,0,0,0,0|2,0,0]=4 997 B9R0.13 C#CC(OCCC)C(=O)O dd15e5c0f35b2a3183ad7ea7f1abbd0f [1,1,0,0,0,0|0,0,2]=4 998 B9R0.13 C#CCNC(CC)C(=O)O 4464d11a0d2df25da2b429b81c350a01 [1,1,0,0,0,0|0,0,2]=4 999 B9R0.13 C#CCN[C@@H](CC)C(=O)O 3a91883e326d70a06c0a02c608789032 [1,1,0,0,0,0|0,0,2]=4 1000 B9R0.13 C#CCN[C@H](CC)C(=O)O 0ed1e889e8b9f62105ff3482f421c816 [1,1,0,0,0,0|0,0,2]=4 1001 B9R0.13 C#CCOC(CC)C(=O)O a3f01bac70705d9fd752ea27609cfc36 [1,1,0,0,0,0|0,0,2]=4 1002 B9R0.13 C#CCO[C@@H](CC)C(=O)O 5195c555473f47309885db715e2843c8 [1,1,0,0,0,0|0,0,2]=4 1003 B9R0.13 C#CCO[C@H](CC)C(=O)O 3a40c3bd56a34a665b2791a598b188e4 [1,1,0,0,0,0|0,0,2]=4 1004 B9R0.13 C/C=C(\OCCC)/C(=O)O 805835d2fd7a7175bc2df69132bafc8c [1,1,0,0,0,0|0,0,2]=4 1005 B9R0.13 C=CC(NCCC)C(=O)O a2cd77405add7f9bda10928ee4ee78ab [1,1,0,0,0,0|0,0,2]=4 1006 B9R0.13 C=CCNC(CC)C(=O)O de481e2466eaff6f0a27732f6dfc352c [1,1,0,0,0,0|0,0,2]=4 1007 B9R0.13 C=CCN[C@@H](CC)C(=O)O f74085695e69590e183acfa0aa7f80ba [1,1,0,0,0,0|0,0,2]=4 1008 B9R0.13 C=CCN[C@H](CC)C(=O)O 7c854a9c251bf6bc5a5bfa1dcc576f30 [1,1,0,0,0,0|0,0,2]=4 1009 B9R0.13 C=CCOC(CC)C(=O)O 12409b9eb4eba52a2e88ae57af39313b [1,1,0,0,0,0|0,0,2]=4 1010 B9R0.13 C=CCO[C@@H](CC)C(=O)O c4783edc56f8b5c2c19ad9c9b07b9c02 [1,1,0,0,0,0|0,0,2]=4 1011 B9R0.13 C=CCO[C@H](CC)C(=O)O 70a5ce7549ed58c5a9a74e77d4d2f7d4 [1,1,0,0,0,0|0,0,2]=4 1012 B9R0.13 C=C[C@H](NCCC)C(=O)O 9277832a0fa493055dd9f58c3067ce63 [1,1,0,0,0,0|0,0,2]=4 1013 B9R0.13 CCC(NCC#N)C(=O)O e10882a1c386e3aa6590707cf4e760bc [1,1,0,0,0,0|1,0,1]=4 1014 B9R0.13 CCC(NCC=O)C(=O)O eab17cc26ff44ad781fc369a930cc922 [1,1,0,0,0,0|1,0,1]=4 1015 B9R0.13 CCC(NCCBr)C(=O)N 9d98281ceda880e1dcaeab24f6bc75e1 [1,1,0,0,0,0|2,0,0]=4 1016 B9R0.13 CCC(NCCBr)C(=O)O 60b3a5cec1771b7f3abdb67726cb92d4 [1,1,0,0,0,0|1,0,0]=3 1017 B9R0.13 CCC(NCCF)C(=O)N 9d7980189f37d456ed15f61f4ee67347 [1,1,0,0,0,0|2,0,0]=4 1018 B9R0.13 CCC(NCCF)C(=O)O f00d042b671287c74e43c494b5cb091f [1,1,0,0,0,0|1,0,0]=3 1019 B9R0.13 CCC(NCCI)C(=O)N c0115b77b4f46b846461f6bc6a2a5ec5 [1,1,0,0,0,0|2,0,0]=4 1020 B9R0.13 CCC(NCCI)C(=O)O e2ba567d8906f9f386d4d3c7d9da02d9 [1,1,0,0,0,0|1,0,0]=3 1021 B9R0.13 CCC(NCCO)C(=O)N 2489f70578494e60c9c27d8e919c4b89 [1,1,0,0,0,0|2,0,0]=4 1022 B9R0.13 CCC(NCCO)C(=O)O 1243b32011dafc3df4fb73416c3d434f [1,1,0,0,0,0|1,0,0]=3 1023 B9R0.13 CCC(NCCS)C(=O)N 18eca7cc918b80b5ea16493698ca11a4 [1,1,0,0,0,0|2,0,0]=4 1024 B9R0.13 CCC(NCCS)C(=O)O cf45ba956b95450629f68d6bc51c2075 [1,1,0,0,0,0|1,0,0]=3 1025 B9R0.13 CCC(NCOC)C(=O)N 8f4286d06e0c4bfcd3da0489a315619c [1,1,0,0,0,0|2,0,0]=4 1026 B9R0.13 CCC(NCOC)C(=O)O 29bdf399d9540f3750b5dbde7f57f2de [1,1,0,0,0,0|1,0,0]=3 1027 B9R0.13 CCC(NCSC)C(=O)N 6d3a975d8c330495737ae1e2b78ace1f [1,1,0,0,0,0|2,0,0]=4 1028 B9R0.13 CCC(NCSC)C(=O)O d79342730ef2d3fa4148bd4194f0c1b1 [1,1,0,0,0,0|1,0,0]=3 1029 B9R0.13 CCC(OCC#N)C(=O)O c8281ede134b6034964e18377fc6d243 [1,1,0,0,0,0|1,0,1]=4 1030 B9R0.13 CCC(OCC=O)C(=O)O b84c6aa9cf2186d81f40497f56dcc686 [1,1,0,0,0,0|1,0,1]=4 1031 B9R0.13 CCC(OCCF)C(=O)N 4a5af37347955d9cc6474b77ce0c4feb [1,1,0,0,0,0|2,0,0]=4 1032 B9R0.13 CCC(OCCF)C(=O)O c00ad7906612369696071846d56d58d6 [1,1,0,0,0,0|1,0,0]=3 1033 B9R0.13 CCC(OCCS)C(=O)N eb6b012c5810bf7e1f5a030c5dccf517 [1,1,0,0,0,0|2,0,0]=4 1034 B9R0.13 CCC(OCCS)C(=O)O e3af5c4fd79a95335149ab48b00e4e02 [1,1,0,0,0,0|1,0,0]=3 1035 B9R0.13 CCC(OCOC)C(=O)N 3fa5c522652bf4cc0728aac721ee9f80 [1,1,0,0,0,0|2,0,0]=4 1036 B9R0.13 CCC(OCOC)C(=O)O e6b9c845d6bb5735a4f158a19827bbda [1,1,0,0,0,0|1,0,0]=3 1037 B9R0.13 CCC(OCSC)C(=O)N 1b463fc2a4b5915ea8e737397216a65d [1,1,0,0,0,0|2,0,0]=4 1038 B9R0.13 CCC(OCSC)C(=O)O ccd4ff15a6e6eec5f462ba7c168ece60 [1,1,0,0,0,0|1,0,0]=3 1039 B9R0.13 CCCCN(CC)C(=O)C 6dcc903ab553d1d8d7c18d1a9b5cfc71 [1,1,0,0,0,0|2,0,0]=4 1040 B9R0.13 CCCNC(CC)C(=O)N 667caeb7a94f8d9ae9b36913fbb97e0d [1,1,0,0,0,0|1,0,0]=3 1041 B9R0.13 CCCNC(CC)C(=O)O f069c353f507c75e209c8348074371d9 [1,1,0,0,0,0|0,0,0]=2 1042 B9R0.13 CCCNC(CCl)C(=O)O 83d744b2a78bac7ef1fc1246b7f75153 [1,1,0,0,0,0|1,0,0]=3 1043 B9R0.13 CCCNC(CF)C(=O)O 2674f23278ea23c1a3fd9e79cc64f417 [1,1,0,0,0,0|1,0,0]=3 1044 B9R0.13 CCCNC(CO)C(=O)N 9c2b75e44bd4651497cab3304501dc4c [1,1,0,0,0,0|2,0,0]=4 1045 B9R0.13 CCCNC(CO)C(=O)O f78fc4da322d7ff361a6dd4f22023970 [1,1,0,0,0,0|1,0,0]=3 1046 B9R0.13 CCCNC(CS)C(=O)O 7ab935d1954160e0fa48d269e73468b7 [1,1,0,0,0,0|1,0,0]=3 1047 B9R0.13 CCCN[C@@H](CC)C(=O)N bb80f4d26611993ee0bd284d09039684 [1,1,0,0,0,0|1,0,0]=3 1048 B9R0.13 CCCN[C@@H](CC)C(=O)O 4af529648ddb980425c401ff5a4b13f1 [1,1,0,0,0,0|0,0,0]=2 1049 B9R0.13 CCCN[C@@H](CC)[C@@H](C)O 0834a6fcf27e3845318fbc3dfc52345e [1,1,0,0,0,0|1,0,1]=4 1050 B9R0.13 CCCN[C@@H](CCl)C(=O)O dab0665f81f97191818ff25180caa069 [1,1,0,0,0,0|1,0,0]=3 1051 B9R0.13 CCCN[C@@H](CO)C(=O)N 6615855b472bab65ebca7f72bd3cddd9 [1,1,0,0,0,0|2,0,0]=4 1052 B9R0.13 CCCN[C@@H](CO)C(=O)O ddf3b03c8510fbc5ca4e2daff87a28f4 [1,1,0,0,0,0|1,0,0]=3 1053 B9R0.13 CCCN[C@@H](CS)C(=O)O e3a74b3aff5bc12b4b6807001695fe2d [1,1,0,0,0,0|1,0,0]=3 1054 B9R0.13 CCCN[C@H](CC)C(=O)O 61d39a4878aa39f0678d7acfbc68cb8c [1,1,0,0,0,0|0,0,0]=2 1055 B9R0.13 CCCN[C@H](CC)[C@@H](C)O 9f7d767220556d24a34d0957783cd0cc [1,1,0,0,0,0|1,0,1]=4 1056 B9R0.13 CCCN[C@H](CC)[C@H](C)O 01968a52ca1e61279e0a659928fb1f77 [1,1,0,0,0,0|1,0,1]=4 1057 B9R0.13 CCCN[C@H](CCl)C(=O)O 4dc35c1012b0d0bb7903731dd1c16a51 [1,1,0,0,0,0|1,0,0]=3 1058 B9R0.13 CCCN[C@H](CO)C(=O)O 8cf55344ec2a8ea73259764a0785501b [1,1,0,0,0,0|1,0,0]=3 1059 B9R0.13 CCCN[C@H](CS)C(=O)O a0487dcbe4739001e1f7043af5abb830 [1,1,0,0,0,0|1,0,0]=3 1060 B9R0.13 CCCOC(CC)C(=O)N 9fda2f7e2d6a6a11459fa617236d25bc [1,1,0,0,0,0|1,0,0]=3 1061 B9R0.13 CCCOC(CC)C(=O)O 3313398866cda9d19c5a77c88cc36eb1 [1,1,0,0,0,0|0,0,0]=2 1062 B9R0.13 CCCO[C@@H](CC)C(=O)O cc9a140b3b6be041090ec10f8ce0cd25 [1,1,0,0,0,0|0,0,0]=2 1063 B9R0.13 CCCO[C@H](CC)C(=O)O 8d217e6f2224fafe55f85fa98a7934d5 [1,1,0,0,0,0|0,0,0]=2 1064 B9R0.13 CCCO[C@H](CF)C(=O)O 29086d9c9cd694f8fc4088578e463f2a [1,1,0,0,0,0|1,0,0]=3 1065 B9R0.13 CCN(CCCO)C(=O)C e7ae570efef2e6ba7964a40dfee99a87 [1,1,0,0,0,0|2,0,0]=4 1066 B9R0.13 CCN(CCOC)C(=O)C 859fe7d575d98ccb55858cdb23984d45 [1,1,0,0,0,0|2,0,0]=4 1067 B9R0.13 CCNCC(C#N)C(=O)O ed3bc2e351117cd0351a1e7f1428a95d [1,1,0,0,0,0|1,0,1]=4 1068 B9R0.13 CCNC[C@H](CC)C(=O)O cffe2fea12875251a32367199af5f540 [1,1,0,0,0,0|0,0,0]=2 1069 B9R0.13 CCNC[C@H](CO)C(=O)O a286bd4559b6a8b5982e2ab8701c93f1 [1,1,0,0,0,0|1,0,0]=3 1070 B9R0.13 CC[C@@H](CNCF)C(=O)O 981bb3911586f255abbfb5961cfb78eb [1,1,0,0,0,0|1,0,0]=3 1071 B9R0.13 CC[C@@H](CNCO)C(=O)O 68f9ed5f73d960fd989ccce413eebff8 [1,1,0,0,0,0|1,0,0]=3 1072 B9R0.13 CC[C@@H](NCC#N)C(=O)O 3d674124ab682d35997b10b1012f6eaa [1,1,0,0,0,0|1,0,1]=4 1073 B9R0.13 CC[C@@H](NCC=O)C(=O)O 870e753934b636a93784181fc4eacdb9 [1,1,0,0,0,0|1,0,1]=4 1074 B9R0.13 CC[C@@H](NCCBr)C(=O)O bb6c187dee35d2ba390554d16dc4aa9c [1,1,0,0,0,0|1,0,0]=3 1075 B9R0.13 CC[C@@H](NCCF)C(=O)O b0e08cededed6f6c7a36fd6ec86e9e11 [1,1,0,0,0,0|1,0,0]=3 1076 B9R0.13 CC[C@@H](NCCI)C(=O)O 6c91d06ea51585e4b95ef8a66d270abe [1,1,0,0,0,0|1,0,0]=3 1077 B9R0.13 CC[C@@H](NCCO)C(=O)O e99f1fcc90431ea7ee28ab87555e864d [1,1,0,0,0,0|1,0,0]=3 1078 B9R0.13 CC[C@@H](NCCS)C(=O)O 14a5bfc0158c777ba30bd0f0cd7926c2 [1,1,0,0,0,0|1,0,0]=3 1079 B9R0.13 CC[C@@H](NCOC)C(=O)O afdab15192460f324c62f62289f5efe2 [1,1,0,0,0,0|1,0,0]=3 1080 B9R0.13 CC[C@@H](NCSC)C(=O)O 5454d4f202e581954955a2783886044d [1,1,0,0,0,0|1,0,0]=3 1081 B9R0.13 CC[C@@H](OCC#N)C(=O)O 519f96a44a3b14011d65a6b7c8c23a81 [1,1,0,0,0,0|1,0,1]=4 1082 B9R0.13 CC[C@@H](OCC=O)C(=O)O c5aa19a1147775fd73c0d33f9486ca56 [1,1,0,0,0,0|1,0,1]=4 1083 B9R0.13 CC[C@@H](OCCF)C(=O)O 4399f51e9aa45bac3aec0e2f73a04ce4 [1,1,0,0,0,0|1,0,0]=3 1084 B9R0.13 CC[C@@H](OCCS)C(=O)O 66d55e860e2b27d00267a7f39525c672 [1,1,0,0,0,0|1,0,0]=3 1085 B9R0.13 CC[C@@H](OCOC)C(=O)O eaf672c9caead4abfc19e8f6a11051c8 [1,1,0,0,0,0|1,0,0]=3 1086 B9R0.13 CC[C@@H](OCSC)C(=O)O f1b1aa50116639e72a339c9ead522291 [1,1,0,0,0,0|1,0,0]=3 1087 B9R0.13 CC[C@H](NCC#N)C(=O)O 6cc8d557b5a6f0b3fd670bb0ecab1db1 [1,1,0,0,0,0|1,0,1]=4 1088 B9R0.13 CC[C@H](NCC=O)C(=O)O 831eb7092855698fae849c3baaf3f89e [1,1,0,0,0,0|1,0,1]=4 1089 B9R0.13 CC[C@H](NCCBr)C(=O)O e8e22504c7ea9404e3c376c4c793bb5c [1,1,0,0,0,0|1,0,0]=3 1090 B9R0.13 CC[C@H](NCCF)C(=O)N 6b11b54dd459b0953fa7781edc0c8018 [1,1,0,0,0,0|2,0,0]=4 1091 B9R0.13 CC[C@H](NCCF)C(=O)O d1f8996afde19b0565d59a42f964550f [1,1,0,0,0,0|1,0,0]=3 1092 B9R0.13 CC[C@H](NCCI)C(=O)O 3a6efc8b485391f685b4ae297821e21f [1,1,0,0,0,0|1,0,0]=3 1093 B9R0.13 CC[C@H](NCCO)C(=O)N 3b8b40a08f0784848e957ed8fa1fd003 [1,1,0,0,0,0|2,0,0]=4 1094 B9R0.13 CC[C@H](NCCO)C(=O)O 1c6b8d756acf8f1db276283748fda969 [1,1,0,0,0,0|1,0,0]=3 1095 B9R0.13 CC[C@H](NCCS)C(=O)N 1fe943a78a5557e1f383d0dd293a801c [1,1,0,0,0,0|2,0,0]=4 1096 B9R0.13 CC[C@H](NCCS)C(=O)O c38a05c741bf6a8c2505ebb00a626765 [1,1,0,0,0,0|1,0,0]=3 1097 B9R0.13 CC[C@H](NCOC)C(=O)N 9ddeabc9457b2d934bae311dafef643d [1,1,0,0,0,0|2,0,0]=4 1098 B9R0.13 CC[C@H](NCOC)C(=O)O 8ff3b44341478cbcc46f6485e982ee40 [1,1,0,0,0,0|1,0,0]=3 1099 B9R0.13 CC[C@H](NCSC)C(=O)N c506a023b16717655fa19ccbb8c02389 [1,1,0,0,0,0|2,0,0]=4 1100 B9R0.13 CC[C@H](NCSC)C(=O)O 215e8fc56b12daa5ff5365fc69da45a2 [1,1,0,0,0,0|1,0,0]=3 1101 B9R0.13 CC[C@H](OCC#N)C(=O)O 405cad0b0c5e8707cb2af2a4aa352fe3 [1,1,0,0,0,0|1,0,1]=4 1102 B9R0.13 CC[C@H](OCC=O)C(=O)O 72ee9feb0307fda9a3dab1459709064b [1,1,0,0,0,0|1,0,1]=4 1103 B9R0.13 CC[C@H](OCCF)C(=O)O 516044a5d658494039eb40ae3a9e3d22 [1,1,0,0,0,0|1,0,0]=3 1104 B9R0.13 CC[C@H](OCCS)C(=O)O d0432edc92842a426feefec6e58ff53e [1,1,0,0,0,0|1,0,0]=3 1105 B9R0.13 CC[C@H](OCOC)C(=O)O 986ecf86f31a1bbe015cd3e780e6ebfd [1,1,0,0,0,0|1,0,0]=3 1106 B9R0.13 CC[C@H](OCSC)C(=O)O f2917a5a83a3472b302dcc248b0acae0 [1,1,0,0,0,0|1,0,0]=3 1107 B9R0.13 COCNC(CCl)C(=O)O bc2b7911e3ffc38a92b959db45b56fcb [1,1,0,0,0,0|2,0,0]=4 1108 B9R0.13 COCNC(CF)C(=O)O 17ec9c581488b2178360a6bce64540b8 [1,1,0,0,0,0|2,0,0]=4 1109 B9R0.13 COCNC(CO)C(=O)O 1874cc910ed4120aa974979dfc2178b5 [1,1,0,0,0,0|2,0,0]=4 1110 B9R0.13 COCNC(CS)C(=O)O 41e8540589127498359276d1b0f8c4ba [1,1,0,0,0,0|2,0,0]=4 1111 B9R0.13 COCN[C@@H](CCl)C(=O)O 93b9c2b6ee76ff370f501f28f0ac1d50 [1,1,0,0,0,0|2,0,0]=4 1112 B9R0.13 COCN[C@@H](CO)C(=O)O f3f941c7e24dfb49cce56dee2c18d303 [1,1,0,0,0,0|2,0,0]=4 1113 B9R0.13 COCN[C@@H](CS)C(=O)O 8da3d51ce198a49de27ff81351b0b750 [1,1,0,0,0,0|2,0,0]=4 1114 B9R0.13 COCN[C@H](CCl)C(=O)O dbb070c5669c8a55f00439f1bd0b8b35 [1,1,0,0,0,0|2,0,0]=4 1115 B9R0.13 COCN[C@H](CO)C(=O)O 0f9a5cca444ea82fb1e59bae4feb5296 [1,1,0,0,0,0|2,0,0]=4 1116 B9R0.13 COCN[C@H](CS)C(=O)O d62af15c7a5bd0b261774146bb080d2c [1,1,0,0,0,0|2,0,0]=4 1117 B9R0.13 COCOC(CF)C(=O)O 94e92cfb4c12fe57f8acc7ee6e110092 [1,1,0,0,0,0|2,0,0]=4 1118 B9R0.13 COCO[C@H](CF)C(=O)O 2f275ecca5c84160a3ea0d26836161b7 [1,1,0,0,0,0|2,0,0]=4 1119 B9R0.13 CSCNC(CCl)C(=O)O 8b432fd4d7ab94eb2fef292cec2f8574 [1,1,0,0,0,0|2,0,0]=4 1120 B9R0.13 CSCNC(CF)C(=O)O 87551dde60a2852bcfabb1f782c8f400 [1,1,0,0,0,0|2,0,0]=4 1121 B9R0.13 CSCNC(CO)C(=O)O 26eca2ee3edb87492e36d46cf8f563c3 [1,1,0,0,0,0|2,0,0]=4 1122 B9R0.13 CSCNC(CS)C(=O)O 432d322a6e29321faf1a7699f31504fc [1,1,0,0,0,0|2,0,0]=4 1123 B9R0.13 CSCN[C@@H](CCl)C(=O)O 4605fb1c2c2e1fd8b9ba8a49da9e5191 [1,1,0,0,0,0|2,0,0]=4 1124 B9R0.13 CSCN[C@@H](CO)C(=O)O e37d633930a82736e21ad053cf8e946e [1,1,0,0,0,0|2,0,0]=4 1125 B9R0.13 CSCN[C@@H](CS)C(=O)O 215b1839987bf53e53872012d9450e77 [1,1,0,0,0,0|2,0,0]=4 1126 B9R0.13 CSCN[C@H](CCl)C(=O)O be9e78e0fd6beb1acc74e9f9a31792b1 [1,1,0,0,0,0|2,0,0]=4 1127 B9R0.13 CSCN[C@H](CO)C(=O)O 6102b7530d697e4e2c526f3c409a0740 [1,1,0,0,0,0|2,0,0]=4 1128 B9R0.13 CSCN[C@H](CS)C(=O)O bbfe372e1340b90367d8d9611995aed6 [1,1,0,0,0,0|2,0,0]=4 1129 B9R0.13 CSCO[C@H](CF)C(=O)O 76403544799d82ad1e367aa1ebec3c9c [1,1,0,0,0,0|2,0,0]=4 1130 B9R0.13 O=C(O)C(CCl)NCCF 2c356734ffa57a8ab01a6197f99924a8 [1,1,0,0,0,0|2,0,0]=4 1131 B9R0.13 O=C(O)C(CCl)NCCO 89432e1e94632c718ca9304944935825 [1,1,0,0,0,0|2,0,0]=4 1132 B9R0.13 O=C(O)C(CCl)NCCS 8728dc05b732117ec73cc397bf0eea04 [1,1,0,0,0,0|2,0,0]=4 1133 B9R0.13 O=C(O)C(CF)NCCBr d2ef9044f513a02ba584c8c7c0202984 [1,1,0,0,0,0|2,0,0]=4 1134 B9R0.13 O=C(O)C(CF)NCCF e02745f04a0c3033fc1180de8def0881 [1,1,0,0,0,0|2,0,0]=4 1135 B9R0.13 O=C(O)C(CF)NCCI ce2ffae01d82a5b2c282c3f0433546cb [1,1,0,0,0,0|2,0,0]=4 1136 B9R0.13 O=C(O)C(CF)NCCO ef1748e871a96430d1bbfcaeeb0406e1 [1,1,0,0,0,0|2,0,0]=4 1137 B9R0.13 O=C(O)C(CF)NCCS 137089b9205aa24aa4d053cc0acdb432 [1,1,0,0,0,0|2,0,0]=4 1138 B9R0.13 O=C(O)C(CO)NCCBr 6abeca60a692b77b8cafe2e1d5024709 [1,1,0,0,0,0|2,0,0]=4 1139 B9R0.13 O=C(O)C(CO)NCCF 42b897e2015457b5f1a8278cc6e9f98f [1,1,0,0,0,0|2,0,0]=4 1140 B9R0.13 O=C(O)C(CO)NCCI c013faa7207d1068c214275e44ad694f [1,1,0,0,0,0|2,0,0]=4 1141 B9R0.13 O=C(O)C(CO)NCCO bfe41a164d92a5f6b0d206689c9a7fc3 [1,1,0,0,0,0|2,0,0]=4 1142 B9R0.13 O=C(O)C(CO)NCCS d8b54897a765204f458bbb487a30d60f [1,1,0,0,0,0|2,0,0]=4 1143 B9R0.13 O=C(O)C(CS)NCCF 0cc74e5ec9173c5198c65cca795a074f [1,1,0,0,0,0|2,0,0]=4 1144 B9R0.13 O=C(O)C(CS)NCCO b71131bc323b098a63fc9bcd8fee3114 [1,1,0,0,0,0|2,0,0]=4 1145 B9R0.13 O=C(O)C(CS)NCCS 7fd89674f7e9e714139863244612756e [1,1,0,0,0,0|2,0,0]=4 1146 B9R0.13 O=C(O)[C@@H](CCl)NCCF bf6c3b5146c5ba94fddf07b4e8dfc4b0 [1,1,0,0,0,0|2,0,0]=4 1147 B9R0.13 O=C(O)[C@@H](CCl)NCCO 48085f9ce948efd84392bda3bd2573c9 [1,1,0,0,0,0|2,0,0]=4 1148 B9R0.13 O=C(O)[C@@H](CCl)NCCS 83b06f2b39fdaa5d599bc42ec139eddd [1,1,0,0,0,0|2,0,0]=4 1149 B9R0.13 O=C(O)[C@@H](CF)OCCF 14b26ccffb963c47140936305b5b668e [1,1,0,0,0,0|2,0,0]=4 1150 B9R0.13 O=C(O)[C@@H](CF)OCCS 3e7c3fe0277bb5a08c4236554d2575ce [1,1,0,0,0,0|2,0,0]=4 1151 B9R0.13 O=C(O)[C@@H](CO)CNCF 3f8b47e92de8a93bfb76ae51f604bd81 [1,1,0,0,0,0|2,0,0]=4 1152 B9R0.13 O=C(O)[C@@H](CO)CNCO 6e77cb6bdff4ed28b745627da4a136b5 [1,1,0,0,0,0|2,0,0]=4 1153 B9R0.13 O=C(O)[C@@H](CO)NCCBr e4699c050f38deacbed430f05c1ea3a2 [1,1,0,0,0,0|2,0,0]=4 1154 B9R0.13 O=C(O)[C@@H](CO)NCCF 88040c617eda2b79543ae30e3e2d3412 [1,1,0,0,0,0|2,0,0]=4 1155 B9R0.13 O=C(O)[C@@H](CO)NCCI 853e5f6e4d311f764b49240c6b77fe80 [1,1,0,0,0,0|2,0,0]=4 1156 B9R0.13 O=C(O)[C@@H](CO)NCCO 670f1f2a54107e4d4bcaf78e06749564 [1,1,0,0,0,0|2,0,0]=4 1157 B9R0.13 O=C(O)[C@@H](CO)NCCS bfe9a49ff89df4bb89311e9014748431 [1,1,0,0,0,0|2,0,0]=4 1158 B9R0.13 O=C(O)[C@@H](CS)NCCF 546e80fe98f67cd7783a6a9ebc57d5e8 [1,1,0,0,0,0|2,0,0]=4 1159 B9R0.13 O=C(O)[C@@H](CS)NCCO 9a6c592976d8d96c63cb2ba59dcb7659 [1,1,0,0,0,0|2,0,0]=4 1160 B9R0.13 O=C(O)[C@@H](CS)NCCS efa76c163b3c2e732eca5b20d281a7ee [1,1,0,0,0,0|2,0,0]=4 1161 B9R0.13 O=C(O)[C@H](CCl)NCCF 79e348ea5069b9361756829012479e16 [1,1,0,0,0,0|2,0,0]=4 1162 B9R0.13 O=C(O)[C@H](CCl)NCCO 5ea34cedfe171ab9b8d182198555b88b [1,1,0,0,0,0|2,0,0]=4 1163 B9R0.13 O=C(O)[C@H](CCl)NCCS 5cb50d3894aae6d654c60b5efce01c14 [1,1,0,0,0,0|2,0,0]=4 1164 B9R0.13 O=C(O)[C@H](CO)NCCBr 393e61a19466d6012b105acb08f3cad8 [1,1,0,0,0,0|2,0,0]=4 1165 B9R0.13 O=C(O)[C@H](CO)NCCF c420e3fd7ac084e98ac03a57cb0ac3a1 [1,1,0,0,0,0|2,0,0]=4 1166 B9R0.13 O=C(O)[C@H](CO)NCCI cd1d0d14d509ac97a9123fc02de0d406 [1,1,0,0,0,0|2,0,0]=4 1167 B9R0.13 O=C(O)[C@H](CO)NCCO 9f5445a8f6084763a850ab50de0e58dd [1,1,0,0,0,0|2,0,0]=4 1168 B9R0.13 O=C(O)[C@H](CO)NCCS 20b558cef6374ce69d26012c6a99aae2 [1,1,0,0,0,0|2,0,0]=4 1169 B9R0.13 O=C(O)[C@H](CS)NCCF 4c79677bbb685854a60d74446e9f57cc [1,1,0,0,0,0|2,0,0]=4 1170 B9R0.13 O=C(O)[C@H](CS)NCCO 0fb8ac4d248688818503cf49bb7e48e3 [1,1,0,0,0,0|2,0,0]=4 1171 B9R0.13 O=C(O)[C@H](CS)NCCS 4880754d17409338cf7658a9fdd61a29 [1,1,0,0,0,0|2,0,0]=4 1172 B9R0.29 CCC(C(=O)N)N(C)CC a0b5ed413496d5f723bff238156ad164 [1,1,0,0,0,0|2,0,0]=4 1173 B9R0.29 CCC(C(=O)O)N(C)CC c538e4ae24aa046d2fdd00f89123f5e1 [1,1,0,0,0,0|1,0,0]=3 1174 B9R0.29 CCN(C)C(CF)C(=O)O 50aa66999b6bb8755ee5455f2976838d [1,1,0,0,0,0|2,0,0]=4 1175 B9R0.29 CCN(C)C(CO)C(=O)O ab79be6b84ef910271315a0e4bf3fd4b [1,1,0,0,0,0|2,0,0]=4 1176 B9R0.29 CCN(C)[C@@H](CO)C(=O)O 4d23087bc5092b5eb7d30309317f714a [1,1,0,0,0,0|2,0,0]=4 1177 B9R0.29 CCN(C)[C@H](CO)C(=O)O c41ee58e427dee9f5257488488b326e5 [1,1,0,0,0,0|2,0,0]=4 1178 B9R0.29 CC[C@@H](C(=O)O)N(C)CC 930dcde365defb38750fba331d85d8d8 [1,1,0,0,0,0|1,0,0]=3 1179 B9R0.29 CC[C@@H](C(=O)O)N(C)CF ea4e660119149f896726d6e737437832 [1,1,0,0,0,0|2,0,0]=4 1180 B9R0.29 CC[C@@H](C(=O)O)N(C)CO fae2afed70cb93f8e439e6c6e3a18d7b [1,1,0,0,0,0|2,0,0]=4 1181 B9R0.29 CC[C@H](C(=O)O)N(C)CC 3fb76b84154a63fac65a55ab1fde4b7d [1,1,0,0,0,0|1,0,0]=3 1182 B9R0.33 CC(C)C(NCF)C(=O)O 109df7da27dddd819fbc6b9ddefadb3e [1,1,0,0,0,0|2,0,0]=4 1183 B9R0.33 CC(C)C(NCO)C(=O)O b07b966a7e54967497cc6a35e9d90be2 [1,1,0,0,0,0|2,0,0]=4 1184 B9R0.33 CC(C)C(OCF)C(=O)O faacbe381eeec4e6467272e4b7096d3d [1,1,0,0,0,0|2,0,0]=4 1185 B9R0.33 CC(C)[C@@H](NCF)C(=O)O 0eaa16e9ac8393d4a1a27bec986c3fa3 [1,1,0,0,0,0|2,0,0]=4 1186 B9R0.33 CC(C)[C@@H](NCO)C(=O)O 993b6a55ed13c43b4aee47b6817fac5f [1,1,0,0,0,0|2,0,0]=4 1187 B9R0.33 CC(C)[C@@H](OCF)C(=O)O 6abb142250ceca611a8c7fcbc3dfefaa [1,1,0,0,0,0|2,0,0]=4 1188 B9R0.33 CC(C)[C@H](NCF)C(=O)O 73a6676296995ddda9da3d10f85f2ba9 [1,1,0,0,0,0|2,0,0]=4 1189 B9R0.33 CC(C)[C@H](NCO)C(=O)O 8519f454486fed8b7b1808452aa59697 [1,1,0,0,0,0|2,0,0]=4 1190 B9R0.33 CC(C)[C@H](OCF)C(=O)O 740154eb173df9782573a89b579e12f6 [1,1,0,0,0,0|2,0,0]=4 1191 B9R0.33 CC(F)C(NCF)C(=O)O eae77cb182eebf2ffd9c9b827126e140 [1,1,0,0,0,0|2,0,0]=4 1192 B9R0.33 CC(F)C(NCO)C(=O)O 6bad97c85abeb2ba13b9306ae434b7a6 [1,1,0,0,0,0|2,0,0]=4 1193 B9R0.33 CC(O)C(NCF)C(=O)O 3c73e83bbd37cb0e2708c2c5b9746103 [1,1,0,0,0,0|2,0,0]=4 1194 B9R0.33 CC(O)C(NCO)C(=O)O 5dbe349bd6acce1b43528ebfece94f22 [1,1,0,0,0,0|2,0,0]=4 1195 B9R0.33 CCCN(C(=O)C)C(C)C 770a5d4d564bad1c1efe03fcbdb2b8dc [1,1,0,0,0,0|2,0,0]=4 1196 B9R0.33 CCNC(C(=O)O)C(C)C a9fb3134cacacce7a959bf78dd3439a1 [1,1,0,0,0,0|1,0,0]=3 1197 B9R0.33 CCNC(C(=O)O)C(C)F c63ec94661301a54768caa8d9a4955b8 [1,1,0,0,0,0|1,0,0]=3 1198 B9R0.33 CCNC(C(=O)O)C(C)O 412b367b8a943d3796a1053e606c7234 [1,1,0,0,0,0|1,0,0]=3 1199 B9R0.33 CCNC(C(=O)O)[C@H](C)O 11fa69cd11bb2ca0b200a8f12cf8eaa4 [1,1,0,0,0,0|1,0,0]=3 1200 B9R0.33 CCN[C@@H](C(=O)O)C(C)C 8e76da0139ee97baf2d51968e96ba2d4 [1,1,0,0,0,0|1,0,0]=3 1201 B9R0.33 CCN[C@@H](C(=O)O)[C@@H](C)O b1da9ab7e2a4c07e77d809e5545b9cfd [1,1,0,0,0,0|1,0,0]=3 1202 B9R0.33 CCN[C@@H](C(=O)O)[C@H](C)O a6e53de98b50916168c0c05115781cd8 [1,1,0,0,0,0|1,0,0]=3 1203 B9R0.33 CCN[C@H](C(=O)N)[C@@H](C)O 5221b43e369407968956e2abe36b85c2 [1,1,0,0,0,0|2,0,0]=4 1204 B9R0.33 CCN[C@H](C(=O)O)C(C)C 8ee580769ea9cb7597c007ef4489b958 [1,1,0,0,0,0|1,0,0]=3 1205 B9R0.33 CCN[C@H](C(=O)O)[C@@H](C)O 3fbb6e266a8ec54d05c5213d122a1a89 [1,1,0,0,0,0|1,0,0]=3 1206 B9R0.33 CCN[C@H](C(=O)O)[C@H](C)O d6c3af7e186b6505f5b588ebf75c79b3 [1,1,0,0,0,0|1,0,0]=3 1207 B9R0.33 CCOC(C(=O)O)C(C)C f9e81252a6b83ef8664916007b0bb218 [1,1,0,0,0,0|1,0,0]=3 1208 B9R0.33 CCO[C@@H](C(=O)O)C(C)C d82604a1fc5baa1b48a976c9d8478893 [1,1,0,0,0,0|1,0,0]=3 1209 B9R0.33 CCO[C@H](C(=O)O)C(C)C dbe5d9658ce7f33be6cf9da2545d5a5d [1,1,0,0,0,0|1,0,0]=3 1210 B9R0.33 C[C@@H](O)[C@@H](NCF)C(=O)O 29d5bccc647e3ad8acc15cecf35bec5b [1,1,0,0,0,0|2,0,0]=4 1211 B9R0.33 C[C@@H](O)[C@@H](NCO)C(=O)O e4165cc6ff0c693eea4bcdfa4b29dd24 [1,1,0,0,0,0|2,0,0]=4 1212 B9R0.33 C[C@@H](O)[C@H](NCF)C(=O)O 041fd6fa17d170fcb9c9fbbbfc5df709 [1,1,0,0,0,0|2,0,0]=4 1213 B9R0.33 C[C@@H](O)[C@H](NCO)C(=O)O a44eecdc2c3fcb200e5e8d6fec998e23 [1,1,0,0,0,0|2,0,0]=4 1214 B9R0.33 C[C@H](O)C(NCF)C(=O)O 82579d5778b1ff37d3ef3582eab6234a [1,1,0,0,0,0|2,0,0]=4 1215 B9R0.33 C[C@H](O)C(NCO)C(=O)O 60c33965c9dcda1aafe0d8b488625591 [1,1,0,0,0,0|2,0,0]=4 1216 B9R0.33 C[C@H](O)[C@@H](NCF)C(=O)O b67e13506749e064512107b802886c91 [1,1,0,0,0,0|2,0,0]=4 1217 B9R0.33 C[C@H](O)[C@@H](NCO)C(=O)O 4b755acddea367db35af71a8f8671301 [1,1,0,0,0,0|2,0,0]=4 1218 B9R0.33 C[C@H](O)[C@H](NCF)C(=O)O 6658994fdd0cb90c4700161ebc53e40a [1,1,0,0,0,0|2,0,0]=4 1219 B9R0.33 C[C@H](O)[C@H](NCO)C(=O)O 670311f708733ce3ce922f0b4964e777 [1,1,0,0,0,0|2,0,0]=4 1220 B9R0.39 CC(C)NC(CCl)C(=O)O 1d090088e0aaa37c9b514c387755de07 [1,1,0,0,0,0|2,0,0]=4 1221 B9R0.39 CC(C)NC(CF)C(=O)O 8b21fa6f54b141f4b6af18b3b4ffefaa [1,1,0,0,0,0|2,0,0]=4 1222 B9R0.39 CC(C)NC(CO)C(=O)O 85ee10fb3bac59316ce1e6039cfeb147 [1,1,0,0,0,0|2,0,0]=4 1223 B9R0.39 CC(C)NC(CS)C(=O)O b57c23a7d3e57d92473dea61f76a2672 [1,1,0,0,0,0|2,0,0]=4 1224 B9R0.39 CC(C)N[C@@H](CCl)C(=O)O fa611d0eed26ab34111eaa7cef381b27 [1,1,0,0,0,0|2,0,0]=4 1225 B9R0.39 CC(C)N[C@@H](CO)C(=O)O 8ae958defe682519febcc0d02a27c749 [1,1,0,0,0,0|2,0,0]=4 1226 B9R0.39 CC(C)N[C@@H](CS)C(=O)O 119dfa838d7ff3de760652ba7e666146 [1,1,0,0,0,0|2,0,0]=4 1227 B9R0.39 CC(C)N[C@H](CCl)C(=O)O 4c423d085885a287396db55e021a67f5 [1,1,0,0,0,0|2,0,0]=4 1228 B9R0.39 CC(C)N[C@H](CO)C(=O)O f97c39ed7b4137999e81b90006e7bfe4 [1,1,0,0,0,0|2,0,0]=4 1229 B9R0.39 CC(C)N[C@H](CS)C(=O)O a1a62cb98dbd812d6c6c17f2766c44c4 [1,1,0,0,0,0|2,0,0]=4 1230 B9R0.39 CC(C)OC(CF)C(=O)O 4eb539bb2e6a75f80e116d9106d066eb [1,1,0,0,0,0|2,0,0]=4 1231 B9R0.39 CC(C)O[C@H](CF)C(=O)O 8f75e8da877a6bd31a8573cc837ee428 [1,1,0,0,0,0|2,0,0]=4 1232 B9R0.39 CCC(NC(C)C)C(=O)N abcd3d2ef4a3fa1141e4f742570a9e4e [1,1,0,0,0,0|2,0,0]=4 1233 B9R0.39 CCC(NC(C)C)C(=O)O d1e2ab254f28f635f62d6836cb2971ca [1,1,0,0,0,0|1,0,0]=3 1234 B9R0.39 CCC(OC(C)C)C(=O)N cc991842340cd018cf89adfa13e82dc0 [1,1,0,0,0,0|2,0,0]=4 1235 B9R0.39 CCC(OC(C)C)C(=O)O 7fcc47a1ffa6d28a9e2f6a969b94e76f [1,1,0,0,0,0|1,0,0]=3 1236 B9R0.39 CCN(CC(C)C)C(=O)C d3afa778674478bcd045a60bd0a7d7f9 [1,1,0,0,0,0|2,0,0]=4 1237 B9R0.39 CCN(CC(C)O)C(=O)C 277afb1450bd63b784532903e9ac21b6 [1,1,0,0,0,0|2,0,0]=4 1238 B9R0.39 CCN(C[C@H](C)O)C(=O)C bad726abafa164d2249e92029a2e2c34 [1,1,0,0,0,0|2,0,0]=4 1239 B9R0.39 CC[C@@H](NC(C)C)C(=O)O 74f2971df7036370e0da2bb233c67656 [1,1,0,0,0,0|1,0,0]=3 1240 B9R0.39 CC[C@@H](OC(C)C)C(=O)O 9e1bf9aaca44c9873fc554bb30857075 [1,1,0,0,0,0|1,0,0]=3 1241 B9R0.39 CC[C@H](NC(C)C)C(=O)N 4a970c7a5270e9ab4ceda05912ee5514 [1,1,0,0,0,0|2,0,0]=4 1242 B9R0.39 CC[C@H](NC(C)C)C(=O)O 1465e55476e138472b94d4661e4437b0 [1,1,0,0,0,0|1,0,0]=3 1243 B9R0.39 CC[C@H](OC(C)C)C(=O)O 8b12a996afa700d32afad4accf218d75 [1,1,0,0,0,0|1,0,0]=3 1244 B9R0.74 CCC(C)(NCF)C(=O)O 56148a0a68bd3830e8542d4882cf4f7c [1,1,0,0,0,0|2,0,0]=4 1245 B9R0.74 CCC(C)(NCO)C(=O)O 67a684fa7655fd3b4552dc54fa339345 [1,1,0,0,0,0|2,0,0]=4 1246 B9R0.74 CCNC(C)(CC)C(=O)N 20f7f01724338c8f2f6d15cd240c4501 [1,1,0,0,0,0|2,0,0]=4 1247 B9R0.74 CCNC(C)(CC)C(=O)O 013cc22d2ebe5789c221161e26ffea21 [1,1,0,0,0,0|1,0,0]=3 1248 B9R0.74 CCNC(C)(CO)C(=O)O 57d3e8a51368d3c37a9a4181d7227aca [1,1,0,0,0,0|2,0,0]=4 1249 B9R0.74 CCN[C@@](C)(CC)C(=O)O 54806aa5c573469b3be93da1d1e62906 [1,1,0,0,0,0|1,0,0]=3 1250 B9R0.74 CCN[C@@](C)(CO)C(=O)O f304448499e07cb9686ec77cd61b9831 [1,1,0,0,0,0|2,0,0]=4 1251 B9R0.74 CCN[C@](C)(CC)C(=O)O 7ce9c5bba28329e17839c5c18647d1b9 [1,1,0,0,0,0|1,0,0]=3 1252 B9R0.74 CCN[C@](C)(CO)C(=O)O ab31d13e415bb78138afc20d034b3169 [1,1,0,0,0,0|2,0,0]=4 1253 B9R0.74 CC[C@@](C)(NCF)C(=O)O 90ce03b49df209132193ab2becd12a71 [1,1,0,0,0,0|2,0,0]=4 1254 B9R0.74 CC[C@@](C)(NCO)C(=O)O 70da7cb3e59f382bc8b17e2731e44fe8 [1,1,0,0,0,0|2,0,0]=4 1255 B9R0.74 CC[C@](C)(NCF)C(=O)O 87fe7c49dd192bc3285700eab38eead2 [1,1,0,0,0,0|2,0,0]=4 1256 B9R0.74 CC[C@](C)(NCO)C(=O)O 024772638d8c037777552487d0e83496 [1,1,0,0,0,0|2,0,0]=4 1257 B9R0.14 C=CC(CC(C)C)OCC 31644764edb043ba1624c67e20282d71 [1,1,0,0,0,0|2,0,0]=4 1258 B9R0.14 C=CC(CCC)OC(C)C 2e012a2f1c9f950d14174919c522fc9d [1,1,0,0,0,0|2,0,0]=4 1259 B9R0.14 CC(O)CN(C=O)CCO 6ca391ae8a95ed8befe0b6f7734d4b39 [1,1,0,0,0,0|2,0,0]=4 1260 B9R0.14 CCCC(CO)NC(C)C bde8f178d225b392e5794634b662a237 [1,1,0,0,0,0|1,0,1]=4 1261 B9R0.14 CCCN(C=O)CC(C)C b7b49b4c8655189b0e1ea6e06e4e879a [1,1,0,0,0,0|1,0,0]=3 1262 B9R0.14 CCCN(C=O)CC(C)O 705e15c8a2a205eb0f8be6137aa0c707 [1,1,0,0,0,0|1,0,0]=3 1263 B9R0.14 CCCN(CO)CC(C)C 6f3756febe403b55bf9659a76e85f780 [1,1,0,0,0,0|1,0,1]=4 1264 B9R0.14 CCCN(CO)CC(C)O 654ec85215a12ae212a7db4d2d2c138d [1,1,0,0,0,0|1,0,1]=4 1265 B9R0.14 CCC[C@@H](CO)NC(C)C 3086af1369b93d1fa42cdeb313a2097d [1,1,0,0,0,0|1,0,1]=4 1266 B9R0.14 CCC[C@H](CO)NC(C)C f970f3c821edfa2ebfbeadb11dc6ec94 [1,1,0,0,0,0|1,0,1]=4 1267 B9R0.14 CCNC(CO)CC(C)C 70a9aacb9463f6eae66fbd5e7509bc43 [1,1,0,0,0,0|1,0,1]=4 1268 B9R0.14 CCN[C@@H](CO)CC(C)C bc3310a2f7637e679fc82e772ff0c426 [1,1,0,0,0,0|1,0,1]=4 1269 B9R0.14 CCN[C@H](CO)CC(C)C 775461ae8ad7ccfcbef3b68fc90d46e8 [1,1,0,0,0,0|1,0,1]=4 1270 B9R0.17 C=CCN(CCC)CCC bae9fda9e09b5f106750036b4cb03055 [1,1,0,0,0,0|2,0,0]=4 1271 B9R0.17 CCCC(CCC)NC#N 786e8dc900b3a514206e9ff94ae40f5e [1,1,0,0,0,0|1,0,1]=4 1272 B9R0.17 CCCC(CCC)NC=O 807aff51f1fe24d356c6711fc8370f90 [1,1,0,0,0,0|0,0,0]=2 1273 B9R0.17 CCCC(CCC)NCC ddd45faa5306b27a1d72b76e087036bb [1,1,0,0,0,0|1,0,1]=4 1274 B9R0.17 CCCC(CCC)NCF ec5b27a8f3c2b4d0e77881907455ba8a [1,1,0,0,0,0|1,0,1]=4 1275 B9R0.17 CCCC(CCC)NCO d1140e3e226f7dbd1150e43fae13223a [1,1,0,0,0,0|0,0,1]=3 1276 B9R0.17 CCCC(CCC)OCC eaefef31a773bb3c066a25cae0992714 [1,1,0,0,0,0|1,0,1]=4 1277 B9R0.17 CCCC(CCC)OCF ba5ef35becd613f75720a15441855b31 [1,1,0,0,0,0|1,0,1]=4 1278 B9R0.17 CCCC(CCO)NC=O f887f8e048c82ec42b3b224f31c660de [1,1,0,0,0,0|1,0,0]=3 1279 B9R0.17 CCCC(CCO)NCC 7cd7153d642a14f8ac7540b4f6be6734 [1,1,0,0,0,0|1,0,1]=4 1280 B9R0.17 CCCC(CCO)NCO bbe705604a9e083ce340cda6117329ba [1,1,0,0,0,0|1,0,1]=4 1281 B9R0.17 CCCN(CC=O)CCC 3f7ee899d33e18ef7369adb9b220d9b3 [1,1,0,0,0,0|1,0,0]=3 1282 B9R0.17 CCCN(CC=O)CCO 138004b89d5c4657e701909e51217872 [1,1,0,0,0,0|2,0,0]=4 1283 B9R0.17 CCCN(CCC)CCO d37662787662c230c63bd2d4f53d9c65 [1,1,0,0,0,0|1,0,1]=4 1284 B9R0.17 CCCN(CCC)COC 1d27d8529023a829f1c8c36ac691b81a [1,1,0,0,0,0|1,0,1]=4 1285 B9R0.17 COCC(CCO)NC=O 041b3216dea15bf357ed6b311d97fceb [1,1,0,0,0,0|2,0,0]=4 1286 B9R0.17 COCC(COC)NC=O a4ba2755183f02d9e0eab56c89d31eb0 [1,1,0,0,0,0|2,0,0]=4 1287 B9R0.40 C#CC(CCC)OCCC 99c19cde12e0d7f1b17443dd53d66c51 [1,1,0,0,0,0|1,0,1]=4 1288 B9R0.40 C=CC(CCC)OCCC c8cc8ff99b986a7fae9322886f38af88 [1,1,0,0,0,0|1,0,0]=3 1289 B9R0.40 C=CC(CCC)OCCF b0727ee9f4e7c7f0fa5042d85ed28cee [1,1,0,0,0,0|2,0,0]=4 1290 B9R0.40 C=CC(CCC)OCCS 1d32182dc19e5e8d4c689ebddbc07f59 [1,1,0,0,0,0|2,0,0]=4 1291 B9R0.40 C=CC(CCC)OCOC 95490b9e1292c66578fca8956db7eec0 [1,1,0,0,0,0|2,0,0]=4 1292 B9R0.40 C=CC(CCC)OCSC 27d679cb3a7f8ba26e0585395f452b2d [1,1,0,0,0,0|2,0,0]=4 1293 B9R0.40 C=CC(CCCC)OCC debe70a957bdc231f9f5bc09ebab038f [1,1,0,0,0,0|2,0,0]=4 1294 B9R0.40 CCCC(CC)COCC 0aa20e7bc483c4759592262d2d2171e2 [1,1,0,0,0,0|1,0,1]=4 1295 B9R0.40 CCCC(CO)NCCF 839381c1a4c265b6e792c21a670f893e [1,1,0,0,0,0|1,0,1]=4 1296 B9R0.40 CCCC(CO)NCCO f713c50ab8748d3a53933197c7bc4506 [1,1,0,0,0,0|1,0,1]=4 1297 B9R0.40 CCCC(CO)NCCS 1c0d6fd844e944a5e79b26c2b38a4461 [1,1,0,0,0,0|1,0,1]=4 1298 B9R0.40 CCCC(CO)NCOC c21540176f4615257402b02c82164538 [1,1,0,0,0,0|1,0,1]=4 1299 B9R0.40 CCCC(CO)NCSC 29aa9aa802329b3af8eadc226aabff1c [1,1,0,0,0,0|1,0,1]=4 1300 B9R0.40 CCCCC(CO)NCC cbdc55a29bd13eaa9ee05a36cd59633e [1,1,0,0,0,0|1,0,1]=4 1301 B9R0.40 CCCCN(C=O)CCC be8b9ffc5e8551c44e5ab58b1828a0f7 [1,1,0,0,0,0|1,0,0]=3 1302 B9R0.40 CCCCN(C=O)CCO 17787dd5e4fe64ab300ff2422659355e [1,1,0,0,0,0|2,0,0]=4 1303 B9R0.40 CCCCN(C=O)CCS a20b475fa5d1ceea20c555b8a71771e2 [1,1,0,0,0,0|2,0,0]=4 1304 B9R0.40 CCCCN(CO)CCC 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d4e8dd38022f43e8401bb5670125dbed [1,1,0,0,0,0|1,0,1]=4 1317 B9R0.40 CCCN[C@@H](CO)CCC df7cfbb3545d05a3ae7dd28845fbd35d [1,1,0,0,0,0|0,0,1]=3 1318 B9R0.40 CCCN[C@@H](CO)CCO d25c41960081028e6638790befa80bdf [1,1,0,0,0,0|1,0,1]=4 1319 B9R0.40 CCCN[C@H](CO)CCC 35715582497d28806315b4b8bae11329 [1,1,0,0,0,0|0,0,1]=3 1320 B9R0.40 CCCOC(C#N)CCC f4f963f957921180c3a56f42e44fba2b [1,1,0,0,0,0|1,0,1]=4 1321 B9R0.40 CCCOC(CC)CCC 8238dc4250141f806af223944c1e9f3d [1,1,0,0,0,0|1,0,1]=4 1322 B9R0.40 CCCO[C@@H](CO)CCO 271971862229ec111c96b74c13aa73b9 [1,1,0,0,0,0|1,0,1]=4 1323 B9R0.40 CCCO[C@H](CC)CCC 769c614be648c7265a5a510d19215798 [1,1,0,0,0,0|1,0,1]=4 1324 B9R0.40 CCC[C@@H](CO)NCCF 34e8468e7ead0f444a11ded8db088926 [1,1,0,0,0,0|1,0,1]=4 1325 B9R0.40 CCC[C@@H](CO)NCCO dc6d34f2bc25ed0c6f3a3255855911d9 [1,1,0,0,0,0|1,0,1]=4 1326 B9R0.40 CCC[C@@H](CO)NCCS 2c446eb54906b36c2e2e14a1e2efb355 [1,1,0,0,0,0|1,0,1]=4 1327 B9R0.40 CCC[C@@H](CO)NCOC ec21531b92d7fee2beb53e9b95249079 [1,1,0,0,0,0|1,0,1]=4 1328 B9R0.40 CCC[C@@H](CO)NCSC 699eecdd63c6842c613ae9e815ec62c1 [1,1,0,0,0,0|1,0,1]=4 1329 B9R0.40 CCC[C@H](CO)NCCF eaaabe68e4e62e7e3bfd0095f0b96f56 [1,1,0,0,0,0|1,0,1]=4 1330 B9R0.40 CCC[C@H](CO)NCCO e5ab79830ce415a63432936150525b1d [1,1,0,0,0,0|1,0,1]=4 1331 B9R0.40 CCC[C@H](CO)NCCS 267d654dba941f84f24fa856c935f348 [1,1,0,0,0,0|1,0,1]=4 1332 B9R0.40 CCC[C@H](CO)NCOC 748cb68b8be4bd06fc90b977db1e5856 [1,1,0,0,0,0|1,0,1]=4 1333 B9R0.40 CCC[C@H](CO)NCSC e0950d7b10fa79ed3d6af599ffc4e76e [1,1,0,0,0,0|1,0,1]=4 1334 B9R0.40 CCNC(CO)CCCO ca46aacb27c034365ce5c4c6253dbfd4 [1,1,0,0,0,0|1,0,1]=4 1335 B9R0.40 CCNC(CO)CCSC b8e564c2b7ad87110db5b46c71a94e3c [1,1,0,0,0,0|1,0,1]=4 1336 B9R0.40 CCN[C@@H](CO)CCSC 45df498a3067aaca39879a58c7bdd89d [1,1,0,0,0,0|1,0,1]=4 1337 B9R0.40 CCN[C@H](CO)CCSC 0f8cdeccb9d7d33e9f1dc19794c6477e [1,1,0,0,0,0|1,0,1]=4 1338 B9R0.40 O=CN(CCO)CCCO 626dee79b46ba73891aab059598cfd8e [1,1,0,0,0,0|2,0,0]=4 1339 B9R0.59 CCCC(C)(CO)NCC 1d5445bdd843732ee905699748904534 [1,1,0,0,0,0|1,0,1]=4 1340 B11R0.35 C=C(C)CN(CCC)CC(=O)O 8a855d1b1ef46e79b26953049a1f1c34 [0,1,0,0,0,1|1,0,1]=4 1341 B11R0.35 CC(C)CC(CC(=O)O)NCF 317c55386ab5c2961c0519d0f8ed89c5 [0,1,0,0,0,1|2,0,0]=4 1342 B11R0.35 CC(C)CC(CC(=O)O)NCO 1158686e5b9e9eead0a91020f8a9d273 [0,1,0,0,0,1|2,0,0]=4 1343 B11R0.35 CC(C)CC(CC(=O)O)OCF d2b16cf2821104730b90ef6533b66481 [0,1,0,0,0,1|2,0,0]=4 1344 B11R0.35 CC(C)CN(CCF)CC(=O)O 63860cc18b67114c1ec35e80ea114f56 [0,1,0,0,0,1|2,0,0]=4 1345 B11R0.35 CC(C)CN(CCO)CC(=O)O 63a54277d0b9b7d9b7b70725341c0489 [0,1,0,0,0,1|2,0,0]=4 1346 B11R0.35 CC(C)CN(CCS)CC(=O)O cb6247e728d20234ac2ba996bc05e97c [0,1,0,0,0,1|2,0,0]=4 1347 B11R0.35 CC(C)C[C@@H](CC(=O)O)NCF 42afeade415a6e06e57ca6a78703e9d2 [0,1,0,0,0,1|2,0,0]=4 1348 B11R0.35 CC(C)C[C@@H](CC(=O)O)NCO d0e7c515f7b99906a107ae8a10068744 [0,1,0,0,0,1|2,0,0]=4 1349 B11R0.35 CC(C)C[C@H](CC(=O)O)NCF 84063a29883824aa66f3289bb0683bf9 [0,1,0,0,0,1|2,0,0]=4 1350 B11R0.35 CC(C)C[C@H](CC(=O)O)NCO c973bebb11ebbfd443e4cb16b84a100c [0,1,0,0,0,1|2,0,0]=4 1351 B11R0.35 CC(O)CN(CCO)CC(=O)O fcd99a82d28d03aa45b38993874b5d33 [0,1,0,0,0,1|2,0,0]=4 1352 B11R0.35 CCCC(CC(=O)O)NC(C)C f0adadeca161ee49b5fc87d047898094 [0,1,0,0,0,1|1,0,0]=3 1353 B11R0.35 CCCC(CC(=O)O)OC(C)C 9e1d76e39af75bfc180ca9992688983a [0,1,0,0,0,1|1,0,0]=3 1354 B11R0.35 CCCN(CC(=O)N)CC(C)C 38af717e8b8760e279c74738edadf3eb [0,1,0,0,0,1|2,0,0]=4 1355 B11R0.35 CCCN(CC(=O)N)CC(C)O cce7a1a682d64c90702cc01fc9f7e40d [0,1,0,0,0,1|2,0,0]=4 1356 B11R0.35 CCCN(CC(=O)O)CC(C)C fc8a0d7bc62d319ce4263fcb71db9d4f [0,1,0,0,0,1|1,0,0]=3 1357 B11R0.35 CCCN(CC(=O)O)CC(C)O 2ab46f888409beed5b1fe297f627e44a [0,1,0,0,0,1|1,0,0]=3 1358 B11R0.35 CCCN(CC(=O)O)CC(F)F 4a67282ab9ec9685858c1e2c0ad4feae [0,1,0,0,0,1|2,0,0]=4 1359 B11R0.35 CCCN(CC(=O)O)CN(C)C fc450e36cf5ec94e447f3ad1e090552b [0,1,0,0,0,1|2,0,0]=4 1360 B11R0.35 CCCN(CC(=O)O)C[C@@H](C)O 76cd9e951fcd2d99a2c40f8b10f5056d [0,1,0,0,0,1|1,0,0]=3 1361 B11R0.35 CCCN(CC(=O)O)C[C@H](C)O 804545b78088706cf45e62d7e1440620 [0,1,0,0,0,1|1,0,0]=3 1362 B11R0.35 CCC[C@@H](CC(=O)O)NC(C)C 043b2857e640d45f6207a790d1ce9fd3 [0,1,0,0,0,1|1,0,0]=3 1363 B11R0.35 CCNC(CC(=O)O)CC(C)C 2e852a24d3789a6f4d9658f8804a6aa7 [0,1,0,0,0,1|1,0,0]=3 1364 B11R0.35 CCN[C@@H](CC(=O)O)CC(C)C bbff5673195bf847f2e66ab198b9720e [0,1,0,0,0,1|1,0,0]=3 1365 B11R0.35 CCN[C@H](CC(=O)O)CC(C)C 04dde47636ca44531205da8ab29f8aef [0,1,0,0,0,1|1,0,0]=3 1366 B11R0.35 CCOC(CC(=O)O)CC(C)C a210a7565866f93cb89f325b1561a41c [0,1,0,0,0,1|1,0,0]=3 1367 B11R0.35 COCN(CC(=O)O)CC(C)C 0b56ed7541c05b2f6d1014a1e1f21f62 [0,1,0,0,0,1|2,0,0]=4 1368 B11R0.35 COC[C@@H](CC(C)C)NC(=O)C c5eb755fc728c563e6e0c61a9de9043f [0,1,0,0,0,1|2,0,0]=4 1369 B11R0.35 CSCN(CC(=O)O)CC(C)C faaeb865c0934e57a4a2a1fd2fea09be [0,1,0,0,0,1|2,0,0]=4 1370 B11R0.35 C[C@@H](O)CN(CCO)CC(=O)O e9762d01ab064875a665697fdfdbc0fd [0,1,0,0,0,1|2,0,0]=4 1371 B11R0.35 C[C@H](O)CN(CCO)CC(=O)O 59196a1f325912515df0486847a74911 [0,1,0,0,0,1|2,0,0]=4 1372 B11R0.39 CCC(C)C(CC(=O)O)NCF 8d14e183ff099de63ad67d66116d951c [0,1,0,0,0,1|2,0,0]=4 1373 B11R0.39 CCC(C)C(CC(=O)O)NCO e0298a113a0608d9e596e5b15bc942a9 [0,1,0,0,0,1|2,0,0]=4 1374 B11R0.39 CCC(C)N(CCF)CC(=O)O 9b2468cbbbfb34f522d6e191d2706838 [0,1,0,0,0,1|2,0,0]=4 1375 B11R0.39 CCC(C)N(CCO)CC(=O)O 6994f316fe92cc37eaf236ac8d4b2257 [0,1,0,0,0,1|2,0,0]=4 1376 B11R0.39 CCC(C)N(CCS)CC(=O)O c9bf565f760e8d7a00a4467ddf034e70 [0,1,0,0,0,1|2,0,0]=4 1377 B11R0.39 CCC(C)N(COC)CC(=O)O dce1fc5c7d3f12b348acdf180cabaff0 [0,1,0,0,0,1|2,0,0]=4 1378 B11R0.39 CCC(C)N(CSC)CC(=O)O e02d8661edc5a62d4089836ccdf889a8 [0,1,0,0,0,1|2,0,0]=4 1379 B11R0.39 CCCN(CC(=O)N)C(C)CC bf0a0c62cbe9946376c83221baa35dab [0,1,0,0,0,1|2,0,0]=4 1380 B11R0.39 CCCN(CC(=O)O)C(C)CC f2f6efd57041dd6a65874868c8fe2717 [0,1,0,0,0,1|1,0,0]=3 1381 B11R0.39 CCCN(CC(=O)O)C(C)CO b1b5f34b15059d4a062822fe443f145a [0,1,0,0,0,1|2,0,0]=4 1382 B11R0.39 CCCN(CC(=O)O)[C@@H](C)CO 3c69f4fca7a4ed4cc4c246c82e2cebac [0,1,0,0,0,1|2,0,0]=4 1383 B11R0.39 CCCN(CC(=O)O)[C@H](C)CO b7182420f34800c5b090fc676f083187 [0,1,0,0,0,1|2,0,0]=4 1384 B11R0.39 CCNC(CC(=O)O)C(C)CC 7c8e7629921b1076985af31c49f1b4bf [0,1,0,0,0,1|1,0,0]=3 1385 B11R0.39 CCN[C@H](CC(=O)O)[C@@H](C)CC 225653afd45e59bef8bcf2743059cbdd [0,1,0,0,0,1|1,0,0]=3 1386 B11R0.39 CC[C@H](C)[C@@H](CC(=O)O)NCF dc24378d5e3311932815562ea4cc6469 [0,1,0,0,0,1|2,0,0]=4 1387 B11R0.39 CC[C@H](C)[C@@H](CC(=O)O)NCO cf71618618e2a8896a0a410630d9591d [0,1,0,0,0,1|2,0,0]=4 1388 B11R0.47 C#CCCN(CCC)CC(=O)O 60cb5a76ae77fc330060aa367b169b91 [0,1,0,0,0,1|1,0,1]=4 1389 B11R0.47 C#CCNC(CCC)CC(=O)O 2d33e897150e7f8bc8df0840e4b33c79 [0,1,0,0,0,1|0,0,2]=4 1390 B11R0.47 C#CCN[C@@H](CCC)CC(=O)O e313add3fdf4a13e5651dd27bbea6c8a [0,1,0,0,0,1|0,0,2]=4 1391 B11R0.47 C#CCOC(CCC)CC(=O)O bc3ed9d9e208a543c8a2d3d08182cfbd [0,1,0,0,0,1|0,0,2]=4 1392 B11R0.47 C/C=C/CN(CCC)CC(=O)O 28992b4cbf9d4c0ce2a0eb00833cc8a2 [0,1,0,0,0,1|1,0,1]=4 1393 B11R0.47 C/C=C\CN(CCC)CC(=O)O 95e62859a01b3c18099e0fefe8b9f9e9 [0,1,0,0,0,1|1,0,1]=4 1394 B11R0.47 C=CCC(CC(=O)O)NCCC 700eb874386aa4135cccb5382c3c5a13 [0,1,0,0,0,1|0,0,2]=4 1395 B11R0.47 C=CCCN(CCC)CC(=O)O 794b29681cbd73a5a6ef1438182dd556 [0,1,0,0,0,1|1,0,1]=4 1396 B11R0.47 C=CCNC(CCC)CC(=O)O 9cd5f699f1374b8146b73740c072b1b6 [0,1,0,0,0,1|0,0,2]=4 1397 B11R0.47 C=CCN[C@@H](CCC)CC(=O)O cf51ef7601f520ff118209565b9138f2 [0,1,0,0,0,1|0,0,2]=4 1398 B11R0.47 C=CCOC(CCC)CC(=O)O 348c72f51abd3385d4d20d41019bbe9e [0,1,0,0,0,1|0,0,2]=4 1399 B11R0.47 CCCC(CC(=O)O)NCC#N d8165d86c6e7789f1ecaf1a59f1e5a28 [0,1,0,0,0,1|1,0,1]=4 1400 B11R0.47 CCCC(CC(=O)O)NCC=O 219e223d92c8545e799dc6475c2dc364 [0,1,0,0,0,1|1,0,1]=4 1401 B11R0.47 CCCC(CC(=O)O)NCCF 165bb54ad864d2e2a9c6e858c7d34fff [0,1,0,0,0,1|1,0,0]=3 1402 B11R0.47 CCCC(CC(=O)O)NCCO bda8cbde62224f90e3f67f5ffc534cd4 [0,1,0,0,0,1|1,0,0]=3 1403 B11R0.47 CCCC(CC(=O)O)NCCS 8b42dfb4f08c6479b4775e1920edf6d8 [0,1,0,0,0,1|1,0,0]=3 1404 B11R0.47 CCCC(CC(=O)O)NCOC 3f96fc059bfa31e60a7bb4adf7c0d005 [0,1,0,0,0,1|1,0,0]=3 1405 B11R0.47 CCCC(CC(=O)O)NCSC f1b26c3247bda63ce14a2e0c42c2f121 [0,1,0,0,0,1|1,0,0]=3 1406 B11R0.47 CCCC(CC(=O)O)OCC#N 26782d4547715a12234a829d548e5eab [0,1,0,0,0,1|1,0,1]=4 1407 B11R0.47 CCCC(CC(=O)O)OCC=O b24d673faac91e3e8abd795480cd853d [0,1,0,0,0,1|1,0,1]=4 1408 B11R0.47 CCCC(CC(=O)O)OCCF 438a8c16af05e6b8fac58c66c2723b18 [0,1,0,0,0,1|1,0,0]=3 1409 B11R0.47 CCCC(CC(=O)O)OCCS 240762044762d0c84370748abfa928bc [0,1,0,0,0,1|1,0,0]=3 1410 B11R0.47 CCCC(CC(=O)O)OCOC 051928c9445eaa565c92055bdb4e779f [0,1,0,0,0,1|1,0,0]=3 1411 B11R0.47 CCCC(CC(=O)O)OCSC 5a874a3ad38e25739da4d3d4dd201577 [0,1,0,0,0,1|1,0,0]=3 1412 B11R0.47 CCCCC(CC(=O)O)NCC 8a85c13a91c6cd94a1254c9c64661abe [0,1,0,0,0,1|1,0,0]=3 1413 B11R0.47 CCCCC(CC(=O)O)NCF c150e610f9bb7aeb0351eb995e13a035 [0,1,0,0,0,1|2,0,0]=4 1414 B11R0.47 CCCCC(CC(=O)O)NCO 1994043ac0d1bca12ac90075e7dd5f80 [0,1,0,0,0,1|2,0,0]=4 1415 B11R0.47 CCCCC(CC(=O)O)OCC 20059e716c9b550bdb3e85c29a7820da [0,1,0,0,0,1|1,0,0]=3 1416 B11R0.47 CCCCC(CC(=O)O)OCF 8f087b450f7aac39cec3cfb4d818fe0d [0,1,0,0,0,1|2,0,0]=4 1417 B11R0.47 CCCCN(CCC)CC(=O)N 68a70bcad13c9928d3213404f5edd7b3 [0,1,0,0,0,1|2,0,0]=4 1418 B11R0.47 CCCCN(CCC)CC(=O)O 728ee2c156068c99cde48546186571f9 [0,1,0,0,0,1|1,0,0]=3 1419 B11R0.47 CCCCN(CCF)CC(=O)O f1bad0d925803895a237124c329df161 [0,1,0,0,0,1|2,0,0]=4 1420 B11R0.47 CCCCN(CCO)CC(=O)O 259a471c14351180f2a9b6fed806afae [0,1,0,0,0,1|2,0,0]=4 1421 B11R0.47 CCCCN(CCS)CC(=O)O 18c59ffbc1cceacceaa44e81ee5df9c4 [0,1,0,0,0,1|2,0,0]=4 1422 B11R0.47 CCCCN(COC)CC(=O)O b7cccb2a701d8a3e24daf864c390be43 [0,1,0,0,0,1|2,0,0]=4 1423 B11R0.47 CCCCN(CSC)CC(=O)O 4d841f02ca9de4680491b17a9ed9dfc3 [0,1,0,0,0,1|2,0,0]=4 1424 B11R0.47 CCCN(CCC#N)CC(=O)O 90c1f47d71b87d874363d6b28ccd3aa7 [0,1,0,0,0,1|1,0,1]=4 1425 B11R0.47 CCCN(CCC=O)CC(=O)O 5043b9de5189c91fd0889297179a2b4e [0,1,0,0,0,1|1,0,1]=4 1426 B11R0.47 CCCN(CCCF)CC(=O)O 852d49f20752ebaee4f71b75f8a6f464 [0,1,0,0,0,1|1,0,0]=3 1427 B11R0.47 CCCN(CCCO)CC(=O)N 0d33068d0f4f01aac648f2dbfb91de9b [0,1,0,0,0,1|2,0,0]=4 1428 B11R0.47 CCCN(CCCO)CC(=O)O 102af7f017b3b0aedbd97d9b8fee7496 [0,1,0,0,0,1|1,0,0]=3 1429 B11R0.47 CCCN(CCCS)CC(=O)O 43e8827cb8d689f5a9c6e73731392bd9 [0,1,0,0,0,1|1,0,0]=3 1430 B11R0.47 CCCN(CCOC)CC(=O)N 6c68a746d2c7593787182a6b7681acd8 [0,1,0,0,0,1|2,0,0]=4 1431 B11R0.47 CCCN(CCOC)CC(=O)O a8d5c2d8092317922edb78f28a6d9c2b [0,1,0,0,0,1|1,0,0]=3 1432 B11R0.47 CCCN(CCSC)CC(=O)O 0f13449483121cb3d062b765649138ed [0,1,0,0,0,1|1,0,0]=3 1433 B11R0.47 CCCN(COCC)CC(=O)O 92ae73f6e1b28aebd78f50527a0f2079 [0,1,0,0,0,1|1,0,0]=3 1434 B11R0.47 CCCNC(CCC)CC(=O)O da2bc4f44e9ff3651d72c9ce63a08fcc [0,1,0,0,0,1|0,0,0]=2 1435 B11R0.47 CCCN[C@@H](CCC)CC(=O)O 452eec214f97b14ded4bed12ff24fa9b [0,1,0,0,0,1|0,0,0]=2 1436 B11R0.47 CCCOC(CCC)CC(=O)O d7d8def0439e966669fcdb77579c0258 [0,1,0,0,0,1|0,0,0]=2 1437 B11R0.47 CCCOC(CCC)C[N+](=O)[O-] 2985200f26c9be62c426bf92ba0cc6f7 [0,1,0,0,0,1|1,0,1]=4 1438 B11R0.47 CCC[C@@H](CC(=O)O)NCC#N 3cb01051370a8508a3a12a64d81699bc [0,1,0,0,0,1|1,0,1]=4 1439 B11R0.47 CCC[C@@H](CC(=O)O)NCC=O 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[0,2,0,0,0,0|1,0,0]=3 1527 B11R0.16 CCNC(CC(F)(F)F)C(=O)O a7ba319ae5fce9693524436587e5c1b5 [0,2,0,0,0,0|2,0,0]=4 1528 B11R0.16 CCN[C@@H](CC(C)(C)C)C(=O)O cec73506c5767b15027ea68e3aae071f [0,2,0,0,0,0|1,0,0]=3 1529 B11R0.16 CCN[C@@H](CC(C)(C)F)C(=O)O 4f385107cf0aa175985e340d7c637f54 [0,2,0,0,0,0|1,0,0]=3 1530 B11R0.16 CCN[C@@H](CC(C)(C)O)C(=O)O b1e64e65d1e462d5fbed469efcacbf0e [0,2,0,0,0,0|1,0,0]=3 1531 B11R0.16 CCN[C@@H](CC(F)(F)F)C(=O)O 6237da96ec41eece597b09cb36c472f8 [0,2,0,0,0,0|2,0,0]=4 1532 B11R0.16 CCN[C@H](CC(C)(C)C)C(=O)O 9c0f0774534a5b1858be98162d758f63 [0,2,0,0,0,0|1,0,0]=3 1533 B11R0.16 CCN[C@H](CC(F)(F)F)C(=O)O 93d26f73a9986ec487e8823047f8aa2c [0,2,0,0,0,0|2,0,0]=4 1534 B11R0.16 CCOC(CC(C)(C)C)C(=O)O 3d9ede0a93c75efa90a3426f0c965448 [0,2,0,0,0,0|1,0,0]=3 1535 B11R0.16 CCOC(CC(F)(F)F)C(=O)O 4167a8592ac056b547ef44846dff49c1 [0,2,0,0,0,0|2,0,0]=4 1536 B11R0.16 CCO[C@@H](CC(C)(C)C)C(=O)O 9b135ee008868c847c227d5476db9b35 [0,2,0,0,0,0|1,0,0]=3 1537 B11R0.16 CCO[C@H](CC(C)(C)C)C(=O)O 243308c1ae20b50999e69d555780848e [0,2,0,0,0,0|1,0,0]=3 1538 B11R0.16 COCC(NC(C)(C)C)C(=O)O 6c7677cbcce047a71caea058c3b04e3e [0,2,0,0,0,0|2,0,0]=4 1539 B11R0.32 C=C(C)CC(NC(C)C)C(=O)O 11fe48131821ff57bb36a8770c755167 [0,2,0,0,0,0|1,0,1]=4 1540 B11R0.32 C=C(C)C[C@@H](NC(C)C)C(=O)O 644e81132cfb497ba7b728eb95d557e9 [0,2,0,0,0,0|1,0,1]=4 1541 B11R0.32 C=C(C)C[C@H](NC(C)C)C(=O)O d27208b030c01ef98dcb7bae970719d4 [0,2,0,0,0,0|1,0,1]=4 1542 B11R0.32 CC(=O)N(CC(C)C)CC(C)C 517eb9457019dac6f886275fc66f3949 [0,2,0,0,0,0|2,0,0]=4 1543 B11R0.32 CC(=O)N(CC(C)O)CC(C)O cb4438409a66eb045e72ed8889e455c8 [0,2,0,0,0,0|2,0,0]=4 1544 B11R0.32 CC(C)CC(NC(C)C)C(=O)N 5e69b1ba9c6c78e59f760ebc5df882d9 [0,2,0,0,0,0|2,0,0]=4 1545 B11R0.32 CC(C)CC(NC(C)C)C(=O)O ca66c5d96a0a336a0fd364810ae6c479 [0,2,0,0,0,0|1,0,0]=3 1546 B11R0.32 CC(C)CC(OC(C)C)C(=O)O 0705925e05295556f73feb343e39ec6e [0,2,0,0,0,0|1,0,0]=3 1547 B11R0.32 CC(C)C[C@@H](NC(C)C)C(=O)N 26f064182bf6ffb460c4546391cb4c3d [0,2,0,0,0,0|2,0,0]=4 1548 B11R0.32 CC(C)C[C@@H](NC(C)C)C(=O)O 4f9dff8fdb8888dc65491f1b2f59b0b8 [0,2,0,0,0,0|1,0,0]=3 1549 B11R0.32 CC(C)C[C@@H](OC(C)C)C(=O)O fa0e129c598536eaebfe5b39e6235f26 [0,2,0,0,0,0|1,0,0]=3 1550 B11R0.32 CC(C)C[C@H](NC(C)C)C(=O)N 37d6ef1bd1d70f7d85cb7b768a942f9b [0,2,0,0,0,0|2,0,0]=4 1551 B11R0.32 CC(C)C[C@H](NC(C)C)C(=O)O ff077531db063e0801e78b8495e2d8d6 [0,2,0,0,0,0|1,0,0]=3 1552 B11R0.32 CC(C)C[C@H](OC(C)C)C(=O)O d470f2574f3ecb3e1e62cbb9fa605ca2 [0,2,0,0,0,0|1,0,0]=3 1553 B11R0.32 CC(C)NC(CC(F)F)C(=O)O 17c917252a0f335df8b32b5eeaea6d66 [0,2,0,0,0,0|2,0,0]=4 1554 B11R0.32 CC(C)N[C@@H](CC(F)F)C(=O)O 770b64082e5939d7df480de39c23e226 [0,2,0,0,0,0|2,0,0]=4 1555 B11R0.32 CC(C)N[C@@H](CS(=O)C)C(=O)O 6d8a3a4ce3124e52e0557f294c3f419c [0,2,0,0,0,0|2,0,0]=4 1556 B11R0.44 CC(O)[C@H](C)[C@H](NCF)C(=O)O 19c57015ee7fed04148587825188d788 [0,2,0,0,0,0|2,0,0]=4 1557 B11R0.44 CC(O)[C@H](C)[C@H](NCO)C(=O)O 70430f99f6aed8a406979c14afb99904 [0,2,0,0,0,0|2,0,0]=4 1558 B11R0.44 CCCC(C(=O)C)N(C)C(C)C 72960ed4866fbb5b239646a8ff2b24af [0,2,0,0,0,0|2,0,0]=4 1559 B11R0.44 CCCC(C(=O)O)N(C)C(C)C 4ebfabd20a8fba87579220bee1e1ede1 [0,2,0,0,0,0|1,0,0]=3 1560 B11R0.44 CCN[C@H](C(=O)O)[C@@H](C)C(C)O 1e60ac3006972cde55b892dd29581cfb [0,2,0,0,0,0|1,0,0]=3 1561 B11R0.44 CCN[C@H](C(=O)O)[C@@H](C)[C@H](C)O 5dcb0900e4f376cf8b5d8037b8e3f944 [0,2,0,0,0,0|1,0,0]=3 1562 B11R0.44 COCC(C(=O)O)N(C)C(C)C 53079c59ea402113dd2e4ac88987ad1b [0,2,0,0,0,0|2,0,0]=4 1563 B11R0.44 CSCC(C(=O)O)N(C)C(C)C e6d595b3fd683295901be36ec1bd9b5d [0,2,0,0,0,0|2,0,0]=4 1564 B11R0.44 C[C@@H]([C@H](C)O)[C@H](NCF)C(=O)O 0b60a65ff403dbfc77ac30e10e5bf371 [0,2,0,0,0,0|2,0,0]=4 1565 B11R0.44 C[C@@H]([C@H](C)O)[C@H](NCO)C(=O)O 8f77cd13d9bae4210c97af8426e29f28 [0,2,0,0,0,0|2,0,0]=4 1566 B11R0.115 CC(C)CC(C(=O)O)N(C)CF a99127b3a6eaf4d5ec9f0c6276dd08fd [0,2,0,0,0,0|2,0,0]=4 1567 B11R0.115 CC(C)CC(C(=O)O)N(C)CO 431a44ee58498f6bc23f52abb979420b [0,2,0,0,0,0|2,0,0]=4 1568 B11R0.115 CC(C)C[C@@H](C(=O)O)N(C)CF 7246f4ef30aefd0611d20799a9059661 [0,2,0,0,0,0|2,0,0]=4 1569 B11R0.115 CC(C)C[C@@H](C(=O)O)N(C)CO 9b9494a987a259ebe45813f5b3dc606f [0,2,0,0,0,0|2,0,0]=4 1570 B11R0.115 CC(C)C[C@H](C(=O)O)N(C)CF 03d73e313e7053fd879f82c4910508f5 [0,2,0,0,0,0|2,0,0]=4 1571 B11R0.115 CC(C)C[C@H](C(=O)O)N(C)CO 187827d1bade3376c9c5711f251cdf7e [0,2,0,0,0,0|2,0,0]=4 1572 B11R0.115 CC(C)N[C@H](C(=O)O)C(C)CO 6ae7b65fb38328eb8e55e07350368606 [0,2,0,0,0,0|2,0,0]=4 1573 B11R0.115 CCC(C)C(NC(C)C)C(=O)O c12f9801b131c7c8fafe779911f725bf [0,2,0,0,0,0|1,0,0]=3 1574 B11R0.115 CCC(C)C(OC(C)C)C(=O)O 759dcd7567b89fdf26236fe34cb208f4 [0,2,0,0,0,0|1,0,0]=3 1575 B11R0.115 CCC(O)C(NC(C)C)C(=O)O 50873d8c4c7762c131c31e02bcff8285 [0,2,0,0,0,0|1,0,0]=3 1576 B11R0.115 CCN(C)C(CC(C)C)C(=O)O 3d3a5ef1090e77b56f1fa7e585ea5134 [0,2,0,0,0,0|1,0,0]=3 1577 B11R0.115 CCN(C)[C@@H](CC(C)C)C(=O)O 6412665f3d3142116d86a36fdd4a7462 [0,2,0,0,0,0|1,0,0]=3 1578 B11R0.115 CCN(C)[C@H](CC(C)C)C(=O)O 39654528029db2346823b5f4700f7a13 [0,2,0,0,0,0|1,0,0]=3 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1589 B11R0.115 CO[C@@H](C)[C@@H](NC(C)C)C(=O)O 1b3236358fdc0b59c05010d11d15043b [0,2,0,0,0,0|2,0,0]=4 1590 B11R0.115 CO[C@@H](C)[C@H](NC(C)C)C(=O)O dc041576d502b5b92a80405862115770 [0,2,0,0,0,0|2,0,0]=4 1591 B11R0.115 CO[C@H](C)[C@@H](NC(C)C)C(=O)O 15186a3bf0e2166075450c4931f6dade [0,2,0,0,0,0|2,0,0]=4 1592 B11R0.115 CO[C@H](C)[C@H](NC(C)C)C(=O)O 6460686fd31e79248f2ebfb48923cd2e [0,2,0,0,0,0|2,0,0]=4 1593 B11R0.160 C#CCCC(NC(C)C)C(=O)O 21dc05aa10c5cdaca5fbdff7244f1361 [0,2,0,0,0,0|1,0,1]=4 1594 B11R0.160 C#CCC[C@@H](NC(C)C)C(=O)O ceaeffe778e12df53358402ceed16cf9 [0,2,0,0,0,0|1,0,1]=4 1595 B11R0.160 C#CCC[C@H](NC(C)C)C(=O)O a0c94c7886c5e156106d5a86b223b626 [0,2,0,0,0,0|1,0,1]=4 1596 B11R0.160 C#CCNC(CC(C)C)C(=O)O 0a4798cea0ba4a0318010431c303eab2 [0,2,0,0,0,0|0,0,2]=4 1597 B11R0.160 C#CCN[C@@H](CC(C)C)C(=O)O b82fe1f5ddcc08838edad0f22f6c88dd [0,2,0,0,0,0|0,0,2]=4 1598 B11R0.160 C#CCN[C@H](CC(C)C)C(=O)O 9933cf9160dff6ea4f1433dd9d4f2a39 [0,2,0,0,0,0|0,0,2]=4 1599 B11R0.160 C#CCOC(CC(C)C)C(=O)O a96db52bdca5ce293f9d9ecc222b5bf5 [0,2,0,0,0,0|0,0,2]=4 1600 B11R0.160 C#CCO[C@@H](CC(C)C)C(=O)O 53e4f86538ddfcda89b15e6a829ead3f [0,2,0,0,0,0|0,0,2]=4 1601 B11R0.160 C#CCO[C@H](CC(C)C)C(=O)O aa4ba5c5a174984343ba9bbe68567448 [0,2,0,0,0,0|0,0,2]=4 1602 B11R0.160 C=C(Br)CC(NCCC)C(=O)O bb79be163f94e9b32787623f4969d88d [0,2,0,0,0,0|0,0,2]=4 1603 B11R0.160 C=C(Br)C[C@@H](NCCC)C(=O)O 634b1ac34ebf8b24bbd67b0f414d082c [0,2,0,0,0,0|0,0,2]=4 1604 B11R0.160 C=C(Br)C[C@H](NCCC)C(=O)O b029dcce20ceb462387dee59740a08c6 [0,2,0,0,0,0|0,0,2]=4 1605 B11R0.160 C=C(C)CC(NCCC)C(=O)O f8963f8c0dc767618c0a0e7881b944fa [0,2,0,0,0,0|0,0,1]=3 1606 B11R0.160 C=C(C)CC(NCCF)C(=O)O 100e9347a3212024e654e9e98c81235a [0,2,0,0,0,0|1,0,1]=4 1607 B11R0.160 C=C(C)CC(NCCO)C(=O)O 7b2fc6b3072d7bb63bf205495809969f [0,2,0,0,0,0|1,0,1]=4 1608 B11R0.160 C=C(C)CC(NCCS)C(=O)O 582f947ae0412a2eaf069179b574ab4a [0,2,0,0,0,0|1,0,1]=4 1609 B11R0.160 C=C(C)CC(NCOC)C(=O)O f01c32e6a8fe931846a6511b89c7c3f5 [0,2,0,0,0,0|1,0,1]=4 1610 B11R0.160 C=C(C)CC(NCSC)C(=O)O 1e719bb128cadcbe8a94e841c899e3e5 [0,2,0,0,0,0|1,0,1]=4 1611 B11R0.160 C=C(C)C[C@@H](NCCC)C(=O)O dd4cf542d714a62df5b5ce171f1769e1 [0,2,0,0,0,0|0,0,1]=3 1612 B11R0.160 C=C(C)C[C@@H](NCCF)C(=O)O 61142cddd71ec7a78460aa2277279be6 [0,2,0,0,0,0|1,0,1]=4 1613 B11R0.160 C=C(C)C[C@@H](NCCO)C(=O)O 661814e4106149190040e85aa420de1c [0,2,0,0,0,0|1,0,1]=4 1614 B11R0.160 C=C(C)C[C@@H](NCCS)C(=O)O c175c0e843b4e47f1cd8b28cd032799e [0,2,0,0,0,0|1,0,1]=4 1615 B11R0.160 C=C(C)C[C@@H](NCOC)C(=O)O 9599049acd315e32fa23017ee8d9c5de [0,2,0,0,0,0|1,0,1]=4 1616 B11R0.160 C=C(C)C[C@@H](NCSC)C(=O)O 186931cb235e7e046694a1ae8ca80c81 [0,2,0,0,0,0|1,0,1]=4 1617 B11R0.160 C=C(C)C[C@H](NCCC)C(=O)O 56c845c38598718eb4f65da94fffb4a0 [0,2,0,0,0,0|0,0,1]=3 1618 B11R0.160 C=C(C)C[C@H](NCCF)C(=O)O 91c130712625880aa4d33092bab6ec52 [0,2,0,0,0,0|1,0,1]=4 1619 B11R0.160 C=C(C)C[C@H](NCCO)C(=O)O 557868de4dc4f2ff59ec7da2845731a6 [0,2,0,0,0,0|1,0,1]=4 1620 B11R0.160 C=C(C)C[C@H](NCCS)C(=O)O 9486e6206dfe39420dcda6ce949396be [0,2,0,0,0,0|1,0,1]=4 1621 B11R0.160 C=C(C)C[C@H](NCOC)C(=O)O 6a6a6f4d6b68d544151f890fb5f9ff13 [0,2,0,0,0,0|1,0,1]=4 1622 B11R0.160 C=C(C)C[C@H](NCSC)C(=O)O 57f97f90c866c2329695f444c8564c43 [0,2,0,0,0,0|1,0,1]=4 1623 B11R0.160 C=CCCC(NC(C)C)C(=O)O 2e186f7e54aa1b1e6c9d72b10fd77fc6 [0,2,0,0,0,0|1,0,1]=4 1624 B11R0.160 C=CCC[C@@H](NC(C)C)C(=O)O c68c6b6711293c6ab546167b6402ac65 [0,2,0,0,0,0|1,0,1]=4 1625 B11R0.160 C=CCC[C@H](NC(C)C)C(=O)O 20ec9ad649e611f7416a4a14c70dfba9 [0,2,0,0,0,0|1,0,1]=4 1626 B11R0.160 C=CCNC(CC(C)C)C(=O)O 9950ef3848560f2161a7976f5cdba7cf [0,2,0,0,0,0|0,0,2]=4 1627 B11R0.160 C=CCN[C@@H](CC(C)C)C(=O)O 7404e2c1d1ca54638b83283e0bd726a8 [0,2,0,0,0,0|0,0,2]=4 1628 B11R0.160 C=CCN[C@H](CC(C)C)C(=O)O 81776b1a8f15b462220741e4931eb197 [0,2,0,0,0,0|0,0,2]=4 1629 B11R0.160 C=CCOC(CC(C)C)C(=O)O 1c0234b6d179c3c1f4da46fd5bbeb541 [0,2,0,0,0,0|0,0,2]=4 1630 B11R0.160 C=CCO[C@@H](CC(C)C)C(=O)O cc0fa93e20b34dc005e97ca609a2893b [0,2,0,0,0,0|0,0,2]=4 1631 B11R0.160 C=CCO[C@H](CC(C)C)C(=O)O 66906f1908c4764150e4ecc997b42842 [0,2,0,0,0,0|0,0,2]=4 1632 B11R0.160 CC#CC[C@@H](NC(C)C)C(=O)O af121db03b1a4c8c2bd03f87a77655cb [0,2,0,0,0,0|1,0,1]=4 1633 B11R0.160 CC#CC[C@H](NC(C)C)C(=O)O 56026e27bd02ed9576972307a00cc09b [0,2,0,0,0,0|1,0,1]=4 1634 B11R0.160 CC(C)CC(CNCF)C(=O)O 59202c1b8e454c9ca3cf8dcf0c87ca3e [0,2,0,0,0,0|1,0,0]=3 1635 B11R0.160 CC(C)CC(CNCO)C(=O)O 90f1fc647da079a7ab913e6a0fda7aea [0,2,0,0,0,0|1,0,0]=3 1636 B11R0.160 CC(C)CC(NCC#N)C(=O)O d770fc644ea31baf261c0b1928cb3ce8 [0,2,0,0,0,0|1,0,1]=4 1637 B11R0.160 CC(C)CC(NCC=O)C(=O)O ee7da2acc16bdd90c46431810821f2fe [0,2,0,0,0,0|1,0,1]=4 1638 B11R0.160 CC(C)CC(NCCBr)C(=O)O 22069d6544e6184310faa39fe9d975f6 [0,2,0,0,0,0|1,0,0]=3 1639 B11R0.160 CC(C)CC(NCCF)C(=O)N 75724b571773e3bf7f34c8ab16a4c647 [0,2,0,0,0,0|2,0,0]=4 1640 B11R0.160 CC(C)CC(NCCF)C(=O)O d6de917556612e23b7e46d8780a738c6 [0,2,0,0,0,0|1,0,0]=3 1641 B11R0.160 CC(C)CC(NCCI)C(=O)O 6b0469eba23c58e6da2805377f660162 [0,2,0,0,0,0|1,0,0]=3 1642 B11R0.160 CC(C)CC(NCCO)C(=O)N 586d9a1e65847ae5564c25dd8d173b14 [0,2,0,0,0,0|2,0,0]=4 1643 B11R0.160 CC(C)CC(NCCO)C(=O)O 6cfa8cd44af006ec3d9ea78773aa4a9f [0,2,0,0,0,0|1,0,0]=3 1644 B11R0.160 CC(C)CC(NCCS)C(=O)N 19fe5824214436f23a07573c616f6a3e [0,2,0,0,0,0|2,0,0]=4 1645 B11R0.160 CC(C)CC(NCCS)C(=O)O 4d60ea329ec3d1269cb53ec2e469b597 [0,2,0,0,0,0|1,0,0]=3 1646 B11R0.160 CC(C)CC(OCC#N)C(=O)O 05997b6594618deb0a3d5f06455f6f14 [0,2,0,0,0,0|1,0,1]=4 1647 B11R0.160 CC(C)CC(OCC=O)C(=O)O 3bcb05587a0d63489979c93cc814c1b6 [0,2,0,0,0,0|1,0,1]=4 1648 B11R0.160 CC(C)CC(OCCF)C(=O)O c30d068d2ad7e6c59de55e4dc2540033 [0,2,0,0,0,0|1,0,0]=3 1649 B11R0.160 CC(C)CC(OCCS)C(=O)O dd723e31511ee736dd681d517de34ef4 [0,2,0,0,0,0|1,0,0]=3 1650 B11R0.160 CC(C)C[C@@H](CNCF)C(=O)O 9df283e5da63e37b5c8acd9abf4745d2 [0,2,0,0,0,0|1,0,0]=3 1651 B11R0.160 CC(C)C[C@@H](CNCO)C(=O)O dec0d731bd15cf36a8300f66dfcb7a70 [0,2,0,0,0,0|1,0,0]=3 1652 B11R0.160 CC(C)C[C@@H](NCC#N)C(=O)O 961e52565a27da2be3f57e460221f252 [0,2,0,0,0,0|1,0,1]=4 1653 B11R0.160 CC(C)C[C@@H](NCC=O)C(=O)O e566144ad05f294a93176203cfae39d2 [0,2,0,0,0,0|1,0,1]=4 1654 B11R0.160 CC(C)C[C@@H](NCCBr)C(=O)O a3158cb4c87f420961657fac43eb33a7 [0,2,0,0,0,0|1,0,0]=3 1655 B11R0.160 CC(C)C[C@@H](NCCF)C(=O)N 190872488e8f71524afd71a1d3774d80 [0,2,0,0,0,0|2,0,0]=4 1656 B11R0.160 CC(C)C[C@@H](NCCF)C(=O)O b4f8a6d35e772c42266eadc79a477989 [0,2,0,0,0,0|1,0,0]=3 1657 B11R0.160 CC(C)C[C@@H](NCCI)C(=O)O 551f7fe187650f73144f51dd022fff9a [0,2,0,0,0,0|1,0,0]=3 1658 B11R0.160 CC(C)C[C@@H](NCCO)C(=O)N 8ca286045bd9e869dc66fa791c226c01 [0,2,0,0,0,0|2,0,0]=4 1659 B11R0.160 CC(C)C[C@@H](NCCO)C(=O)O 28272441d65ada29560d2a32f897da61 [0,2,0,0,0,0|1,0,0]=3 1660 B11R0.160 CC(C)C[C@@H](NCCS)C(=O)N 26935fbb5d909f3f09b64ad650543b37 [0,2,0,0,0,0|2,0,0]=4 1661 B11R0.160 CC(C)C[C@@H](NCCS)C(=O)O 1e4bb286653981f24283cb1ec443b6f1 [0,2,0,0,0,0|1,0,0]=3 1662 B11R0.160 CC(C)C[C@@H](OCC#N)C(=O)O 2fd6a17f497645bbe196b556a717a7e2 [0,2,0,0,0,0|1,0,1]=4 1663 B11R0.160 CC(C)C[C@@H](OCC=O)C(=O)O 320daa3d3a83211514287effe3ed0ea0 [0,2,0,0,0,0|1,0,1]=4 1664 B11R0.160 CC(C)C[C@@H](OCCF)C(=O)O 334e4b2bcfd28b7b782a6f39a01ce36c [0,2,0,0,0,0|1,0,0]=3 1665 B11R0.160 CC(C)C[C@@H](OCCS)C(=O)O 5471113cbdd9f4ccf2f263bdf73910f3 [0,2,0,0,0,0|1,0,0]=3 1666 B11R0.160 CC(C)C[C@H](CNCF)C(=O)O c70928a9fdf39eebfd6294dff92fd84d [0,2,0,0,0,0|1,0,0]=3 1667 B11R0.160 CC(C)C[C@H](CNCO)C(=O)O db93830533dc9124a11d0f45d91c1a96 [0,2,0,0,0,0|1,0,0]=3 1668 B11R0.160 CC(C)C[C@H](NCC#N)C(=O)O 7ff2680cf19bf15d35a0863c1887e617 [0,2,0,0,0,0|1,0,1]=4 1669 B11R0.160 CC(C)C[C@H](NCC=O)C(=O)O f2ad265d81e943f119f951901c65711d [0,2,0,0,0,0|1,0,1]=4 1670 B11R0.160 CC(C)C[C@H](NCCBr)C(=O)O 523bc30c22f4791c3be6f9fda7db11ab [0,2,0,0,0,0|1,0,0]=3 1671 B11R0.160 CC(C)C[C@H](NCCF)C(=O)N 835373dc773215b637f3a26689f80d02 [0,2,0,0,0,0|2,0,0]=4 1672 B11R0.160 CC(C)C[C@H](NCCF)C(=O)O 37764d13c6b92f1d62c3e413dac9cfe9 [0,2,0,0,0,0|1,0,0]=3 1673 B11R0.160 CC(C)C[C@H](NCCI)C(=O)O 65d0bc0ed7190cc1ab80544280c97da3 [0,2,0,0,0,0|1,0,0]=3 1674 B11R0.160 CC(C)C[C@H](NCCO)C(=O)N 65d59c2d3deca92bab1333096f81ada0 [0,2,0,0,0,0|2,0,0]=4 1675 B11R0.160 CC(C)C[C@H](NCCO)C(=O)O ebc820727daad2d2396868149ae06c86 [0,2,0,0,0,0|1,0,0]=3 1676 B11R0.160 CC(C)C[C@H](NCCS)C(=O)N 40194fc9efc6717e2e2501a11064f6f2 [0,2,0,0,0,0|2,0,0]=4 1677 B11R0.160 CC(C)C[C@H](NCCS)C(=O)O d2a22c744173e5df2167c7dc4ea89c84 [0,2,0,0,0,0|1,0,0]=3 1678 B11R0.160 CC(C)C[C@H](OCC#N)C(=O)O c0bab8c9e930b66204622768f4ff239c [0,2,0,0,0,0|1,0,1]=4 1679 B11R0.160 CC(C)C[C@H](OCC=O)C(=O)O 68e3186895d9cfa8863818e3290fd780 [0,2,0,0,0,0|1,0,1]=4 1680 B11R0.160 CC(C)C[C@H](OCCF)C(=O)O bd820190e1e4512031840e8942f0f233 [0,2,0,0,0,0|1,0,0]=3 1681 B11R0.160 CC(C)C[C@H](OCCS)C(=O)O 2022b6936fa0c0b20d21e9175bc4d7ec [0,2,0,0,0,0|1,0,0]=3 1682 B11R0.160 CC(C)N[C@@H](CCCO)C(=O)O 0b1b0393167626ef50fa57f517095c55 [0,2,0,0,0,0|1,0,0]=3 1683 B11R0.160 CC(C)N[C@H](CCCO)C(=O)O 18eccbbc24793b9f9e52cb911cf4bfa9 [0,2,0,0,0,0|1,0,0]=3 1684 B11R0.160 CCCCC(NC(C)C)C(=O)N 27c545879bd6c46b2bda52b7a2c5abaa [0,2,0,0,0,0|2,0,0]=4 1685 B11R0.160 CCCCC(NC(C)C)C(=O)O 25f9b42d9924ecbf2146b81d1f77e689 [0,2,0,0,0,0|1,0,0]=3 1686 B11R0.160 CCCCC(OC(C)C)C(=O)N aea3cecfb6096df1affb64d13a4398e4 [0,2,0,0,0,0|2,0,0]=4 1687 B11R0.160 CCCC[C@@H](NC(C)C)C(=O)O c56ae27afbd567f9f50e4560fb47bdae [0,2,0,0,0,0|1,0,0]=3 1688 B11R0.160 CCCC[C@H](NC(C)C)C(=O)O 153a21c7f681bad57bee84c0f6f9bc65 [0,2,0,0,0,0|1,0,0]=3 1689 B11R0.160 CCCNC(CC(=O)N)C(=O)O 5e52991931219f76cdd7a43c1fad4536 [0,2,0,0,0,0|1,0,1]=4 1690 B11R0.160 CCCNC(CC(=O)O)C(=O)O 79d4d192351448b8df2c115006057c2e [0,2,0,0,0,0|1,0,1]=4 1691 B11R0.160 CCCNC(CC(C)C)C(=O)N 450f2402b8605bdb746cce941172e8a6 [0,2,0,0,0,0|1,0,0]=3 1692 B11R0.160 CCCNC(CC(C)C)C(=O)O 38e4b1fa1ecd4a4d5fe4ba7c4f96cdcd [0,2,0,0,0,0|0,0,0]=2 1693 B11R0.160 CCCNC(CC(F)F)C(=O)O 0ef88647af44180f58b75e62261ce4c1 [0,2,0,0,0,0|1,0,0]=3 1694 B11R0.160 CCCN[C@@H](CC(=O)N)C(=O)O 76192ec77430319f677e8a8ba9fd4d60 [0,2,0,0,0,0|1,0,1]=4 1695 B11R0.160 CCCN[C@@H](CC(=O)O)C(=O)O 5623cd4045334f1514b7dae32a78207c [0,2,0,0,0,0|1,0,1]=4 1696 B11R0.160 CCCN[C@@H](CC(C)C)C(=O)N 28cc45082af61bc444f9edbb4950839f [0,2,0,0,0,0|1,0,0]=3 1697 B11R0.160 CCCN[C@@H](CC(C)C)C(=O)O 004ff41f4fbe8d26f788cf04354156a7 [0,2,0,0,0,0|0,0,0]=2 1698 B11R0.160 CCCN[C@@H](CC(F)F)C(=O)O 5dacee398871a807b07a6142fec7eab6 [0,2,0,0,0,0|1,0,0]=3 1699 B11R0.160 CCCN[C@@H](CS(=O)C)C(=O)O beb2534c7347d36abf5a0a9beeb20bb4 [0,2,0,0,0,0|1,0,0]=3 1700 B11R0.160 CCCN[C@@H](CS(=O)O)C(=O)O 5d68d4f5b9aa34f1ffe376ee18d7898a [0,2,0,0,0,0|2,0,0]=4 1701 B11R0.160 CCCN[C@H](CC(=O)N)C(=O)O bf688dd9710be90746e3f702da457da3 [0,2,0,0,0,0|1,0,1]=4 1702 B11R0.160 CCCN[C@H](CC(=O)O)C(=O)O ed1f15793ef83dda399a71102627793c [0,2,0,0,0,0|1,0,1]=4 1703 B11R0.160 CCCN[C@H](CC(C)C)C(=O)N c3716a5bcf6ea0119b920ce70969fe8a [0,2,0,0,0,0|1,0,0]=3 1704 B11R0.160 CCCN[C@H](CC(C)C)C(=O)O 8fc76d44fd5997f61ac1e7306a79e239 [0,2,0,0,0,0|0,0,0]=2 1705 B11R0.160 CCCOC(CC(=O)C)C(=O)C 4308fcacd3a226bed94fad6fcd55778d [0,2,0,0,0,0|1,0,1]=4 1706 B11R0.160 CCCOC(CC(=O)O)C(=O)O 11890a2e8c75f73f13785761d9ecc9c3 [0,2,0,0,0,0|1,0,1]=4 1707 B11R0.160 CCCOC(CC(C)C)C(=O)O c4ac57899174601f6466b366981d46f5 [0,2,0,0,0,0|0,0,0]=2 1708 B11R0.160 CCCO[C@@H](CC(=O)O)C(=O)O 4a1aa792d46cd005c5326b4de5fd0ab8 [0,2,0,0,0,0|1,0,1]=4 1709 B11R0.160 CCCO[C@@H](CC(C)C)C(=O)O db8c6a1b9d18b1a2a8dcaeba865bf57e [0,2,0,0,0,0|0,0,0]=2 1710 B11R0.160 CCCO[C@H](CC(=O)O)C(=O)O 1993589759ed5844d7618c9d4c3b9875 [0,2,0,0,0,0|1,0,1]=4 1711 B11R0.160 CCCO[C@H](CC(C)C)C(=O)O e0af17bd971234518250746ee3ecd0f9 [0,2,0,0,0,0|0,0,0]=2 1712 B11R0.160 CCNCC(CC(C)C)C(=O)O f04e84bb31ce62e08c50fe3e3b2ba3ad [0,2,0,0,0,0|0,0,0]=2 1713 B11R0.160 CCNC[C@@H](CC(C)C)C(=O)O 3a8061a4c46a6aa7d3586c73e2e0dd0e [0,2,0,0,0,0|0,0,0]=2 1714 B11R0.160 CCNC[C@H](CC(C)C)C(=O)O b09a87571e4e9a98ddf4c402d425b8f6 [0,2,0,0,0,0|0,0,0]=2 1715 B11R0.160 CCOCC(NC(=O)C)C(=O)O 3aecb95a4d576e2c2d5a2d81dbd9cef8 [0,2,0,0,0,0|1,0,1]=4 1716 B11R0.160 CCOC[C@@H](NC(=O)C)C(=O)O 5f047f0b96471f5369450a7b187eb08c [0,2,0,0,0,0|1,0,1]=4 1717 B11R0.160 CCOC[C@H](NC(=O)C)C(=O)O 529155ba3344f8825bbd7829cfc19c9e [0,2,0,0,0,0|1,0,1]=4 1718 B11R0.160 COCC[C@H](NC(C)C)C(=O)O b6e85e01704d3a63bbcafd7e446e7213 [0,2,0,0,0,0|1,0,0]=3 1719 B11R0.160 COCNC(CC(C)C)C(=O)N 856ca4230c6b02087f4fb83d0e7e67cc [0,2,0,0,0,0|2,0,0]=4 1720 B11R0.160 COCNC(CC(C)C)C(=O)O 115a313ca344acb024d1b7b527e5b25a [0,2,0,0,0,0|1,0,0]=3 1721 B11R0.160 COCNC(CC(F)F)C(=O)O ac1d6ed446849ae6e9e933c9efbdb8b6 [0,2,0,0,0,0|2,0,0]=4 1722 B11R0.160 COCN[C@@H](CC(C)C)C(=O)N c66b2e9b90c6492e453881d15f22b711 [0,2,0,0,0,0|2,0,0]=4 1723 B11R0.160 COCN[C@@H](CC(C)C)C(=O)O b1a54951cfc26e425eb9d7ee291c83a9 [0,2,0,0,0,0|1,0,0]=3 1724 B11R0.160 COCN[C@@H](CC(F)F)C(=O)O 4701dc0a7baf287d90d23731660361be [0,2,0,0,0,0|2,0,0]=4 1725 B11R0.160 COCN[C@@H](CS(=O)C)C(=O)O 3929938a54fb5f1ea3bd8411f7b82abf [0,2,0,0,0,0|2,0,0]=4 1726 B11R0.160 COCN[C@H](CC(C)C)C(=O)N 6d0e12ac991331249d80e2ebb3772f98 [0,2,0,0,0,0|2,0,0]=4 1727 B11R0.160 COCN[C@H](CC(C)C)C(=O)O cf31eab87c2fa9f94a0f566954632897 [0,2,0,0,0,0|1,0,0]=3 1728 B11R0.160 COCOC(CC(C)C)C(=O)O 0ae5898716778e9fd08bcc86db1bb802 [0,2,0,0,0,0|1,0,0]=3 1729 B11R0.160 COCO[C@@H](CC(C)C)C(=O)O 23c95a4ab008475de37e4020b1cd24e7 [0,2,0,0,0,0|1,0,0]=3 1730 B11R0.160 COCO[C@H](CC(C)C)C(=O)O 8a6aac6fee41a8837bc9895fe2e6a0d1 [0,2,0,0,0,0|1,0,0]=3 1731 B11R0.160 CS(=O)C[C@H](NCCF)C(=O)O b0feaad0b7b4a8c8b67673336427d023 [0,2,0,0,0,0|2,0,0]=4 1732 B11R0.160 CS(=O)C[C@H](NCCO)C(=O)O c6fe54c1e643e28597a5287e3e7357ed [0,2,0,0,0,0|2,0,0]=4 1733 B11R0.160 CS(=O)C[C@H](NCCS)C(=O)O ba4e67f93de0d9606da93a5a507e90bf [0,2,0,0,0,0|2,0,0]=4 1734 B11R0.160 CSCCC(NC(C)C)C(=O)O 2b00740d33fffddd73af3d887852123a [0,2,0,0,0,0|1,0,0]=3 1735 B11R0.160 CSCCC(OC(C)C)C(=O)N 7ef08ee030706739e21c8291ee5f57ea [0,2,0,0,0,0|2,0,0]=4 1736 B11R0.160 CSCCC(OC(C)C)C(=O)O bd201aba6db087b7e9c7b00414bc08a6 [0,2,0,0,0,0|1,0,0]=3 1737 B11R0.160 CSCC[C@@H](NC(C)C)C(=O)O ad1132d51ded5578b0b311b3d13258b3 [0,2,0,0,0,0|1,0,0]=3 1738 B11R0.160 CSCC[C@H](NC(C)C)C(=O)N 9b49ee7147f0ef40ba04c65eaf386341 [0,2,0,0,0,0|2,0,0]=4 1739 B11R0.160 CSCC[C@H](NC(C)C)C(=O)O d6024d2efaaa0f3562283e1158399e46 [0,2,0,0,0,0|1,0,0]=3 1740 B11R0.160 CSCNC(CC(C)C)C(=O)N 583158fe02d437502886ca8f9ee4990c [0,2,0,0,0,0|2,0,0]=4 1741 B11R0.160 CSCNC(CC(C)C)C(=O)O 959bcddbc4169359fac72da3cd43d66f [0,2,0,0,0,0|1,0,0]=3 1742 B11R0.160 CSCNC(CC(F)F)C(=O)O b08789df616aa2603e0d793a0da93cca [0,2,0,0,0,0|2,0,0]=4 1743 B11R0.160 CSCN[C@@H](CC(C)C)C(=O)N 2ab9bbfa6d739f6b2b44e18a934525a4 [0,2,0,0,0,0|2,0,0]=4 1744 B11R0.160 CSCN[C@@H](CC(C)C)C(=O)O 4e665f052794c32321d33c9ec4d6e61d [0,2,0,0,0,0|1,0,0]=3 1745 B11R0.160 CSCN[C@@H](CC(F)F)C(=O)O f9eb4a27c658b879213f2edef17b7952 [0,2,0,0,0,0|2,0,0]=4 1746 B11R0.160 CSCN[C@@H](CS(=O)C)C(=O)O 116937ddf3b55b5693c2689afc7e7d2a [0,2,0,0,0,0|2,0,0]=4 1747 B11R0.160 CSCN[C@H](CC(C)C)C(=O)N 1f082b42db1b026af345e6c6d5f4d891 [0,2,0,0,0,0|2,0,0]=4 1748 B11R0.160 CSCN[C@H](CC(C)C)C(=O)O ceca99eb548165acda2ea198a23b0687 [0,2,0,0,0,0|1,0,0]=3 1749 B11R0.160 CSCOC(CC(C)C)C(=O)O b6802eccd30a73078ddef01edf458099 [0,2,0,0,0,0|1,0,0]=3 1750 B11R0.160 CSCO[C@@H](CC(C)C)C(=O)O f4f94e80e00601ae4df542a81e1046f7 [0,2,0,0,0,0|1,0,0]=3 1751 B11R0.160 CSCO[C@H](CC(C)C)C(=O)O 64cab061c7cce9796c66a7b3bc35eb98 [0,2,0,0,0,0|1,0,0]=3 1752 B11R0.160 O=C(O)C(CC(F)F)NCCF 2de25ca6f89d5d7d5d246e8861f171a0 [0,2,0,0,0,0|2,0,0]=4 1753 B11R0.160 O=C(O)C(CC(F)F)NCCO 73f4af455dd84d66b415491a0835afbf [0,2,0,0,0,0|2,0,0]=4 1754 B11R0.160 O=C(O)C(CC(F)F)NCCS 117845d0168d182a567a5c4daeb3f450 [0,2,0,0,0,0|2,0,0]=4 1755 B11R0.160 O=C(O)[C@H](CC(F)F)NCCF 5966161afb0367099b8af4dc211ebf4f [0,2,0,0,0,0|2,0,0]=4 1756 B11R0.160 O=C(O)[C@H](CC(F)F)NCCO dd25395ca6c3391a2c1262b4820c50f8 [0,2,0,0,0,0|2,0,0]=4 1757 B11R0.160 O=C(O)[C@H](CC(F)F)NCCS 3d7b5aa4ca417b1cf83485f5c9ed1f45 [0,2,0,0,0,0|2,0,0]=4 1758 B11R0.181 CCCC(C)(NC(C)C)C(=O)O 47ca206e258a0e831c61a9863426d107 [0,2,0,0,0,0|1,0,0]=3 1759 B11R0.181 CCC[C@@](C)(NC(C)C)C(=O)O b8cda1daf98bac7bd0fc0573f1ee4eb7 [0,2,0,0,0,0|1,0,0]=3 1760 B11R0.181 CCC[C@](C)(NC(C)C)C(=O)O 5a591466633e45a1e360d9012eacd04f [0,2,0,0,0,0|1,0,0]=3 1761 B11R0.236 C#CC(C)NC(CCC)C(=O)C 5526e49b9250b134439070e222d78741 [0,2,0,0,0,0|2,0,0]=4 1762 B11R0.236 C#CC(C)NC(CCC)C(=O)O d414eabfb69f9d943a3343b3479c5418 [0,2,0,0,0,0|1,0,0]=3 1763 B11R0.236 C#CC(C)NC(CCS)C(=O)O 9675ef1c6ad7c6c425c516dc5c3fb3a0 [0,2,0,0,0,0|2,0,0]=4 1764 B11R0.236 C#CC(C)NC(COC)C(=O)O a8eab3c29f77e043f8ac3f7acd275d87 [0,2,0,0,0,0|2,0,0]=4 1765 B11R0.236 C#CC(C)NC(CSC)C(=O)O c4a49db027361e350d00d40a2d7422e5 [0,2,0,0,0,0|2,0,0]=4 1766 B11R0.236 C#CC(C)N[C@@H](CCC)C(=O)O 773432b45b822511fbc01005349576f1 [0,2,0,0,0,0|1,0,0]=3 1767 B11R0.236 C#CC(C)N[C@@H](CCS)C(=O)O 0bf34f68b26a61794990d6cc87c09772 [0,2,0,0,0,0|2,0,0]=4 1768 B11R0.236 C#CC(C)N[C@@H](CSC)C(=O)O d5294aae2910a82e6a5b383c318b71d3 [0,2,0,0,0,0|2,0,0]=4 1769 B11R0.236 C#CC(C)N[C@H](CCC)C(=O)O b6730806ed1ebc564789c46e6aab2fa9 [0,2,0,0,0,0|1,0,0]=3 1770 B11R0.236 C#CC(C)N[C@H](CCS)C(=O)O e8cce69533977b151dae73c367f0229f [0,2,0,0,0,0|2,0,0]=4 1771 B11R0.236 C#CC(C)N[C@H](CSC)C(=O)O 090da6b7ae1a2095bddb2f923a17a1f3 [0,2,0,0,0,0|2,0,0]=4 1772 B11R0.236 C#CC(C)OC(CCC)C(=O)C 98bd889611d674b6dafa6e6fe87ebf9e [0,2,0,0,0,0|2,0,0]=4 1773 B11R0.236 C#CC(C)OC(COC)C(=O)O 19872b7710af7f7efb8524affd5c4ba5 [0,2,0,0,0,0|2,0,0]=4 1774 B11R0.236 C#CCC(NC(C)CC)C(=O)O ef198d955e0d51e78ed526c593105afd [0,2,0,0,0,0|0,0,2]=4 1775 B11R0.236 C#CCC(OC(C)CC)C(=O)O a93f6acb195942948bdb5561d4a8f5c8 [0,2,0,0,0,0|0,0,2]=4 1776 B11R0.236 C#CC[C@@H](NC(C)CC)C(=O)O f3c7eb6ee06399f90e8bf677ce4793e8 [0,2,0,0,0,0|0,0,2]=4 1777 B11R0.236 C#CC[C@H](NC(C)CC)C(=O)O 617736ea808554b83c73285dbe50a04a [0,2,0,0,0,0|0,0,2]=4 1778 B11R0.236 C#C[C@@H](C)NC(CCC)C(=O)C 3d7031481e0c17420f91b67efbf3ce74 [0,2,0,0,0,0|2,0,0]=4 1779 B11R0.236 C#C[C@@H](C)NC(CCC)C(=O)O b73ede9aa803743063139b6fc95eed6b [0,2,0,0,0,0|1,0,0]=3 1780 B11R0.236 C#C[C@@H](C)NC(COC)C(=O)O 155f07cc92ca72a422e4cc4ffa9dbe25 [0,2,0,0,0,0|2,0,0]=4 1781 B11R0.236 C#C[C@@H](C)N[C@@H](CCC)C(=O)O eebcc76c77b1bab572f76bfc1d81b73c [0,2,0,0,0,0|1,0,0]=3 1782 B11R0.236 C#C[C@@H](C)OC(CCC)C(=O)C dd56039ed3df75dda1f4dbdf50d229c2 [0,2,0,0,0,0|2,0,0]=4 1783 B11R0.236 C#C[C@@H](C)OC(COC)C(=O)O 9bd0a4780d3ab39416233d0140eb1ce1 [0,2,0,0,0,0|2,0,0]=4 1784 B11R0.236 C#C[C@H](C)NC(CCC)C(=O)C 0623d2612664d55e53911d91f28bbb63 [0,2,0,0,0,0|2,0,0]=4 1785 B11R0.236 C#C[C@H](C)NC(CCC)C(=O)O cc267f469526dc9386af5f1a5070d12f [0,2,0,0,0,0|1,0,0]=3 1786 B11R0.236 C#C[C@H](C)NC(COC)C(=O)O 6d4594c9b486c045cd6f1ac4dd60bcd5 [0,2,0,0,0,0|2,0,0]=4 1787 B11R0.236 C#C[C@H](C)N[C@@H](CCC)C(=O)O c249161111f9cc935feae03ce9fdbdbe [0,2,0,0,0,0|1,0,0]=3 1788 B11R0.236 C#C[C@H](C)OC(CCC)C(=O)C 9103fe8f345e386084575ca61ca54d90 [0,2,0,0,0,0|2,0,0]=4 1789 B11R0.236 C#C[C@H](C)OC(COC)C(=O)O af9ba233d10b020fb9fc5897081406b7 [0,2,0,0,0,0|2,0,0]=4 1790 B11R0.236 C=CC(C)NC(CCC)C(=O)C e298631840191d37bd4f284b68b3f98f [0,2,0,0,0,0|2,0,0]=4 1791 B11R0.236 C=CC(C)NC(CCC)C(=O)O 50adb1c93ea7aaf303000c226de7c87a [0,2,0,0,0,0|1,0,0]=3 1792 B11R0.236 C=CC(C)NC(CCO)C(=O)O 7bdcbac336bb42b091403b2f1746f953 [0,2,0,0,0,0|2,0,0]=4 1793 B11R0.236 C=CC(C)NC(CCS)C(=O)O 893c66b6d0188824650ace043a899abe [0,2,0,0,0,0|2,0,0]=4 1794 B11R0.236 C=CC(C)NC(COC)C(=O)O f2ae6538f3e75ab344a7d635ba6de2c2 [0,2,0,0,0,0|2,0,0]=4 1795 B11R0.236 C=CC(C)NC(CSC)C(=O)O 473084d7f7b38ae943440b4e458da12a [0,2,0,0,0,0|2,0,0]=4 1796 B11R0.236 C=CC(C)N[C@@H](CCC)C(=O)O 987b1b74bdebdee9c35f8d64e676fb4d [0,2,0,0,0,0|1,0,0]=3 1797 B11R0.236 C=CC(C)N[C@@H](CCO)C(=O)O 1ef50870bdd7cbcc4c2ea72e76b49fab [0,2,0,0,0,0|2,0,0]=4 1798 B11R0.236 C=CC(C)N[C@@H](CCS)C(=O)O 163e661081da965648cae1e86f947579 [0,2,0,0,0,0|2,0,0]=4 1799 B11R0.236 C=CC(C)N[C@@H](COC)C(=O)O c2aa41ae7522a0e3b959bc9490ee62db [0,2,0,0,0,0|2,0,0]=4 1800 B11R0.236 C=CC(C)N[C@@H](CSC)C(=O)O 65ba89e73bcbea51a37e018a90d5168f [0,2,0,0,0,0|2,0,0]=4 1801 B11R0.236 C=CC(C)N[C@H](CCC)C(=O)O 5faa14f96d7e561588099b6625064cf0 [0,2,0,0,0,0|1,0,0]=3 1802 B11R0.236 C=CC(C)N[C@H](CCO)C(=O)O 061977615bc3eb5135edac6b7d097758 [0,2,0,0,0,0|2,0,0]=4 1803 B11R0.236 C=CC(C)N[C@H](CCS)C(=O)O 41355f7df1c50563801c44fc4a47c479 [0,2,0,0,0,0|2,0,0]=4 1804 B11R0.236 C=CC(C)N[C@H](COC)C(=O)O 0550a05d187f289a950dff4e8e962be8 [0,2,0,0,0,0|2,0,0]=4 1805 B11R0.236 C=CC(C)N[C@H](CSC)C(=O)O 3dfb54ef51ee39fdf1b4206c146524e1 [0,2,0,0,0,0|2,0,0]=4 1806 B11R0.236 C=CC(C)OC(CCC)C(=O)C 9e93b45bbe967f9ad28f2f913d5b9b6a [0,2,0,0,0,0|2,0,0]=4 1807 B11R0.236 C=CC(C)OC(CCC)C(=O)N f2c1431acac94998ee76ffe4e23e5e54 [0,2,0,0,0,0|2,0,0]=4 1808 B11R0.236 C=CC(C)OC(CCC)C(=O)O 324061fcf554bcab78ba1fc6b806ecec [0,2,0,0,0,0|1,0,0]=3 1809 B11R0.236 C=CC(C)OC(COC)C(=O)O 92ec310a3e2e609ca3294488348c8da0 [0,2,0,0,0,0|2,0,0]=4 1810 B11R0.236 C=CC(C)OC(CSC)C(=O)O dd943b9eb0c5ed79f271a1541488f290 [0,2,0,0,0,0|2,0,0]=4 1811 B11R0.236 C=CC(C)O[C@@H](CCC)C(=O)O 578daa6ee6248193f282862c519ddb05 [0,2,0,0,0,0|1,0,0]=3 1812 B11R0.236 C=CC(C)O[C@H](CCC)C(=O)O 3ef03d83ba02354d2532544651bb69c7 [0,2,0,0,0,0|1,0,0]=3 1813 B11R0.236 C=CCC(NC(C)CC)C(=O)O 4176261f27b50fb9b2a81785afbedf04 [0,2,0,0,0,0|0,0,2]=4 1814 B11R0.236 C=CC[C@@H](NC(C)CC)C(=O)O 695d1fad323e80d0174affb38aa38444 [0,2,0,0,0,0|0,0,2]=4 1815 B11R0.236 C=CC[C@H](NC(C)CC)C(=O)O 0bad82efd7e0f1085bbf522ec441a887 [0,2,0,0,0,0|0,0,2]=4 1816 B11R0.236 C=C[C@H](C)OC(CCC)C(=O)C 1770dda2e3edb15214a84c8372630f14 [0,2,0,0,0,0|2,0,0]=4 1817 B11R0.236 C=C[C@H](C)OC(CCC)C(=O)O 54376ab9e50b3bd5cfe04b8572b4f3b1 [0,2,0,0,0,0|1,0,0]=3 1818 B11R0.236 C=C[C@H](C)OC(COC)C(=O)O 2606f35f1516665b2989c4436c542c4d [0,2,0,0,0,0|2,0,0]=4 1819 B11R0.236 C=C[C@H](C)O[C@@H](CCC)C(=O)O 9c6e51bcee85e548f1282bfeefc8d7a8 [0,2,0,0,0,0|1,0,0]=3 1820 B11R0.236 CC(C#N)NC(CCS)C(=O)O 0757b473ba6959aa22cc7f8e41ecae0d [0,2,0,0,0,0|2,0,0]=4 1821 B11R0.236 CC(C#N)N[C@@H](CCS)C(=O)O ef6094f07c62097d87354cded8c170a1 [0,2,0,0,0,0|2,0,0]=4 1822 B11R0.236 CC(C#N)N[C@H](CCS)C(=O)O 9c227273626eb0c6ec95188187cd954a [0,2,0,0,0,0|2,0,0]=4 1823 B11R0.236 CC(C=O)NC(CCO)C(=O)O 244081b9f45e0bda8eac77435d442484 [0,2,0,0,0,0|2,0,0]=4 1824 B11R0.236 CC(C=O)NC(CCS)C(=O)O 0264f6395d7e17a3b2941d220550a1e9 [0,2,0,0,0,0|2,0,0]=4 1825 B11R0.236 CC(C=O)N[C@@H](CCO)C(=O)O 67fef15a99cc3b35b7c37b9c77dea4db [0,2,0,0,0,0|2,0,0]=4 1826 B11R0.236 CC(C=O)N[C@@H](CCS)C(=O)O 00d18875bb665d07df0656c71ba92547 [0,2,0,0,0,0|2,0,0]=4 1827 B11R0.236 CC(C=O)N[C@H](CCO)C(=O)O 68d94e675309d34381831ff5bcf603e6 [0,2,0,0,0,0|2,0,0]=4 1828 B11R0.236 CC(C=O)N[C@H](CCS)C(=O)O e21686011246c8bb6b91b168cf90b1b6 [0,2,0,0,0,0|2,0,0]=4 1829 B11R0.236 CC(CO)NC(CCO)C(=O)O 80150c57dd08926436369ee8bb771a86 [0,2,0,0,0,0|2,0,0]=4 1830 B11R0.236 CC(CO)NC(CCS)C(=O)O 3cdba9909f18d6b0b11cb9b5314fa6c9 [0,2,0,0,0,0|2,0,0]=4 1831 B11R0.236 CC(CO)N[C@@H](CCO)C(=O)O 24316c1a6a0d1da0a349f6c8852d3840 [0,2,0,0,0,0|2,0,0]=4 1832 B11R0.236 CC(CO)N[C@@H](CCS)C(=O)O cd093e2e8129f92c613fe6644e0c7eb4 [0,2,0,0,0,0|2,0,0]=4 1833 B11R0.236 CC(CO)N[C@H](CCO)C(=O)O 5484fac255db03661fad690c41e2deae [0,2,0,0,0,0|2,0,0]=4 1834 B11R0.236 CC(CO)N[C@H](CCS)C(=O)O b4c1cccb1b5f5c676fb894efe605acb5 [0,2,0,0,0,0|2,0,0]=4 1835 B11R0.236 CCC(C)CC(NCF)C(=O)O c1480157021530c5cf389e0c400dbfd2 [0,2,0,0,0,0|2,0,0]=4 1836 B11R0.236 CCC(C)CC(NCO)C(=O)O 50b7f80fb88352f28f10897858b0d12a [0,2,0,0,0,0|2,0,0]=4 1837 B11R0.236 CCC(C)NC(CC#N)C(=O)O e86062a60f4c12b982e6a9e559ca20e9 [0,2,0,0,0,0|1,0,1]=4 1838 B11R0.236 CCC(C)NC(CCO)C(=O)C b308f43e6839cba9a77e660388f898ed [0,2,0,0,0,0|2,0,0]=4 1839 B11R0.236 CCC(C)NC(CCO)C(=O)O aa99141e719f412d479394a43928baed [0,2,0,0,0,0|1,0,0]=3 1840 B11R0.236 CCC(C)NC(CCS)C(=O)O 463fc7928a7705b6ea8ada9e3c194198 [0,2,0,0,0,0|1,0,0]=3 1841 B11R0.236 CCC(C)NC(COC)C(=O)O d3a2331082d3f8e447a0ec6bd6e531ea [0,2,0,0,0,0|1,0,0]=3 1842 B11R0.236 CCC(C)NC(CSC)C(=O)O eac92385a000eac1a9f1b0370287621d [0,2,0,0,0,0|1,0,0]=3 1843 B11R0.236 CCC(C)N[C@@H](CC#N)C(=O)O 8a8cae42b485288c20816e6849c2b2f0 [0,2,0,0,0,0|1,0,1]=4 1844 B11R0.236 CCC(C)N[C@@H](CCO)C(=O)O 49b8336979842f2a4b02b4136f85ffd2 [0,2,0,0,0,0|1,0,0]=3 1845 B11R0.236 CCC(C)N[C@@H](CCS)C(=O)O e16ae8fd962ac3dcdccbf8ee97996e10 [0,2,0,0,0,0|1,0,0]=3 1846 B11R0.236 CCC(C)N[C@@H](COC)C(=O)O be20d2e5a319d92b3a117779ab9cfdaa [0,2,0,0,0,0|1,0,0]=3 1847 B11R0.236 CCC(C)N[C@@H](CSC)C(=O)O 586e69eef97e78128eb5238f957eeba1 [0,2,0,0,0,0|1,0,0]=3 1848 B11R0.236 CCC(C)N[C@H](CCO)C(=O)O 464d1a3ac3bba63de6e2f43f06d30582 [0,2,0,0,0,0|1,0,0]=3 1849 B11R0.236 CCC(C)N[C@H](CCS)C(=O)O cafd50fc80d8b3ec61d660766fe9628e [0,2,0,0,0,0|1,0,0]=3 1850 B11R0.236 CCC(C)N[C@H](COC)C(=O)O 9d35b0934db77f835a7f6fc7e4e8c56a [0,2,0,0,0,0|1,0,0]=3 1851 B11R0.236 CCC(C)N[C@H](CSC)C(=O)O bf7b0f0a142db01943b89b943b228c37 [0,2,0,0,0,0|1,0,0]=3 1852 B11R0.236 CCC(C)OC(COC)C(=O)O 6c397755dc149bf22b7efc76ce5a021b [0,2,0,0,0,0|1,0,0]=3 1853 B11R0.236 CCC(C)OC(CSC)C(=O)O 8800fab27247d82dcc9c32fb5ad78739 [0,2,0,0,0,0|1,0,0]=3 1854 B11R0.236 CCCC(NC(C)C#N)C(=O)C a1b638bd6be52fd3586b4fa9b7bd3a9a [0,2,0,0,0,0|2,0,0]=4 1855 B11R0.236 CCCC(NC(C)C=O)C(=O)O 6e57bc1035cf29b95eb3687ff5288979 [0,2,0,0,0,0|1,0,0]=3 1856 B11R0.236 CCCC(NC(C)CC)C(=O)C 4dbd5351bab3cf4764981c00c90cc699 [0,2,0,0,0,0|1,0,0]=3 1857 B11R0.236 CCCC(NC(C)CC)C(=O)O 54d6e65f88b376667d1533188aeeea64 [0,2,0,0,0,0|0,0,0]=2 1858 B11R0.236 CCCC(NC(C)CO)C(=O)C 42d0b80a39e4a936426f2d67373e7c44 [0,2,0,0,0,0|2,0,0]=4 1859 B11R0.236 CCCC(NC(C)CO)C(=O)O c9bcccddb339a2f80904c79b25e9f76e [0,2,0,0,0,0|1,0,0]=3 1860 B11R0.236 CCCC(NC(F)C#N)C(=O)O b6fe798e9bef8f16db82b7095ba025b4 [0,2,0,0,0,0|1,0,1]=4 1861 B11R0.236 CCCC(N[C@@H](C)CC)C(=O)C 834aa88406778a8abd6bce58af28c1cc [0,2,0,0,0,0|1,0,0]=3 1862 B11R0.236 CCCC(N[C@@H](C)CO)C(=O)C adf200e0d1171402c9144216e295a62c [0,2,0,0,0,0|2,0,0]=4 1863 B11R0.236 CCCC(N[C@@H](C)CO)C(=O)O 16993c1bcc9b9cfd74f00d2cdc85bf08 [0,2,0,0,0,0|1,0,0]=3 1864 B11R0.236 CCCC(N[C@H](C)C=O)C(=O)O 92e3b9b8b6a996faf2f7c30a94e3fd65 [0,2,0,0,0,0|1,0,0]=3 1865 B11R0.236 CCCC(N[C@H](C)CC)C(=O)C 7c8299c648d1fd0ab2e98333e6872e5b [0,2,0,0,0,0|1,0,0]=3 1866 B11R0.236 CCCC(N[C@H](C)CO)C(=O)C ca58b024fb008f6c9827406d8fe68c30 [0,2,0,0,0,0|2,0,0]=4 1867 B11R0.236 CCCC(N[C@H](C)CO)C(=O)O 7809b41b83f873e5e00f9629a9c99d8f [0,2,0,0,0,0|1,0,0]=3 1868 B11R0.236 CCCC(OC(C)C=O)C(=O)C 852387b95cf4ebfa1115fd59dcc934d2 [0,2,0,0,0,0|2,0,0]=4 1869 B11R0.236 CCCC(OC(C)C=O)C(=O)N 7b2b749affffcd21a8502a5cb064f4c9 [0,2,0,0,0,0|2,0,0]=4 1870 B11R0.236 CCCC(OC(C)C=O)C(=O)O a3433eb09ee8ab26054319252a8c0b1c [0,2,0,0,0,0|1,0,0]=3 1871 B11R0.236 CCCC(OC(C)CC)C(=O)C 0f190416dbb3dbedfc7aaf748c3265b6 [0,2,0,0,0,0|1,0,0]=3 1872 B11R0.236 CCCC(OC(C)CC)C(=O)N 6ad1623567c02c6153503151414ea8a4 [0,2,0,0,0,0|1,0,0]=3 1873 B11R0.236 CCCC(OC(C)CC)C(=O)O cb9be8ed9c15d06678572a36b810b4cc [0,2,0,0,0,0|0,0,0]=2 1874 B11R0.236 CCCC(OC(C)CF)C(=O)C 066e96eb9e24957daa6773733098cbbf [0,2,0,0,0,0|2,0,0]=4 1875 B11R0.236 CCCC(OC(C)CS)C(=O)C 475d28010cb8b6c38860b49cf7aa44a6 [0,2,0,0,0,0|2,0,0]=4 1876 B11R0.236 CCCC(O[C@@H](C)CC)C(=O)C 4338506a06d1615a3b80914495d2b0b4 [0,2,0,0,0,0|1,0,0]=3 1877 B11R0.236 CCCC(O[C@@H](C)CC)C(=O)O 9681f52a9845fb99aa0c3c734c493e3f [0,2,0,0,0,0|0,0,0]=2 1878 B11R0.236 CCCC(O[C@H](C)C=O)C(=O)N 5d18a762e36953009eb234550bf656a9 [0,2,0,0,0,0|2,0,0]=4 1879 B11R0.236 CCCC(O[C@H](C)C=O)C(=O)O 75824f18043f33f9c467eb1b304c1a22 [0,2,0,0,0,0|1,0,0]=3 1880 B11R0.236 CCCC(O[C@H](C)CC)C(=O)C 08ef6382ae65f3bfad6ee3cd74288ab1 [0,2,0,0,0,0|1,0,0]=3 1881 B11R0.236 CCCC(O[C@H](C)CC)C(=O)O a87f07ec7d7154421e9e4fde20d83106 [0,2,0,0,0,0|0,0,0]=2 1882 B11R0.236 CCCC(O[C@H](C)CS)C(=O)C e612126a9ba40c13f94099c63da33e2b [0,2,0,0,0,0|2,0,0]=4 1883 B11R0.236 CCCN(CC(O)CO)C(=O)C ded2de8859586906b1cca32dcf6ff4b6 [0,2,0,0,0,0|2,0,0]=4 1884 B11R0.236 CCC[C@@H](NC(C)C=O)C(=O)O 7bd2c7691674645e618d1a1e70adb510 [0,2,0,0,0,0|1,0,0]=3 1885 B11R0.236 CCC[C@@H](NC(C)CC)C(=O)O 6979f146d55dd8f700686e8f50de50e6 [0,2,0,0,0,0|0,0,0]=2 1886 B11R0.236 CCC[C@@H](NC(C)CO)C(=O)O f8092c82d8d2e4560d02c58a8fdf4ab5 [0,2,0,0,0,0|1,0,0]=3 1887 B11R0.236 CCC[C@@H](NC(F)C#N)C(=O)O 35afda5cd9d3b41b8a9971cf0694f64e [0,2,0,0,0,0|1,0,1]=4 1888 B11R0.236 CCC[C@@H](N[C@@H](C)CO)C(=O)O 3f1f12e7c8c4e36e54dabbeb8b9b049c [0,2,0,0,0,0|1,0,0]=3 1889 B11R0.236 CCC[C@@H](N[C@H](C)C=O)C(=O)O 21d15376d21a2b467a3d14b57c03388b [0,2,0,0,0,0|1,0,0]=3 1890 B11R0.236 CCC[C@@H](N[C@H](C)CO)C(=O)O 347b03ce08ef0da1d61cb7f50146f378 [0,2,0,0,0,0|1,0,0]=3 1891 B11R0.236 CCC[C@@H](OC(C)C=O)C(=O)O 8e02986f162c83df27df59a08c44dcf0 [0,2,0,0,0,0|1,0,0]=3 1892 B11R0.236 CCC[C@@H](OC(C)CC)C(=O)O 06f8dccd63fca81e1c92107c3f879927 [0,2,0,0,0,0|0,0,0]=2 1893 B11R0.236 CCC[C@@H](O[C@H](C)C=O)C(=O)O 91ea9b1842d300abb9bc288df82f573d [0,2,0,0,0,0|1,0,0]=3 1894 B11R0.236 CCC[C@H](NC(C)C=O)C(=O)O 97dc2118eb9073ccfbaaacf5ee654813 [0,2,0,0,0,0|1,0,0]=3 1895 B11R0.236 CCC[C@H](NC(C)CC)C(=O)O a1355ef417ddfcc5a3a2fd252aff1b13 [0,2,0,0,0,0|0,0,0]=2 1896 B11R0.236 CCC[C@H](NC(C)CO)C(=O)O 44f5d649d7e7d332cb4cfb524da85cfc [0,2,0,0,0,0|1,0,0]=3 1897 B11R0.236 CCC[C@H](NC(F)C#N)C(=O)O 3def5852c74cf3b6c9781d59b902c0f2 [0,2,0,0,0,0|1,0,1]=4 1898 B11R0.236 CCC[C@H](N[C@@H](C)CO)C(=O)O c9954f5be594acebff3608d7428ec66f [0,2,0,0,0,0|1,0,0]=3 1899 B11R0.236 CCC[C@H](N[C@H](C)C=O)C(=O)O 34478b890f443b21efeca87527197d98 [0,2,0,0,0,0|1,0,0]=3 1900 B11R0.236 CCC[C@H](N[C@H](C)CO)C(=O)O 63b80b2609aaefacbea2e1093c341c07 [0,2,0,0,0,0|1,0,0]=3 1901 B11R0.236 CCC[C@H](OC(C)C=O)C(=O)O 704d467cc9add9cb13fc3206a2e66585 [0,2,0,0,0,0|1,0,0]=3 1902 B11R0.236 CCC[C@H](OC(C)CC)C(=O)O af428ba912c0fc366ae99ab4c89e30e9 [0,2,0,0,0,0|0,0,0]=2 1903 B11R0.236 CCC[C@H](O[C@@H](C)CC)C(=O)O b52571118837bf331feb2a368c4676cb [0,2,0,0,0,0|0,0,0]=2 1904 B11R0.236 CCC[C@H](O[C@H](C)C=O)C(=O)O 16178d23346075924e4e3e30bf815e21 [0,2,0,0,0,0|1,0,0]=3 1905 B11R0.236 CCC[C@H](O[C@H](C)CC)C(=O)O 969341f60882ce37fbfc3da0d48ab787 [0,2,0,0,0,0|0,0,0]=2 1906 B11R0.236 CCNC(CC(=O)NC)C(=O)O e6568309c9c1b04358d1abaf9c3aec69 [0,2,0,0,0,0|1,0,1]=4 1907 B11R0.236 CCNC(CC(=O)OC)C(=O)O ce8809fa59a4bc573b75645235a9055b [0,2,0,0,0,0|1,0,1]=4 1908 B11R0.236 CCNC(CC(C)CC)C(=O)O 7e033da7b838b4f8a3220fe02c67187c [0,2,0,0,0,0|1,0,0]=3 1909 B11R0.236 CCN[C@@H](CC(=O)NC)C(=O)O c8c8b1c26bd64b89c26e5f15618ce311 [0,2,0,0,0,0|1,0,1]=4 1910 B11R0.236 CCN[C@@H](CC(=O)OC)C(=O)O b4541f6b233d6d29a8d7504486a688c8 [0,2,0,0,0,0|1,0,1]=4 1911 B11R0.236 CCN[C@H](CC(=O)NC)C(=O)O e65ce0ced7a4cb90b7f9f41cf5315db1 [0,2,0,0,0,0|1,0,1]=4 1912 B11R0.236 CCN[C@H](CC(=O)OC)C(=O)O e982c59281620e7555f1612876b83003 [0,2,0,0,0,0|1,0,1]=4 1913 B11R0.236 CCO[C@H](CC(=O)OC)C(=O)O e75f6b942a02693a672bcd1b2bb64b3d [0,2,0,0,0,0|1,0,1]=4 1914 B11R0.236 CC[C@@H](C)NC(CCO)C(=O)C 67c2fe19c6068c2e0b371b11da64e255 [0,2,0,0,0,0|2,0,0]=4 1915 B11R0.236 CC[C@@H](C)NC(COC)C(=O)O 5b2c7cbb372eca1575e142b018788be6 [0,2,0,0,0,0|1,0,0]=3 1916 B11R0.236 CC[C@@H](C)OC(COC)C(=O)O e040953f1b209e88829633667239b83d [0,2,0,0,0,0|1,0,0]=3 1917 B11R0.236 CC[C@H](C)NC(CCO)C(=O)C 84ad3245fc1a9f286a6bd4ffa3867340 [0,2,0,0,0,0|2,0,0]=4 1918 B11R0.236 CC[C@H](C)NC(COC)C(=O)O 3d963be25c492fefa506a4ba5a616b71 [0,2,0,0,0,0|1,0,0]=3 1919 B11R0.236 CC[C@H](C)OC(COC)C(=O)O a88ec5a5f674a31b2815d14dd8b1db2c [0,2,0,0,0,0|1,0,0]=3 1920 B11R0.236 COCC(NC(C)C#N)C(=O)O 33334a3fd13aaf4c387ab21aa86367ba [0,2,0,0,0,0|2,0,0]=4 1921 B11R0.236 COCC(NC(C)C=O)C(=O)O e9c6561f7e4330c27bd738b7acfb247a [0,2,0,0,0,0|2,0,0]=4 1922 B11R0.236 COCC(NC(C)CO)C(=O)O 6d2bb6ddb7a5d01e59edd54a8c8c39da [0,2,0,0,0,0|2,0,0]=4 1923 B11R0.236 COCC(N[C@@H](C)CO)C(=O)O b308d7cb8dc1652d722f1e4fa9f76aef [0,2,0,0,0,0|2,0,0]=4 1924 B11R0.236 COCC(N[C@H](C)C=O)C(=O)O 7981998eb02bdd89bfbb5ea7f034f353 [0,2,0,0,0,0|2,0,0]=4 1925 B11R0.236 COCC(N[C@H](C)CO)C(=O)O eedcf055ce5517427970302c999f7ce5 [0,2,0,0,0,0|2,0,0]=4 1926 B11R0.236 COCC(OC(C)C=O)C(=O)O d40a33becd6ac30b46b173f07eec6046 [0,2,0,0,0,0|2,0,0]=4 1927 B11R0.236 COCC(OC(C)CF)C(=O)O 0240e8e2f12af3e51bef2da0d0ff3059 [0,2,0,0,0,0|2,0,0]=4 1928 B11R0.236 COCC(OC(C)CS)C(=O)O c918131483d12487ddc3830b5a4eccd6 [0,2,0,0,0,0|2,0,0]=4 1929 B11R0.236 COCC(O[C@H](C)CS)C(=O)O 0323edb72a402fd3753d119979382515 [0,2,0,0,0,0|2,0,0]=4 1930 B11R0.236 COC[C@@H](NC(C)C=O)C(=O)O bf024d7ce6b4d8bff9e1ada2d98f7f3e [0,2,0,0,0,0|2,0,0]=4 1931 B11R0.236 COC[C@@H](NC(C)CO)C(=O)O edcff0df44f8e7d476c6510a34dbb510 [0,2,0,0,0,0|2,0,0]=4 1932 B11R0.236 COC[C@@H](N[C@@H](C)CO)C(=O)O 18b7864c876a212ee9079687b273db1e [0,2,0,0,0,0|2,0,0]=4 1933 B11R0.236 COC[C@@H](N[C@H](C)C=O)C(=O)O 1d947c329acf74c2c5637e695040350b [0,2,0,0,0,0|2,0,0]=4 1934 B11R0.236 COC[C@@H](N[C@H](C)CO)C(=O)O ad422c89933e7feceee58ce90ad4ba44 [0,2,0,0,0,0|2,0,0]=4 1935 B11R0.236 COC[C@H](NC(C)C=O)C(=O)O 0690676b6d500d25885ec034dd898fc2 [0,2,0,0,0,0|2,0,0]=4 1936 B11R0.236 COC[C@H](NC(C)CO)C(=O)O 327d5ae855007fa496a6f6e7bf2a3b78 [0,2,0,0,0,0|2,0,0]=4 1937 B11R0.236 COC[C@H](N[C@@H](C)CO)C(=O)O 403b0aee580c258cf6e965a4c34b7f0c [0,2,0,0,0,0|2,0,0]=4 1938 B11R0.236 COC[C@H](N[C@H](C)C=O)C(=O)O 4b2e941529bb660dc8c00727e9803446 [0,2,0,0,0,0|2,0,0]=4 1939 B11R0.236 COC[C@H](N[C@H](C)CO)C(=O)O 4905563f7d845b768b1a7d7c70b6ced4 [0,2,0,0,0,0|2,0,0]=4 1940 B11R0.236 CSCC(NC(C)C=O)C(=O)O 1349a97370966fe5ede640841407db76 [0,2,0,0,0,0|2,0,0]=4 1941 B11R0.236 CSCC(NC(C)CO)C(=O)O ef3c791a0412d560be99f38766678a16 [0,2,0,0,0,0|2,0,0]=4 1942 B11R0.236 CSCC(N[C@@H](C)CO)C(=O)O 10a9a15f5515e96f21fb6f36816a5c15 [0,2,0,0,0,0|2,0,0]=4 1943 B11R0.236 CSCC(N[C@H](C)C=O)C(=O)O b333e51eab742cf46b5a147870ef848f [0,2,0,0,0,0|2,0,0]=4 1944 B11R0.236 CSCC(N[C@H](C)CO)C(=O)O 06b552af7d2eb92fe1e4d681af8224b4 [0,2,0,0,0,0|2,0,0]=4 1945 B11R0.236 CSCC(OC(C)C=O)C(=O)O 2a1167fd2552a6b0166b4ee3ed026458 [0,2,0,0,0,0|2,0,0]=4 1946 B11R0.236 CSCC(O[C@H](C)C=O)C(=O)O c88d24f04ceb631cf81d38f06c6b61f2 [0,2,0,0,0,0|2,0,0]=4 1947 B11R0.236 CSC[C@@H](NC(C)C=O)C(=O)O e76bec479bfe132bb4f02bc31e364948 [0,2,0,0,0,0|2,0,0]=4 1948 B11R0.236 CSC[C@@H](NC(C)CO)C(=O)O 6897926238c9de2831fa3c84b8e36b36 [0,2,0,0,0,0|2,0,0]=4 1949 B11R0.236 CSC[C@@H](N[C@@H](C)CO)C(=O)O 5c6e488404e2dd516779325727ec0694 [0,2,0,0,0,0|2,0,0]=4 1950 B11R0.236 CSC[C@@H](N[C@H](C)C=O)C(=O)O 66f44b10a54e92469cbf64481cfb7212 [0,2,0,0,0,0|2,0,0]=4 1951 B11R0.236 CSC[C@@H](N[C@H](C)CO)C(=O)O f4fd67baab4558c8bc5e20e7113a973f [0,2,0,0,0,0|2,0,0]=4 1952 B11R0.236 CSC[C@H](NC(C)C=O)C(=O)O 57721b942a043426d56acbd9c88e69d9 [0,2,0,0,0,0|2,0,0]=4 1953 B11R0.236 CSC[C@H](NC(C)CO)C(=O)O c05d4eec03787af1ffd8895ba270d268 [0,2,0,0,0,0|2,0,0]=4 1954 B11R0.236 CSC[C@H](N[C@@H](C)CO)C(=O)O 39cf4f00a8e8386c901f06f72ddb0b93 [0,2,0,0,0,0|2,0,0]=4 1955 B11R0.236 CSC[C@H](N[C@H](C)C=O)C(=O)O 589fa66d021e1bc6426a487243500b6e [0,2,0,0,0,0|2,0,0]=4 1956 B11R0.236 CSC[C@H](N[C@H](C)CO)C(=O)O 5fb22ecfe401ec2b0f3e1c71e364c76d [0,2,0,0,0,0|2,0,0]=4 1957 B11R0.236 C[C@@H](CO)NC(CCO)C(=O)O e9f16e44cef58887a364911b1f93e2cc [0,2,0,0,0,0|2,0,0]=4 1958 B11R0.236 C[C@@H](CO)NC(CCS)C(=O)O 967c93a4e633704e9b6148242e740d34 [0,2,0,0,0,0|2,0,0]=4 1959 B11R0.236 C[C@@H](CO)N[C@@H](CCO)C(=O)O 8e975c0be320cb46c5d4c66d1615efa1 [0,2,0,0,0,0|2,0,0]=4 1960 B11R0.236 C[C@@H](CO)N[C@@H](CCS)C(=O)O 49a1a626b9f26863b0d91b25339958cc [0,2,0,0,0,0|2,0,0]=4 1961 B11R0.236 C[C@@H](CO)N[C@H](CCO)C(=O)O e4ba73b1907dd9dccbe36bce05f65d4e [0,2,0,0,0,0|2,0,0]=4 1962 B11R0.236 C[C@@H](CO)N[C@H](CCS)C(=O)O efe4bd24951e996f42298699ef4f5906 [0,2,0,0,0,0|2,0,0]=4 1963 B11R0.236 C[C@H](C=O)NC(CCO)C(=O)O 2ccba2601d43c50670ae2454298b3f54 [0,2,0,0,0,0|2,0,0]=4 1964 B11R0.236 C[C@H](C=O)NC(CCS)C(=O)O 3b1109bffbe5da2d82291a8aac0c50f2 [0,2,0,0,0,0|2,0,0]=4 1965 B11R0.236 C[C@H](C=O)N[C@@H](CCO)C(=O)O 82f0be4c2e35f80867bf26fb3f35affb [0,2,0,0,0,0|2,0,0]=4 1966 B11R0.236 C[C@H](C=O)N[C@@H](CCS)C(=O)O a866395766278dee0d0a47770cd2df12 [0,2,0,0,0,0|2,0,0]=4 1967 B11R0.236 C[C@H](C=O)N[C@H](CCO)C(=O)O 69fed59dd998c724a6262e171c6b4132 [0,2,0,0,0,0|2,0,0]=4 1968 B11R0.236 C[C@H](C=O)N[C@H](CCS)C(=O)O 8d6a6eaf9607e4115bd8618a22ff1823 [0,2,0,0,0,0|2,0,0]=4 1969 B11R0.236 C[C@H](CO)NC(CCO)C(=O)O 4d70171ba10ab81f4f557126ddebc4b2 [0,2,0,0,0,0|2,0,0]=4 1970 B11R0.236 C[C@H](CO)NC(CCS)C(=O)O 0c4fec481b0b5af1e4415d48eb404e9d [0,2,0,0,0,0|2,0,0]=4 1971 B11R0.236 C[C@H](CO)N[C@@H](CCO)C(=O)O bf618a9fc351fbea7a7a0337e7d49c43 [0,2,0,0,0,0|2,0,0]=4 1972 B11R0.236 C[C@H](CO)N[C@@H](CCS)C(=O)O 8bac078d6ca2201ea20d10e7f9a9cc74 [0,2,0,0,0,0|2,0,0]=4 1973 B11R0.236 C[C@H](CO)N[C@H](CCO)C(=O)O 9fb5c72eb4968af4001a52b6aa7ba4c0 [0,2,0,0,0,0|2,0,0]=4 1974 B11R0.236 C[C@H](CO)N[C@H](CCS)C(=O)O e2c78027e97d8516aac74fcbf24b3c7d [0,2,0,0,0,0|2,0,0]=4 1975 B11R0.41 C#CC(=O)N(CCC)C(C)CC 315244340f0b321928c63d609e726a6d [0,2,0,0,0,0|2,0,0]=4 1976 B11R0.41 C=CC(=O)N(CCC)C(C)CC 2a973bced43ae3cf9d42912dd65ef62b [0,2,0,0,0,0|2,0,0]=4 1977 B11R0.41 CCC(C)C(NCF)C(=O)OC 8cbaddb681cd37efc0eeb9980c604338 [0,2,0,0,0,0|2,0,0]=4 1978 B11R0.41 CCC(C)C(NCO)C(=O)OC 4fbfe1914a78f293eabcd9a66dc3acd3 [0,2,0,0,0,0|2,0,0]=4 1979 B11R0.41 CCC(C)C(OCF)C(=O)OC 5bb72a473c1265a8043222394c4fff0f [0,2,0,0,0,0|2,0,0]=4 1980 B11R0.41 CCCC(C(=O)OC)N(C)CC 2b6bbf37794230db0394c5292481307d [0,2,0,0,0,0|1,0,0]=3 1981 B11R0.41 CCCN(C(=O)C=O)C(C)CC 88584206cf9ea82e5739a4c73246bb0f [0,2,0,0,0,0|1,0,1]=4 1982 B11R0.41 CCCN(C(=O)CC)C(C)CC 675137bf1c6a559f6841e97bbdc288b0 [0,2,0,0,0,0|2,0,0]=4 1983 B11R0.41 CCCN(C(=O)CF)C(C)CC 1e9eb5aeec86bdc6a74a8bfb2181c4e1 [0,2,0,0,0,0|2,0,0]=4 1984 B11R0.41 CCCN(C(=O)CO)C(C)CC bd18aad6bf5fa436799887ab68dcab0a [0,2,0,0,0,0|1,0,0]=3 1985 B11R0.41 CCCN(C(=O)CO)C(C)CO 703a5c68ae0fe116fbc1c3775bc483bb [0,2,0,0,0,0|2,0,0]=4 1986 B11R0.41 CCCN(C(=O)CO)[C@@H](C)CO 058399c5c72cdd447a58898c006d15d8 [0,2,0,0,0,0|2,0,0]=4 1987 B11R0.41 CCCN(C(=O)CS)C(C)CC 2b92292586e8ff4dd04620538dbb791e [0,2,0,0,0,0|1,1,0]=4 1988 B11R0.41 CCN(C)C(COC)C(=O)OC 6eba6477f8396987e88e479390c906db [0,2,0,0,0,0|2,0,0]=4 1989 B11R0.41 CCNC(C(=O)OC)C(C)CC ad78e86898c360764a122f20874246be [0,2,0,0,0,0|1,0,0]=3 1990 B11R0.41 CCN[C@H](C(=O)OC)[C@@H](C)CC df87055f1449dd0368cc53d6d245bff1 [0,2,0,0,0,0|1,0,0]=3 1991 B11R0.41 CCOC(C(=O)OC)C(C)CC 02fea5b05e7e4e47814c8495e7b81a8e [0,2,0,0,0,0|1,0,0]=3 1992 B11R0.41 CC[C@H](C)[C@H](NCF)C(=O)OC 84bd0ed4a4db73c9851fd4d4e04e3e82 [0,2,0,0,0,0|2,0,0]=4 1993 B11R0.41 CC[C@H](C)[C@H](NCO)C(=O)OC 48f11c5ac13944b912dc8eeefee5eb63 [0,2,0,0,0,0|2,0,0]=4 1994 B11R0.57 C#CCN(C)C(CCC)C(=O)O 8f0070425abe4a38383f8a0f5a76f4bf [0,2,0,0,0,0|0,0,2]=4 1995 B11R0.57 C#CCN(C)[C@@H](CCC)C(=O)O 759d33220070bee0d71866dab552718b [0,2,0,0,0,0|0,0,2]=4 1996 B11R0.57 C=CCN(C)C(CCC)C(=O)O 7fc39ff0ffee38bfcbc65181c88d163a [0,2,0,0,0,0|0,0,2]=4 1997 B11R0.57 C=CCN(C)[C@@H](CCC)C(=O)O 7420ed217d640dd35985d9070ceeb744 [0,2,0,0,0,0|0,0,2]=4 1998 B11R0.57 CCCC(C(=O)C)N(C)CCC d4368aaf7d113ac1760620cdb5a3efbb [0,2,0,0,0,0|1,0,0]=3 1999 B11R0.57 CCCC(C(=O)C)N(C)CCF 5225a766375df7c225a01a7bf2f84be7 [0,2,0,0,0,0|2,0,0]=4 2000 B11R0.57 CCCC(C(=O)C)N(C)CCO 375fe2ba48d50404cd3a20f049810a33 [0,2,0,0,0,0|2,0,0]=4 2001 B11R0.57 CCCC(C(=O)O)N(C)CC#N ba1da8b0c6b44688fbb149b1adc4dc9a [0,2,0,0,0,0|1,0,1]=4 2002 B11R0.57 CCCC(C(=O)O)N(C)CC=O 423f868640c11c7a89bead32b43ef6f7 [0,2,0,0,0,0|1,0,1]=4 2003 B11R0.57 CCCC(C(=O)O)N(C)CCC 58c5782d33bca067684bb8ce162b6402 [0,2,0,0,0,0|0,0,0]=2 2004 B11R0.57 CCCC(C(=O)O)N(C)CCF 8de736c61bdc1d07c5328edd56488458 [0,2,0,0,0,0|1,0,0]=3 2005 B11R0.57 CCCC(C(=O)O)N(C)CCO bff820492eb3eb1a9b896c92da3a58cf [0,2,0,0,0,0|1,0,0]=3 2006 B11R0.57 CCCC(C(=O)O)N(C)CCS 8b1905b7833929a63ae9e6802a659f4e [0,2,0,0,0,0|1,0,0]=3 2007 B11R0.57 CCCC(C(=O)O)N(C)COC 633ddf3598b7023b57563cd4fd77e104 [0,2,0,0,0,0|1,0,0]=3 2008 B11R0.57 CCCC(C(=O)O)N(C)CSC a8f154885dbd6d63ca9febadf64f85ff [0,2,0,0,0,0|1,0,0]=3 2009 B11R0.57 CCCC(C)C(NCC)C(=O)O 629b6b4481ee5fbc5cde0cbc54d6955a [0,2,0,0,0,0|1,0,0]=3 2010 B11R0.57 CCCC(C)C(NCF)C(=O)O 7b5fd7d3cf1de8561d3b598ff9c9f177 [0,2,0,0,0,0|2,0,0]=4 2011 B11R0.57 CCCC(C)C(NCO)C(=O)O 97a576d9f1a47cc495c2913cbddb80eb [0,2,0,0,0,0|2,0,0]=4 2012 B11R0.57 CCCN(C)C(CCO)C(=O)C 91f403e29b109c66b360fe94930e62df [0,2,0,0,0,0|2,0,0]=4 2013 B11R0.57 CCCN(C)C(COC)C(=O)O 4b55f894766f9af954a267620471b98f [0,2,0,0,0,0|1,0,0]=3 2014 B11R0.57 CCCN(C)C(CSC)C(=O)O e7fd4025bc306b042f5bb29e7af54001 [0,2,0,0,0,0|1,0,0]=3 2015 B11R0.57 CCC[C@@H](C(=O)O)N(C)CC#N 17c93286a6ccf4136258aa3e9eb8e0ca [0,2,0,0,0,0|1,0,1]=4 2016 B11R0.57 CCC[C@@H](C(=O)O)N(C)CCC d3139168a2f813a2cd47453aa6c83435 [0,2,0,0,0,0|0,0,0]=2 2017 B11R0.57 CCC[C@@H](C(=O)O)N(C)CCF dcb2a12e2053dc5e2ed84d923e4732c0 [0,2,0,0,0,0|1,0,0]=3 2018 B11R0.57 COCC(C(=O)O)N(C)CCF 90fcfae1012a370577e8c0208c378455 [0,2,0,0,0,0|2,0,0]=4 2019 B11R0.57 COCC(C(=O)O)N(C)CCO edc4bfb2fb7f3a202511a85ef6bc3494 [0,2,0,0,0,0|2,0,0]=4 2020 B11R0.57 COCN(C)C(CSC)C(=O)O b1e3579e42d97c3fc4cbdc4c40e9cdb7 [0,2,0,0,0,0|2,0,0]=4 2021 B11R0.57 CSCC(C(=O)O)N(C)CCF 2b38b0b3c0df533363515205bf7f3ca9 [0,2,0,0,0,0|2,0,0]=4 2022 B11R0.57 CSCC(C(=O)O)N(C)CCO 3aeb9a3b257b453943cadd341dcd56d5 [0,2,0,0,0,0|2,0,0]=4 2023 B11R0.57 CSCC(C(=O)O)N(C)CCS e0124acc01e0ce7d7fd1a76798b4f8e7 [0,2,0,0,0,0|2,0,0]=4 2024 B11R0.57 CSCC(C(=O)O)N(C)CSC 824b8c1f819b35d27f19d95ba2c088cb [0,2,0,0,0,0|2,0,0]=4 2025 B11R0.121 CCC(C)C(C(=O)O)N(C)CC 058e8a94c75bd94e3efb8eacef327cc5 [0,2,0,0,0,0|1,0,0]=3 2026 B11R0.121 CCC(C)C(C(=O)O)N(C)CF 2b7ad086265bda08ff8ffe5227498440 [0,2,0,0,0,0|2,0,0]=4 2027 B11R0.121 CCC(C)C(C(=O)O)N(C)CO 990a7c64da57ea0f089d00827fd956ed [0,2,0,0,0,0|2,0,0]=4 2028 B11R0.121 CCC(C)N(C(=O)C)C(C)CC 358bdced78a4b93392c3635cc05973f6 [0,2,0,0,0,0|2,0,0]=4 2029 B11R0.121 CC[C@H](C)[C@@H](C(=O)O)N(C)CC 757abe7b8592c6673b6e5066eb9bdcd2 [0,2,0,0,0,0|1,0,0]=3 2030 B11R0.121 CC[C@H](C)[C@@H](C(=O)O)N(C)CF 3f76b04021aaa6499fbf7b77f47da980 [0,2,0,0,0,0|2,0,0]=4 2031 B11R0.121 CC[C@H](C)[C@@H](C(=O)O)N(C)CO 8b854e6f95bf4e1439586b996d958d1d [0,2,0,0,0,0|2,0,0]=4 2032 B11R0.138 CCC(CC)C(NCF)C(=O)O 4b7b43bd45beef82f22cc1ca0d1be6da [0,2,0,0,0,0|2,0,0]=4 2033 B11R0.138 CCC(CC)C(NCO)C(=O)O b88606d4b5dbeab723a18bd6d32df08f [0,2,0,0,0,0|2,0,0]=4 2034 B11R0.138 CCC(CC)[C@@H](NCF)C(=O)O 1cd10c04efdce14ba5190ee2c8e337e5 [0,2,0,0,0,0|2,0,0]=4 2035 B11R0.138 CCC(CC)[C@@H](NCO)C(=O)O 8e996fb4e2873d63d981fb66dd4baf7e [0,2,0,0,0,0|2,0,0]=4 2036 B11R0.138 CCC(CC)[C@H](NCF)C(=O)O 8753ec82d3518c20f3187bb49542b61f [0,2,0,0,0,0|2,0,0]=4 2037 B11R0.138 CCC(CC)[C@H](NCO)C(=O)O a5bb4721517447015786a9ae26e877fb [0,2,0,0,0,0|2,0,0]=4 2038 B11R0.138 CCNC(C(=O)O)C(CC)CC ecf70ff2fe70dcac3d2a9215adcd33bf [0,2,0,0,0,0|1,0,0]=3 2039 B11R0.138 CCN[C@@H](C(=O)O)C(CC)CC ac9a835c31fec2f682f85f55dfa67dde [0,2,0,0,0,0|1,0,0]=3 2040 B11R0.138 CCN[C@H](C(=O)O)C(CC)CC d9703b7332d987e9cb108838ca0cc32a [0,2,0,0,0,0|1,0,0]=3 2041 B11R0.167 C#CCNC(C(=O)O)C(C)CC a07d2484529fc502851b82b07b3f5c3a [0,2,0,0,0,0|0,0,2]=4 2042 B11R0.167 C#CCNC(C(=O)O)C(O)CC 0f3f870cf3daf7baca0ecdeb4e660178 [0,2,0,0,0,0|0,0,2]=4 2043 B11R0.167 C#CCN[C@@H](C(=O)O)[C@@H](C)CC 273b622d12c3d3bb237a551db8f51c05 [0,2,0,0,0,0|0,0,2]=4 2044 B11R0.167 C#CCN[C@@H](C(=O)O)[C@H](C)CC 5677690165156261df85f11a35a29035 [0,2,0,0,0,0|0,0,2]=4 2045 B11R0.167 C#CCN[C@H](C(=O)O)[C@@H](C)CC efa2e57954042cecfa647b01b3c3240b [0,2,0,0,0,0|0,0,2]=4 2046 B11R0.167 C#CCN[C@H](C(=O)O)[C@H](C)CC 1b68917fd1b17439ed06a6df61e59495 [0,2,0,0,0,0|0,0,2]=4 2047 B11R0.167 C#CCOC(C(=O)O)C(C)CC f3d1c8c798bff5954d906b1335559436 [0,2,0,0,0,0|0,0,2]=4 2048 B11R0.167 C#CCO[C@@H](C(=O)O)[C@@H](C)CC 3b56730125b196f1129d636e4b7917a0 [0,2,0,0,0,0|0,0,2]=4 2049 B11R0.167 C#CCO[C@@H](C(=O)O)[C@H](C)CC bd6e1e30a5a5d3580ebb0c48c4b958bf [0,2,0,0,0,0|0,0,2]=4 2050 B11R0.167 C#CCO[C@H](C(=O)O)[C@@H](C)CC 5311da5edc9d025c906e9dd4952aeb6e [0,2,0,0,0,0|0,0,2]=4 2051 B11R0.167 C#CCO[C@H](C(=O)O)[C@H](C)CC bb1f09a63e6a1fe8eff7c8938bdbaabb [0,2,0,0,0,0|0,0,2]=4 2052 B11R0.167 C#C[C@@H](O)[C@H](NCCC)C(=O)O b9fd655d976dfd9f9f941eed1858d896 [0,2,0,0,0,0|0,0,2]=4 2053 B11R0.167 C=CCNC(C(=O)O)C(C)CC 92b532d7d0ddc17fa3e93871f9db7113 [0,2,0,0,0,0|0,0,2]=4 2054 B11R0.167 C=CCNC(C(=O)O)C(O)CC 037360abf84efd6af4566a86263258c3 [0,2,0,0,0,0|0,0,2]=4 2055 B11R0.167 C=CCN[C@@H](C(=O)O)[C@@H](C)CC f9b8a977a1db6c811d8fcf6b881f3813 [0,2,0,0,0,0|0,0,2]=4 2056 B11R0.167 C=CCN[C@@H](C(=O)O)[C@H](C)CC 26cf6f87f237fc7c00774ae0d7a177d4 [0,2,0,0,0,0|0,0,2]=4 2057 B11R0.167 C=CCN[C@H](C(=O)O)[C@@H](C)CC 05405d7268576c1f0759a4506a5aa74b [0,2,0,0,0,0|0,0,2]=4 2058 B11R0.167 C=CCN[C@H](C(=O)O)[C@H](C)CC e1891314264da325354126005978d31a [0,2,0,0,0,0|0,0,2]=4 2059 B11R0.167 C=CCOC(C(=O)O)C(C)CC 706e30986724ddbd290c3a333648f5fc [0,2,0,0,0,0|0,0,2]=4 2060 B11R0.167 C=CCO[C@@H](C(=O)O)[C@@H](C)CC b1f4c601dc6aad5007ece6857aae5cd1 [0,2,0,0,0,0|0,0,2]=4 2061 B11R0.167 C=CCO[C@@H](C(=O)O)[C@H](C)CC 50e575c15e3deff64aa08ad07db1f765 [0,2,0,0,0,0|0,0,2]=4 2062 B11R0.167 C=CCO[C@H](C(=O)O)[C@@H](C)CC f9f83ba7f63c79a76ca8b60d816629f2 [0,2,0,0,0,0|0,0,2]=4 2063 B11R0.167 CC(CO)[C@H](NCCF)C(=O)O ab20e3fe6e2ddf11d50a99611740e21b [0,2,0,0,0,0|2,0,0]=4 2064 B11R0.167 CC(CO)[C@H](NCCO)C(=O)O 5cc008e7d3439bdf2d607c28533775d9 [0,2,0,0,0,0|2,0,0]=4 2065 B11R0.167 CC(CO)[C@H](NCCS)C(=O)O d97a40dd7e2b0f4c8f1eec4b1bcca336 [0,2,0,0,0,0|2,0,0]=4 2066 B11R0.167 CCC(C)C(NCC#N)C(=O)O 46a856b6bc47fc5bce0d736b6adfaa2b [0,2,0,0,0,0|1,0,1]=4 2067 B11R0.167 CCC(C)C(NCC=O)C(=O)O 977ba107c6e8d44f3584064fabd9e8e0 [0,2,0,0,0,0|1,0,1]=4 2068 B11R0.167 CCC(C)C(NCCF)C(=O)O dad328a9ed6c853c220035a9fb6f69f0 [0,2,0,0,0,0|1,0,0]=3 2069 B11R0.167 CCC(C)C(NCCO)C(=O)O d69d2f1c4063aeebcd8b52980d44cb5e [0,2,0,0,0,0|1,0,0]=3 2070 B11R0.167 CCC(C)C(NCCS)C(=O)O e42f070510db7acc469cc3da44c9ecd1 [0,2,0,0,0,0|1,0,0]=3 2071 B11R0.167 CCC(C)C(NCOC)C(=O)O 29d6fac263d94c0131bab93c0a5947e5 [0,2,0,0,0,0|1,0,0]=3 2072 B11R0.167 CCC(C)C(NCSC)C(=O)O 2fa1f17dd886cc1ab46201215cd0cf64 [0,2,0,0,0,0|1,0,0]=3 2073 B11R0.167 CCC(C)C(OCC#N)C(=O)O deccd8cf1b6703d7f736709b9d5a8e8d [0,2,0,0,0,0|1,0,1]=4 2074 B11R0.167 CCC(C)C(OCC=O)C(=O)O ec59cc9ca364772d63620d54fca5c79f [0,2,0,0,0,0|1,0,1]=4 2075 B11R0.167 CCC(C)C(OCCF)C(=O)O 9b24fad930a8d7bf508528b8926a9dc3 [0,2,0,0,0,0|1,0,0]=3 2076 B11R0.167 CCC(C)C(OCCS)C(=O)O 3785fedc2abc4a10c6e3116e87c109d0 [0,2,0,0,0,0|1,0,0]=3 2077 B11R0.167 CCC(C)C(OCSC)C(=O)O 98e944a68dffe94ea40acfedc2da53a4 [0,2,0,0,0,0|1,0,0]=3 2078 B11R0.167 CCC(C)N(CCOC)C(=O)C 9d3eaa24f9451ecce9e189ecaf4a283d [0,2,0,0,0,0|2,0,0]=4 2079 B11R0.167 CCC(O)C(NCC#N)C(=O)O 9f22692127a6b1a2a1c6d5d4cb51ab0f [0,2,0,0,0,0|1,0,1]=4 2080 B11R0.167 CCC(O)C(NCC=O)C(=O)O 6271f887f786a5390b5dfed75890d910 [0,2,0,0,0,0|1,0,1]=4 2081 B11R0.167 CCC(O)C(NCCF)C(=O)O 96003c4ceef5a58f872ffbf7c6218668 [0,2,0,0,0,0|1,0,0]=3 2082 B11R0.167 CCC(O)C(NCCO)C(=O)O a42b1258252f1cda6a8220dc438fe53c [0,2,0,0,0,0|1,0,0]=3 2083 B11R0.167 CCC(O)C(NCCS)C(=O)O 33581e63ad7f8abd09e19e31b1732911 [0,2,0,0,0,0|1,0,0]=3 2084 B11R0.167 CCC(O)C(NCOC)C(=O)O 2011c92fd6bf0474b95aff78cbc52420 [0,2,0,0,0,0|1,0,0]=3 2085 B11R0.167 CCC(O)C(NCSC)C(=O)O b7b81837a97810c14b7dac3e119a12be [0,2,0,0,0,0|1,0,0]=3 2086 B11R0.167 CCCCC(C(=O)N)N(C)CC 34e325b6554208c6826f2b66398b9c45 [0,2,0,0,0,0|2,0,0]=4 2087 B11R0.167 CCCCC(C(=O)O)N(C)CC bdb99e7b943ca8e8e9f480c6a084c972 [0,2,0,0,0,0|1,0,0]=3 2088 B11R0.167 CCCCC(C(=O)O)N(C)CF c2bc091b8f19ce84fb36050bcc7f56ad [0,2,0,0,0,0|2,0,0]=4 2089 B11R0.167 CCCCC(C(=O)O)N(C)CO e8c66b44eaa1e2de4f16fbfd09eeb27b [0,2,0,0,0,0|2,0,0]=4 2090 B11R0.167 CCCC[C@@H](C(=O)O)N(C)CC 2dd4be213606502ac68d31264123161e [0,2,0,0,0,0|1,0,0]=3 2091 B11R0.167 CCCC[C@@H](C(=O)O)N(C)CF c27b494f657fbf5ee720d3439220e7af [0,2,0,0,0,0|2,0,0]=4 2092 B11R0.167 CCCC[C@@H](C(=O)O)N(C)CO 77dfe1e8f62f1b23d7af04cf25e4bd76 [0,2,0,0,0,0|2,0,0]=4 2093 B11R0.167 CCCNC(C(=O)O)C(C)CC 2f31ce08bbbfb329171d51264fbe84c9 [0,2,0,0,0,0|0,0,0]=2 2094 B11R0.167 CCCNC(C(=O)O)C(C)OC 3e3e6cde31b20e3399dea11c8b883aad [0,2,0,0,0,0|1,0,0]=3 2095 B11R0.167 CCCNC(C(=O)O)C(O)CC 6bed8e7c1ce2b0a1264fb9f60318a4d8 [0,2,0,0,0,0|0,0,0]=2 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CCCC(NCCBr)C(=O)OC a8efca87fa0622bc5bb593f6ed7c5a9e [0,2,0,0,0,0|1,0,0]=3 2209 B11R0.38 CCCC(NCCF)C(=O)NC 61851bd67913ef6ad99690f7c0c84939 [0,2,0,0,0,0|2,0,0]=4 2210 B11R0.38 CCCC(NCCF)C(=O)OC eda490bc613c15cdbb23caa57538f6e9 [0,2,0,0,0,0|1,0,0]=3 2211 B11R0.38 CCCC(NCCI)C(=O)OC c1cdd77fcd832ea3ad185e958b565db0 [0,2,0,0,0,0|1,0,0]=3 2212 B11R0.38 CCCC(NCCO)C(=O)NC 93963212e8df61d0b154ef6ebeca95cf [0,2,0,0,0,0|2,0,0]=4 2213 B11R0.38 CCCC(NCCO)C(=O)OC 1546cc59a43d0745962bd2b811e13f1b [0,2,0,0,0,0|1,0,0]=3 2214 B11R0.38 CCCC(NCCS)C(=O)NC d09a0ce5a8a850f58ddc80b906b50939 [0,2,0,0,0,0|2,0,0]=4 2215 B11R0.38 CCCC(NCCS)C(=O)OC bc34eebb06a40073ede028a9a2d65964 [0,2,0,0,0,0|1,0,0]=3 2216 B11R0.38 CCCC(NCOC)C(=O)NC 10d14141f639d668cfe0bb309bad528b [0,2,0,0,0,0|2,0,0]=4 2217 B11R0.38 CCCC(NCSC)C(=O)NC a4e55ec4795bc6a98fc86a7fc9bd58ad [0,2,0,0,0,0|2,0,0]=4 2218 B11R0.38 CCCC(OCOC)C(=O)OC ed6c74b31b1241352b0bf3353ba5dba5 [0,2,0,0,0,0|1,0,0]=3 2219 B11R0.38 CCCCN(CCC)C(=O)C=O 6593144b1e5cdde7f2ad3f1a8d673e91 [0,2,0,0,0,0|1,0,1]=4 2220 B11R0.38 CCCCN(CCC)C(=O)CC 771986b5e786c62b94f633d1fb573702 [0,2,0,0,0,0|2,0,0]=4 2221 B11R0.38 CCCCN(CCC)C(=O)CF 29b6010c66ff6a7c3edbe9ca43d5c2f8 [0,2,0,0,0,0|2,0,0]=4 2222 B11R0.38 CCCCN(CCC)C(=O)CO 5f901ac129075d090c8e5e62133ffe2f [0,2,0,0,0,0|1,0,0]=3 2223 B11R0.38 CCCCN(CCC)C(=O)CS f27de02d57b082cd129f9b615d39728d [0,2,0,0,0,0|1,1,0]=4 2224 B11R0.38 CCCCN(CCO)C(=O)CO 8aa47abaee8b480600f88359e04a71bc [0,2,0,0,0,0|2,0,0]=4 2225 B11R0.38 CCCCN(CCS)C(=O)CO f0fa70aaef67339d2ff26b57fc6942f8 [0,2,0,0,0,0|2,0,0]=4 2226 B11R0.38 CCCN(CCC#N)C(=O)CO 34b169ce83dccc82add1a6b098b8e315 [0,2,0,0,0,0|1,0,1]=4 2227 B11R0.38 CCCN(CCCO)C(=O)C=O ebddf01c46256ba54ead23ba5b13644f [0,2,0,0,0,0|1,0,1]=4 2228 B11R0.38 CCCN(CCCO)C(=O)CC d558b0d5bc5403fffc3280dc121ea185 [0,2,0,0,0,0|2,0,0]=4 2229 B11R0.38 CCCN(CCCO)C(=O)CF fa11a9c3deefadd8ce2ae69569f5c5c2 [0,2,0,0,0,0|2,0,0]=4 2230 B11R0.38 CCCN(CCCO)C(=O)CO e43abf0d26792780d3e40f5b51b5a84e [0,2,0,0,0,0|1,0,0]=3 2231 B11R0.38 CCCN(CCCO)C(=O)CS 7dfb7cb940e2deaba657782425401a3b [0,2,0,0,0,0|1,1,0]=4 2232 B11R0.38 CCCN(CCOC)C(=O)C=O 1d9a62aeec6126d2a1f3180040d22b30 [0,2,0,0,0,0|1,0,1]=4 2233 B11R0.38 CCCN(CCOC)C(=O)CC f83444936f0ce75bc81ad6e0f3c7fb0f [0,2,0,0,0,0|2,0,0]=4 2234 B11R0.38 CCCN(CCOC)C(=O)CF 941e17c331bd45af5fb3a5fbdc34dae0 [0,2,0,0,0,0|2,0,0]=4 2235 B11R0.38 CCCN(CCOC)C(=O)CO c83f3f75d431eaf492bda654c74ee68f [0,2,0,0,0,0|1,0,0]=3 2236 B11R0.38 CCCN(CCOC)C(=O)CS 44ff311886d86ca3850198831ea17a70 [0,2,0,0,0,0|1,1,0]=4 2237 B11R0.38 CCCNC(CCC)C(=O)NC 4d0724cd6487806d2e92c0a3ef5bff01 [0,2,0,0,0,0|1,0,0]=3 2238 B11R0.38 CCCNC(CCC)C(=O)OC 8b73b840c1b17e24b5f8bfee453da52d [0,2,0,0,0,0|0,0,0]=2 2239 B11R0.38 CCCNC(COC)C(=O)OC 66be3c0e71a43aae60bbfb75ac019c91 [0,2,0,0,0,0|1,0,0]=3 2240 B11R0.38 CCCN[C@H](CCC)C(=O)OC f9551ffb0e70f852cdee8a0a78172ad2 [0,2,0,0,0,0|0,0,0]=2 2241 B11R0.38 CCCOC(CCC)C(=O)OC 74b60bee5b54c4b32e940b951b10c071 [0,2,0,0,0,0|0,0,0]=2 2242 B11R0.38 CCCOC(COC)C(=O)OC 818234c24b2b87ffc5029144a554635b [0,2,0,0,0,0|1,0,0]=3 2243 B11R0.38 CCCO[C@@H](COC)C(=O)OC 20d1917768edd8da3cf9f603fe6a30ed [0,2,0,0,0,0|1,0,0]=3 2244 B11R0.38 CCC[C@@H](NCC#N)C(=O)OC d0122055d9e8c7a58842b2ba61e94b87 [0,2,0,0,0,0|1,0,1]=4 2245 B11R0.38 CCC[C@@H](NCC=O)C(=O)OC 83c6658321b6f04dbe0a858834d032ca [0,2,0,0,0,0|1,0,1]=4 2246 B11R0.38 CCC[C@@H](NCCF)C(=O)OC 587b22448d3efcb50feef4b3b4cce414 [0,2,0,0,0,0|1,0,0]=3 2247 B11R0.38 CCC[C@@H](NCCO)C(=O)OC 4a7f777c9472c24515e0b71cd84ccb5b [0,2,0,0,0,0|1,0,0]=3 2248 B11R0.38 CCC[C@@H](NCCS)C(=O)OC 016367035c1cfb2a29a0e7f3d2ab8852 [0,2,0,0,0,0|1,0,0]=3 2249 B11R0.38 CCC[C@@H](NCOC)C(=O)OC 2163836abd74ed13a4b1094858f4ac42 [0,2,0,0,0,0|1,0,0]=3 2250 B11R0.38 CCC[C@@H](NCSC)C(=O)OC 3f83919b675c1a6517452d79401f3caa [0,2,0,0,0,0|1,0,0]=3 2251 B11R0.38 CCOC(CCSC)C(=O)OC 24210304cdf8235ecb9e75b2a00d7d54 [0,2,0,0,0,0|1,0,0]=3 2252 B11R0.38 COC(=O)C(CCSC)OCF 30650e9b3d48059324e29b06610240bd [0,2,0,0,0,0|2,0,0]=4 2253 B11R0.38 COCC(NCCBr)C(=O)OC 2409d7dbeac319a33b3dc7aace033aaf [0,2,0,0,0,0|2,0,0]=4 2254 B11R0.38 COCC(NCCF)C(=O)OC 9a5f37e77eecb5d4a23acac963125933 [0,2,0,0,0,0|2,0,0]=4 2255 B11R0.38 COCC(NCCI)C(=O)OC ed5a63100be073381e55b5d109cca1cb [0,2,0,0,0,0|2,0,0]=4 2256 B11R0.38 COCC(NCCO)C(=O)OC efe5f079483bd782ed2563dd56773da3 [0,2,0,0,0,0|2,0,0]=4 2257 B11R0.38 COCC(NCCS)C(=O)OC af4e01e8257ad9e9d83e7d0e4547cad3 [0,2,0,0,0,0|2,0,0]=4 2258 B11R0.38 COCC(OCCF)C(=O)OC 0cb1e260a440919fff52280e3038f4fe [0,2,0,0,0,0|2,0,0]=4 2259 B11R0.38 COCC(OCCS)C(=O)OC 3f4fa86609d3b660c0e99ec66753bc33 [0,2,0,0,0,0|2,0,0]=4 2260 B11R0.38 COCC(OCSC)C(=O)OC 4bfbaa9a2368b492522ff92e4d2a7ee0 [0,2,0,0,0,0|2,0,0]=4 2261 B11R0.38 COCOC(COC)C(=O)OC 2474b8e3bfe19cb37c6b622ce247e797 [0,2,0,0,0,0|2,0,0]=4 2262 B11R0.38 COCO[C@@H](COC)C(=O)OC 2691494cb20275f09fa209f68809ec41 [0,2,0,0,0,0|2,0,0]=4 2263 B11R0.38 COC[C@H](OCCF)C(=O)OC 6531d4d3bfb724609c036d48663f9e20 [0,2,0,0,0,0|2,0,0]=4 2264 B11R0.38 COC[C@H](OCCS)C(=O)OC ba93a37f41c0e7cb4e0977e12ef2ec23 [0,2,0,0,0,0|2,0,0]=4 2265 B11R0.38 COC[C@H](OCSC)C(=O)OC 6d411b96778a74ad89b6e46a6b2ad0f5 [0,2,0,0,0,0|2,0,0]=4 2266 B11R0.38 O=C(CO)N(CCO)CCCO 11589de5114421ca011a37ebdbdb9413 [0,2,0,0,0,0|2,0,0]=4 2267 B11R0.61 C#CCC(=O)N(CCC)CCC 6a82347aec80eee45101ee4393b63f00 [0,2,0,0,0,0|2,0,0]=4 2268 B11R0.61 C/C=C/C(=O)N(CCC)CCC 4ed60e118b0fb57b8d5b216361e005d0 [0,2,0,0,0,0|2,0,0]=4 2269 B11R0.61 C=CCC(=O)N(CCC)CCC ac35d385aeece3b9ca1d26622ffd1c35 [0,2,0,0,0,0|2,0,0]=4 2270 B11R0.61 CC#CC(=O)N(CCC)CCC 27e51f15f7cc5ef3d64bdd4b6a6acb37 [0,2,0,0,0,0|2,0,0]=4 2271 B11R0.61 CCCC(=O)C(CCC)OCC 2a85de6cde1d4b5e057725ae82c5dafd [0,2,0,0,0,0|2,0,0]=4 2272 B11R0.61 CCCC(=O)N(CCC)CCC a3cdde45b2ec84ab28764c8b04e534d3 [0,2,0,0,0,0|2,0,0]=4 2273 B11R0.61 CCCC(CCC)N(C)CCO 08639f048da76aea74d4ad647f89fd59 [0,2,0,0,0,0|2,0,0]=4 2274 B11R0.61 CCCC(OCC)C(=O)OCC 8189a0592193af935bc047cc7995f8e2 [0,2,0,0,0,0|1,0,0]=3 2275 B11R0.61 CCCC(OCF)C(=O)OCC d21752fc34b3876883448043bd6c2e82 [0,2,0,0,0,0|2,0,0]=4 2276 B11R0.61 CCCN(CCC)C(=O)/C=C/Br 5fa18b8b61d0c5ca1a4e5e298ae24473 [0,2,0,0,0,0|2,0,0]=4 2277 B11R0.61 CCCN(CCC)C(=O)/C=C/Cl 87795f1b54ec6970b3e01a07dec8922f [0,2,0,0,0,0|2,0,0]=4 2278 B11R0.61 CCCN(CCC)C(=O)/C=C/I 77c2c392104dd6236935d27f895093a6 [0,2,0,0,0,0|2,0,0]=4 2279 B11R0.61 CCCN(CCC)C(=O)/C=C\Br 709db1da8151973ff85d4c7420f7ee8a [0,2,0,0,0,0|2,0,0]=4 2280 B11R0.61 CCCN(CCC)C(=O)/C=C\Cl 917adec2df59acdd87f751002cbd47ca [0,2,0,0,0,0|2,0,0]=4 2281 B11R0.61 CCCN(CCC)C(=O)/C=C\I 03e1ad37f98d58594ec59f0d30cd6310 [0,2,0,0,0,0|2,0,0]=4 2282 B11R0.61 CCCN(CCC)C(=O)C#CBr 7f7acdff2a74e1eb7618c0483f7b9cc0 [0,2,0,0,0,0|2,0,0]=4 2283 B11R0.61 CCCN(CCC)C(=O)C=CBr 0bee2a12c8c55f82d232e9bdb00b0a91 [0,2,0,0,0,0|2,0,0]=4 2284 B11R0.61 CCCN(CCC)C(=O)C=CI 7795497dbfd6aa500b523dc8ec1c512f [0,2,0,0,0,0|2,0,0]=4 2285 B11R0.61 CCCN(CCC)C(=O)CC#N fdb7219532efb067c2bee6c0b3f381eb [0,2,0,0,0,0|2,0,0]=4 2286 B11R0.61 CCCN(CCC)C(=O)CC=O c0e76f275716cc9b30cc50df8f8eeb94 [0,2,0,0,0,0|1,0,1]=4 2287 B11R0.61 CCCN(CCC)C(=O)CCF 50939ce2fc6e5ae1dee3e92d578e3d47 [0,2,0,0,0,0|2,0,0]=4 2288 B11R0.61 CCCN(CCC)C(=O)CCO c6432325978fb172473d178b3538ebe7 [0,2,0,0,0,0|1,0,0]=3 2289 B11R0.61 CCCN(CCC)C(=O)CCS cf8720867a6779acf1952968c6e03dc6 [0,2,0,0,0,0|1,1,0]=4 2290 B11R0.61 CCCN(CCC)C(=O)COC 53b6ff76ff0e1684e978797ffe614978 [0,2,0,0,0,0|1,0,0]=3 2291 B11R0.61 CCCN(CCC)C(=O)CON bd90f4af5c59382215308b589383aaa7 [0,2,0,0,0,0|1,0,0]=3 2292 B11R0.61 CCCN(CCC)C(=O)CSC e876d9b085642949a3486cc3a4a51a91 [0,2,0,0,0,0|1,1,0]=4 2293 B11R0.61 CCCN(CCC)C(=O)NC#N 05aca16342d17283e9a35ba23b99224d [0,2,0,0,0,0|2,0,0]=4 2294 B11R0.61 CCCN(CCO)C(=O)CCO b6257f8a9dbbe4601efdb7db3c687346 [0,2,0,0,0,0|2,0,0]=4 2295 B11R0.61 CCCN(CCO)C(=O)COC d2b08fdef30a03ccaa6040a2267ba6e3 [0,2,0,0,0,0|2,0,0]=4 2296 B11R0.61 CCCN(CCO)C(=O)CON c6284d13c2afcac76c1ebf9342a13547 [0,2,0,0,0,0|2,0,0]=4 2297 B11R0.351 CCNC(C)(COC)C(=O)OC 7b71f7ee211c62d270ee9ec982a8bce6 [0,2,0,0,0,0|2,0,0]=4 2298 B11R0.36 C#CCCC(NCCC)C(=O)O c23515521b805c4a6643b77db3325de5 [0,2,0,0,0,0|0,0,1]=3 2299 B11R0.36 C#CCCC(NCCF)C(=O)O c0033b64f74abc0bc9fcdb82b5494912 [0,2,0,0,0,0|1,0,1]=4 2300 B11R0.36 C#CCCC(NCCO)C(=O)O c0d879ea20df12d5cbfa79ef307be4be [0,2,0,0,0,0|1,0,1]=4 2301 B11R0.36 C#CCCC(NCCS)C(=O)O 0ecba8e9f4ab959cd84545f4985a5b41 [0,2,0,0,0,0|1,0,1]=4 2302 B11R0.36 C#CCCC(NCOC)C(=O)O b3606ef6657aad8dbc2cb1749ecd5c1d [0,2,0,0,0,0|1,0,1]=4 2303 B11R0.36 C#CCCC(NCSC)C(=O)O f0017b80288f17c9cec338d1a61cf3e9 [0,2,0,0,0,0|1,0,1]=4 2304 B11R0.36 C#CCC[C@@H](NCCC)C(=O)O 9c338b2ac35bad19fabb256e2a397396 [0,2,0,0,0,0|0,0,1]=3 2305 B11R0.36 C#CCC[C@@H](NCCF)C(=O)O a1cb6e4e890a02aa4e990fcf806eda80 [0,2,0,0,0,0|1,0,1]=4 2306 B11R0.36 C#CCC[C@@H](NCCO)C(=O)O 978c90ecfccc14c16bd4074127c851b2 [0,2,0,0,0,0|1,0,1]=4 2307 B11R0.36 C#CCC[C@@H](NCCS)C(=O)O d7075866172d62e33c4decc3f25c018b [0,2,0,0,0,0|1,0,1]=4 2308 B11R0.36 C#CCC[C@@H](NCOC)C(=O)O 972ea14daeebc5f48a8f6fdafc45cf6b [0,2,0,0,0,0|1,0,1]=4 2309 B11R0.36 C#CCC[C@@H](NCSC)C(=O)O 56a70810d37267ba8dc0b76135e4cd91 [0,2,0,0,0,0|1,0,1]=4 2310 B11R0.36 C#CCC[C@H](NCCC)C(=O)O e6e7dcdc660e4ce0b72ff9d73854ba1a [0,2,0,0,0,0|0,0,1]=3 2311 B11R0.36 C#CCC[C@H](NCCF)C(=O)O 4dac8d41ce74a8e6236785931775c794 [0,2,0,0,0,0|1,0,1]=4 2312 B11R0.36 C#CCC[C@H](NCCO)C(=O)O e153e223d9867fadaf9c52e572d15e1c [0,2,0,0,0,0|1,0,1]=4 2313 B11R0.36 C#CCC[C@H](NCCS)C(=O)O 58605c8f08191cfd15955ae784277b2e [0,2,0,0,0,0|1,0,1]=4 2314 B11R0.36 C#CCC[C@H](NCOC)C(=O)O 6545bb7b758caff1990a034d097b9c76 [0,2,0,0,0,0|1,0,1]=4 2315 B11R0.36 C#CCC[C@H](NCSC)C(=O)O 8a2b825f9e90e7ed3521606fe6e9c003 [0,2,0,0,0,0|1,0,1]=4 2316 B11R0.36 C#CCNC(CCCC)C(=O)O 0a547d55856f9b3b017332ba72f160bb [0,2,0,0,0,0|0,0,2]=4 2317 B11R0.36 C#CCNC(CCSC)C(=O)O dee75bd93e7873df5973481bc30d1846 [0,2,0,0,0,0|0,0,2]=4 2318 B11R0.36 C#CCN[C@@H](CCCC)C(=O)O ccf2efb7f4cb0875de6e3c437dd5bb6c [0,2,0,0,0,0|0,0,2]=4 2319 B11R0.36 C#CCN[C@@H](CCCO)C(=O)O b53615f8c7b72746cf7696c59eb10988 [0,2,0,0,0,0|0,0,2]=4 2320 B11R0.36 C#CCN[C@@H](CCOC)C(=O)O 7c71684d36aa11505f7f9f6c6516cb4a [0,2,0,0,0,0|0,0,2]=4 2321 B11R0.36 C#CCN[C@@H](CCSC)C(=O)O 0d5820be7141028f1f7d801544c29cd7 [0,2,0,0,0,0|0,0,2]=4 2322 B11R0.36 C#CCN[C@H](CCCC)C(=O)O 4380f0683c3421bce18f2af28efd3df0 [0,2,0,0,0,0|0,0,2]=4 2323 B11R0.36 C#CCN[C@H](CCCO)C(=O)O ddcce65f24094b27848bb423303b22e4 [0,2,0,0,0,0|0,0,2]=4 2324 B11R0.36 C#CCN[C@H](CCSC)C(=O)O 3511f66d724c5e6aa454194375076da6 [0,2,0,0,0,0|0,0,2]=4 2325 B11R0.36 C#CCOC(CCCC)C(=O)O c8e00b524ae4f73c61323e569071a765 [0,2,0,0,0,0|0,0,2]=4 2326 B11R0.36 C=CCCC(NCCC)C(=O)O 37207e8246f45572c392a16d2149e8fc [0,2,0,0,0,0|0,0,1]=3 2327 B11R0.36 C=CCCC(NCCF)C(=O)O 9816b3f7ffd8b3bb19aa3b4a27d51f0e [0,2,0,0,0,0|1,0,1]=4 2328 B11R0.36 C=CCCC(NCCO)C(=O)O 1ac820118ad91403f9bb8db712550fb3 [0,2,0,0,0,0|1,0,1]=4 2329 B11R0.36 C=CCCC(NCCS)C(=O)O 387256a1d1bff27419ac0af1322a3d0f [0,2,0,0,0,0|1,0,1]=4 2330 B11R0.36 C=CCCC(NCOC)C(=O)O 356980062b2da6f77da436cfdd22c704 [0,2,0,0,0,0|1,0,1]=4 2331 B11R0.36 C=CCCC(NCSC)C(=O)O 6268758ff049ca086e8433befc0ee5c3 [0,2,0,0,0,0|1,0,1]=4 2332 B11R0.36 C=CCC[C@@H](NCCC)C(=O)O c716a46131cef31d1ff96e8c94ef1c26 [0,2,0,0,0,0|0,0,1]=3 2333 B11R0.36 C=CCC[C@@H](NCCF)C(=O)O 3b0b883f52af0a90408b2c1a3ffd1923 [0,2,0,0,0,0|1,0,1]=4 2334 B11R0.36 C=CCC[C@@H](NCCO)C(=O)O c87f13088187ccf241b22f28fb50d8dd [0,2,0,0,0,0|1,0,1]=4 2335 B11R0.36 C=CCC[C@@H](NCCS)C(=O)O 645a8ca5711903a740f3bbcdb835c54c [0,2,0,0,0,0|1,0,1]=4 2336 B11R0.36 C=CCC[C@@H](NCOC)C(=O)O 893f6b33648f5ff7044f3c14600f7a0f [0,2,0,0,0,0|1,0,1]=4 2337 B11R0.36 C=CCC[C@@H](NCSC)C(=O)O 19ba74b37ebf8be392b95b47176f14bc [0,2,0,0,0,0|1,0,1]=4 2338 B11R0.36 C=CCC[C@H](NCCC)C(=O)O d20c17ae1851dfdca0bb6c0b483f4b2b [0,2,0,0,0,0|0,0,1]=3 2339 B11R0.36 C=CCC[C@H](NCCF)C(=O)O 61c8b4dfa409af03d08ca052e5edd411 [0,2,0,0,0,0|1,0,1]=4 2340 B11R0.36 C=CCC[C@H](NCCO)C(=O)O b3173ca9186de9e2e8b353af095ebd43 [0,2,0,0,0,0|1,0,1]=4 2341 B11R0.36 C=CCC[C@H](NCCS)C(=O)O 4bf79db6f146308f5a8da4089f0b9ff9 [0,2,0,0,0,0|1,0,1]=4 2342 B11R0.36 C=CCC[C@H](NCOC)C(=O)O ce477ef278ca523cc5a5b6d923506737 [0,2,0,0,0,0|1,0,1]=4 2343 B11R0.36 C=CCC[C@H](NCSC)C(=O)O 77a3a57015f82f5451b8aaa9ba80068f [0,2,0,0,0,0|1,0,1]=4 2344 B11R0.36 C=CCNC(CCCC)C(=O)O 5d7e60a551c76a4c67bc3f59943d6c7d [0,2,0,0,0,0|0,0,2]=4 2345 B11R0.36 C=CCNC(CCSC)C(=O)O 0d0865baa81c2c9fe1376fd366744aa9 [0,2,0,0,0,0|0,0,2]=4 2346 B11R0.36 C=CCN[C@@H](CCCC)C(=O)O 52322a7d8b6289df39c25ff5a04b7b6d [0,2,0,0,0,0|0,0,2]=4 2347 B11R0.36 C=CCN[C@@H](CCCO)C(=O)O 4fb9b523287144512b7907ffd0ef0e45 [0,2,0,0,0,0|0,0,2]=4 2348 B11R0.36 C=CCN[C@@H](CCOC)C(=O)O 76833c1cdc6a4e10aa2dfcfe85233731 [0,2,0,0,0,0|0,0,2]=4 2349 B11R0.36 C=CCN[C@@H](CCSC)C(=O)O 3e12bf5d4c9198483c77ea94e47e2d0e [0,2,0,0,0,0|0,0,2]=4 2350 B11R0.36 C=CCN[C@H](CCCC)C(=O)O de18af324e65b0692b4630b6137326a8 [0,2,0,0,0,0|0,0,2]=4 2351 B11R0.36 C=CCN[C@H](CCCO)C(=O)O 69e34362248ae371a8196440e2348515 [0,2,0,0,0,0|0,0,2]=4 2352 B11R0.36 C=CCN[C@H](CCSC)C(=O)O 8a447d227e21ba8c1ceaa87e713f4173 [0,2,0,0,0,0|0,0,2]=4 2353 B11R0.36 C=CCOC(CCCC)C(=O)O d5f8242985f5811cd49b23410261f794 [0,2,0,0,0,0|0,0,2]=4 2354 B11R0.36 C=CCOC(CCSC)C(=O)O 223cd39f32046c19fa900af9856c606d [0,2,0,0,0,0|0,0,2]=4 2355 B11R0.36 C=CCO[C@@H](CCCC)C(=O)O a4034a32f754af3e9f3093d8faf453e4 [0,2,0,0,0,0|0,0,2]=4 2356 B11R0.36 C=CCO[C@H](CCCC)C(=O)O 52e2a4cddc6e9d9cbd73f603f10600b0 [0,2,0,0,0,0|0,0,2]=4 2357 B11R0.36 CC#CC[C@@H](NCCC)C(=O)O 02765151f5d8a5fe66bc86f577caf53e [0,2,0,0,0,0|0,0,1]=3 2358 B11R0.36 CC#CC[C@@H](NCCF)C(=O)O fbf66232ae87331bd9f88bc1038b2b93 [0,2,0,0,0,0|1,0,1]=4 2359 B11R0.36 CC#CC[C@@H](NCCO)C(=O)O 7bf5dedde5a2ed6bda25c6d9b44bd86a [0,2,0,0,0,0|1,0,1]=4 2360 B11R0.36 CC#CC[C@@H](NCCS)C(=O)O 8126b5b6efa66c9864e52431106ae3f4 [0,2,0,0,0,0|1,0,1]=4 2361 B11R0.36 CC#CC[C@@H](NCOC)C(=O)O 98ca21cf1e9dedc5a8c8e65c75389416 [0,2,0,0,0,0|1,0,1]=4 2362 B11R0.36 CC#CC[C@@H](NCSC)C(=O)O 1b93d348e393f5b41f43b055b70faff1 [0,2,0,0,0,0|1,0,1]=4 2363 B11R0.36 CC#CC[C@H](NCCC)C(=O)O 21a634fb55f28997dbce2c3bb4bf429a [0,2,0,0,0,0|0,0,1]=3 2364 B11R0.36 CC#CC[C@H](NCCF)C(=O)O af82e5b7a6ed25bbf3f19bf783cf489f [0,2,0,0,0,0|1,0,1]=4 2365 B11R0.36 CC#CC[C@H](NCCO)C(=O)O 86b6aca770883f64c20eddcc49467720 [0,2,0,0,0,0|1,0,1]=4 2366 B11R0.36 CC#CC[C@H](NCCS)C(=O)O baf29fbe3b42a5de9da58fc604863dc2 [0,2,0,0,0,0|1,0,1]=4 2367 B11R0.36 CC#CC[C@H](NCOC)C(=O)O 35247cc5fe387a7f1c153b206a67a72e [0,2,0,0,0,0|1,0,1]=4 2368 B11R0.36 CC#CC[C@H](NCSC)C(=O)O 78248ede0f7088db102c1672df92bf13 [0,2,0,0,0,0|1,0,1]=4 2369 B11R0.36 CC(=O)N(CCCO)CCCO 4cee43ffd89dcd63ae6aa413c46da4ff [0,2,0,0,0,0|2,0,0]=4 2370 B11R0.36 CCCCC(COCC)C(=O)O 95ffbf80b72946647c18bcb449d698a0 [0,2,0,0,0,0|0,0,0]=2 2371 B11R0.36 CCCCC(COCF)C(=O)O 3981c69009bac6e700dfd4cefb929f25 [0,2,0,0,0,0|1,0,0]=3 2372 B11R0.36 CCCCC(NCC#N)C(=O)O 2efdfb98ae56da487b86a17c6f975910 [0,2,0,0,0,0|1,0,1]=4 2373 B11R0.36 CCCCC(NCC=O)C(=O)O 7a54b884ad27ba7d830d20125aef777c [0,2,0,0,0,0|1,0,1]=4 2374 B11R0.36 CCCCC(NCCBr)C(=O)N e334bdfdcfc2c5ee5f84df86a18e1c83 [0,2,0,0,0,0|2,0,0]=4 2375 B11R0.36 CCCCC(NCCC)C(=O)N 94e40cc752c88116e222b12998214b3c [0,2,0,0,0,0|1,0,0]=3 2376 B11R0.36 CCCCC(NCCC)C(=O)O 07745ad745f82fb418fdb310d8c0c2fb [0,2,0,0,0,0|0,0,0]=2 2377 B11R0.36 CCCCC(NCCF)C(=O)N 7cda8ac465d0066ea661ca54b1d64f84 [0,2,0,0,0,0|2,0,0]=4 2378 B11R0.36 CCCCC(NCCF)C(=O)O 4cd40bcf883a6200ad3f9004619538f5 [0,2,0,0,0,0|1,0,0]=3 2379 B11R0.36 CCCCC(NCCI)C(=O)N 8a7f0d988052283dc476b88497688451 [0,2,0,0,0,0|2,0,0]=4 2380 B11R0.36 CCCCC(NCCI)C(=O)O 56b2026c3fa89f6b24b57d72840c637f [0,2,0,0,0,0|1,0,0]=3 2381 B11R0.36 CCCCC(NCCO)C(=O)N ae14ee13560e1eebdb0e22eb398f5325 [0,2,0,0,0,0|2,0,0]=4 2382 B11R0.36 CCCCC(NCCO)C(=O)O 7968d8500bf604ac53bd53fe064e93b7 [0,2,0,0,0,0|1,0,0]=3 2383 B11R0.36 CCCCC(NCCS)C(=O)N a28a62b37ef8087450189fbad29376cd [0,2,0,0,0,0|2,0,0]=4 2384 B11R0.36 CCCCC(NCOC)C(=O)N de14f574a880adfd6fa2dfa03bce7635 [0,2,0,0,0,0|2,0,0]=4 2385 B11R0.36 CCCCC(NCOC)C(=O)O 29abda64b7cb86089156159b72e59f6d [0,2,0,0,0,0|1,0,0]=3 2386 B11R0.36 CCCCC(NCSC)C(=O)N ca0acc7b47e3a08367b1d004185f1814 [0,2,0,0,0,0|2,0,0]=4 2387 B11R0.36 CCCCC(NCSC)C(=O)O d95287f1fac1a66a70726bec36151f6f [0,2,0,0,0,0|1,0,0]=3 2388 B11R0.36 CCCCC(OCC#N)C(=O)O 9e64bff2535f00f3ef87e00cb5d7fb7e [0,2,0,0,0,0|1,0,1]=4 2389 B11R0.36 CCCCC(OCC=O)C(=O)O dd5fa09ccd0878f593556efd411ff268 [0,2,0,0,0,0|1,0,1]=4 2390 B11R0.36 CCCCC(OCCC)C(=O)N 933062d17aafe2cad690d3161709064f [0,2,0,0,0,0|1,0,0]=3 2391 B11R0.36 CCCCC(OCCC)C(=O)O 1b204540e621a0884f60e8752d5fba4d [0,2,0,0,0,0|0,0,0]=2 2392 B11R0.36 CCCCC(OCCF)C(=O)N fb5148494e65c8192d77046681c66bac [0,2,0,0,0,0|2,0,0]=4 2393 B11R0.36 CCCCC(OCCF)C(=O)O 54dd359701d67ea65bd390ec1bfb8374 [0,2,0,0,0,0|1,0,0]=3 2394 B11R0.36 CCCCC(OCCS)C(=O)N b09b0a5d6294e06350e435dd4c36c9e0 [0,2,0,0,0,0|2,0,0]=4 2395 B11R0.36 CCCCC(OCCS)C(=O)O 440aa0223ee76da908b4437fb54e163f [0,2,0,0,0,0|1,0,0]=3 2396 B11R0.36 CCCCC(OCOC)C(=O)N 3637d55466c6eceb6882ead35e27b5d5 [0,2,0,0,0,0|2,0,0]=4 2397 B11R0.36 CCCCC(OCOC)C(=O)O 4ed11061f05dc8edbd39ed85ee6a81cd [0,2,0,0,0,0|1,0,0]=3 2398 B11R0.36 CCCCC(OCSC)C(=O)O f4cfd4268bba7f21e1608bdd677ecc2f [0,2,0,0,0,0|1,0,0]=3 2399 B11R0.36 CCCCN(CCCC)C(=O)C 60559782e8ee2e563e494b720033da63 [0,2,0,0,0,0|2,0,0]=4 2400 B11R0.36 CCCC[C@@H](COCC)C(=O)O b18b36dad66c2879cf1b0df124eb7cfc [0,2,0,0,0,0|0,0,0]=2 2401 B11R0.36 CCCC[C@@H](COCF)C(=O)O 0ec3f772bd8b197c99c47dd68e92e4ed [0,2,0,0,0,0|1,0,0]=3 2402 B11R0.36 CCCC[C@@H](NCC#N)C(=O)O 464b6f7646572b854a3f293138bdb5ca [0,2,0,0,0,0|1,0,1]=4 2403 B11R0.36 CCCC[C@@H](NCC=O)C(=O)O 9e897ad0ff845a3471953a31b0d2c882 [0,2,0,0,0,0|1,0,1]=4 2404 B11R0.36 CCCC[C@@H](NCCC)C(=O)O 3f08467579db3dc7f36835f120f0ca32 [0,2,0,0,0,0|0,0,0]=2 2405 B11R0.36 CCCC[C@@H](NCCF)C(=O)O 9efe343005fa5b416d066fc67fcd02a2 [0,2,0,0,0,0|1,0,0]=3 2406 B11R0.36 CCCC[C@@H](NCCO)C(=O)O 475875d376e586a00b98dada6db2d5cc [0,2,0,0,0,0|1,0,0]=3 2407 B11R0.36 CCCC[C@@H](NCOC)C(=O)O 5893dfbd03f45a17ddc064ce4c2f9c2f [0,2,0,0,0,0|1,0,0]=3 2408 B11R0.36 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N#CCN[C@@H](CCCO)C(=O)O eb633180c4782e0bc856ecd9edc8a08f [0,2,0,0,0,0|1,0,1]=4 2486 B11R0.36 N#CCN[C@H](CCCO)C(=O)O 42f31ad91d642345bfa5f61b319699f7 [0,2,0,0,0,0|1,0,1]=4 2487 B11R0.36 O=C(O)[C@@H](CCCO)NCCF f02cd740a5f84cc2a89b93a0b729a4b1 [0,2,0,0,0,0|1,0,0]=3 2488 B11R0.36 O=C(O)[C@@H](CCCO)NCCO 3135b945108f29d3a6d41ca7f607c556 [0,2,0,0,0,0|1,0,0]=3 2489 B11R0.36 O=C(O)[C@@H](CCCO)NCCS 16933d266d70613927a0120270455238 [0,2,0,0,0,0|1,0,0]=3 2490 B11R0.36 O=C(O)[C@H](CCCO)NCCF 714a912feccddd6e502c13f454ba3fd7 [0,2,0,0,0,0|1,0,0]=3 2491 B11R0.36 O=C(O)[C@H](CCCO)NCCO b0893e9a47b90eac729f30dc70b25500 [0,2,0,0,0,0|1,0,0]=3 2492 B11R0.36 O=C(O)[C@H](CCCO)NCCS 2a00960398822b5fdecffea80f492f64 [0,2,0,0,0,0|1,0,0]=3 2493 B11R0.36 O=CCN[C@@H](CCCO)C(=O)O e23ec24574a1c6f61410cb9f62e3bdae [0,2,0,0,0,0|1,0,1]=4 2494 B11R0.36 O=CCN[C@H](CCCO)C(=O)O 307e35098d663f3d07e1d61ae5799ffb [0,2,0,0,0,0|1,0,1]=4 2495 B11R0.78 C#CCC(NCCCC)C(=O)O e37bbe0eabf8a0a89ee6fdf754646f46 [0,2,0,0,0,0|0,0,2]=4 2496 B11R0.78 C#CCC(NCCCF)C(=O)O c1b9ee852b2651e277c5486994a651a6 [0,2,0,0,0,0|0,0,2]=4 2497 B11R0.78 C#CCC(NCCCO)C(=O)O 3dfb0adb52c222a2cff94dba55e5992f [0,2,0,0,0,0|0,0,2]=4 2498 B11R0.78 C#CCC(NCCCS)C(=O)O a29f1060ce2caf42e05cf8b10603ae78 [0,2,0,0,0,0|0,0,2]=4 2499 B11R0.78 C#CCC(NCCOC)C(=O)O 36275c7099711478d7c3a84c5dd62b68 [0,2,0,0,0,0|0,0,2]=4 2500 B11R0.78 C#CCC(NCCSC)C(=O)O 98f686f7a5205cdba0c359a32b988329 [0,2,0,0,0,0|0,0,2]=4 2501 B11R0.78 C#CCC(OCCCC)C(=O)O 87fe4f3d57722f558f2c55a3aedcf94b [0,2,0,0,0,0|0,0,2]=4 2502 B11R0.78 C#CCC(OCCCF)C(=O)O 5fef0cfdd6d02346ce4b97bc548cf704 [0,2,0,0,0,0|0,0,2]=4 2503 B11R0.78 C#CCC(OCCOC)C(=O)O 0222c1822e7513bee10f8c9888202e01 [0,2,0,0,0,0|0,0,2]=4 2504 B11R0.78 C#CCC(OCCSC)C(=O)O ef342416a318d79ee08213c480224fcd [0,2,0,0,0,0|0,0,2]=4 2505 B11R0.78 C#CCCC[C@@H](NCC)C(=O)O 14566a23849575e896b26b9795adc64e [0,2,0,0,0,0|1,0,0]=3 2506 B11R0.78 C#CCCC[C@@H](NCF)C(=O)O a111e207d743ee14d3f71eb66f2d8095 [0,2,0,0,0,0|2,0,0]=4 2507 B11R0.78 C#CCCC[C@@H](NCO)C(=O)O 5d96394b249a695c07688c41248432ba [0,2,0,0,0,0|2,0,0]=4 2508 B11R0.78 C#CCCC[C@H](NCC)C(=O)O b332cf8e83965228173812babea2e480 [0,2,0,0,0,0|1,0,0]=3 2509 B11R0.78 C#CCCC[C@H](NCF)C(=O)O da320c434cdf8bf8759146e8fd99d587 [0,2,0,0,0,0|2,0,0]=4 2510 B11R0.78 C#CCCC[C@H](NCO)C(=O)O 070173f9dd2d3f06ce79d851dc45b87b [0,2,0,0,0,0|2,0,0]=4 2511 B11R0.78 C#CCCNC(CCC)C(=O)C 10d50673d0677a9eb86ca7d75601d946 [0,2,0,0,0,0|1,0,1]=4 2512 B11R0.78 C#CCCNC(CCC)C(=O)O 9d9c5f54c8edadc36b072939e97eb55d [0,2,0,0,0,0|0,0,1]=3 2513 B11R0.78 C#CCCNC(CCO)C(=O)O d8ff8f8d85069d3874e11f843ab8fbd1 [0,2,0,0,0,0|1,0,1]=4 2514 B11R0.78 C#CCCNC(CCS)C(=O)O df55391767499430fb5cff0de23746c0 [0,2,0,0,0,0|1,0,1]=4 2515 B11R0.78 C#CCCNC(COC)C(=O)O 26df0dfcb2c62b75ee342b16ef9df601 [0,2,0,0,0,0|1,0,1]=4 2516 B11R0.78 C#CCCNC(CSC)C(=O)O f273d23dbcca1d85f60119a68ea452fe [0,2,0,0,0,0|1,0,1]=4 2517 B11R0.78 C#CCCN[C@@H](CCC)C(=O)O 8a8b453cc0b01a86739933aa039ce320 [0,2,0,0,0,0|0,0,1]=3 2518 B11R0.78 C#CCCN[C@@H](CCO)C(=O)O 157d7a33f25f49c422b2a10967807575 [0,2,0,0,0,0|1,0,1]=4 2519 B11R0.78 C#CCCN[C@@H](CCS)C(=O)O 609a3dbb45c62d95468fc0ed07112322 [0,2,0,0,0,0|1,0,1]=4 2520 B11R0.78 C#CCCN[C@@H](COC)C(=O)O c1bc136996c21b13df099ae4d1d3d5f5 [0,2,0,0,0,0|1,0,1]=4 2521 B11R0.78 C#CCCN[C@@H](CSC)C(=O)O 281bcb35562d3aeb67d0be47bd479574 [0,2,0,0,0,0|1,0,1]=4 2522 B11R0.78 C#CCCN[C@H](CCC)C(=O)O f4f36ec94d117a4916c6541b48439479 [0,2,0,0,0,0|0,0,1]=3 2523 B11R0.78 C#CCCN[C@H](CCO)C(=O)O fa70dae6894378291c55bd0cb6f9cc1b [0,2,0,0,0,0|1,0,1]=4 2524 B11R0.78 C#CCCN[C@H](CCS)C(=O)O 101b0a8632b2b182bc53cb1ef5082130 [0,2,0,0,0,0|1,0,1]=4 2525 B11R0.78 C#CCCN[C@H](COC)C(=O)O ec9a4e081395d2273911cbf829b7538c [0,2,0,0,0,0|1,0,1]=4 2526 B11R0.78 C#CCCN[C@H](CSC)C(=O)O 7cdc795d8524f8d3a2cf4688a64e3d6b [0,2,0,0,0,0|1,0,1]=4 2527 B11R0.78 C#CCCOC(CCC)C(=O)C 2f6c8cc71048dfbc7ae1e2a723ab8424 [0,2,0,0,0,0|1,0,1]=4 2528 B11R0.78 C#CCCOC(CCC)C(=O)N 5e06c23b3c8f74800aa6b21b0c491e67 [0,2,0,0,0,0|1,0,1]=4 2529 B11R0.78 C#CCCOC(CCC)C(=O)O d4136c708c51ae0f802df0a95b959012 [0,2,0,0,0,0|0,0,1]=3 2530 B11R0.78 C#CCCOC(COC)C(=O)O ae75a8cab32be5071ea04c06b4e4a18e [0,2,0,0,0,0|1,0,1]=4 2531 B11R0.78 C#CCCOC(CSC)C(=O)O 8bd9fae0dd90929b837e9d864d2d9311 [0,2,0,0,0,0|1,0,1]=4 2532 B11R0.78 C#CCCO[C@@H](CCC)C(=O)O 433a733a2d72cec3fd17867bba4366bb [0,2,0,0,0,0|0,0,1]=3 2533 B11R0.78 C#CCCO[C@H](CCC)C(=O)O 97db4642d2dda11c95a0c77c55a5d64d [0,2,0,0,0,0|0,0,1]=3 2534 B11R0.78 C#CCNCC(CCC)C(=O)O 693ee8879c03ad577bbe1b3b1670f119 [0,2,0,0,0,0|0,0,1]=3 2535 B11R0.78 C#CCNC[C@H](CCC)C(=O)O 7fd74390a812ffe7e054ecb9da2bb105 [0,2,0,0,0,0|0,0,1]=3 2536 B11R0.78 C#CCOC[C@@H](CCC)C(=O)O dc48e6290cb5634fd0f268942e25766a [0,2,0,0,0,0|0,0,1]=3 2537 B11R0.78 C#CCSC[C@H](NCC)C(=O)O 196a4610505a9f44e5d92a1ac9083933 [0,2,0,0,0,0|1,0,1]=4 2538 B11R0.78 C#CC[C@@H](NCCCC)C(=O)O bd013ace9924ba123c73dfb2bec8a27b [0,2,0,0,0,0|0,0,2]=4 2539 B11R0.78 C#CC[C@@H](NCCCF)C(=O)O 2ceca0ce09e2adfb0ba88f62bac7a73c [0,2,0,0,0,0|0,0,2]=4 2540 B11R0.78 C#CC[C@@H](NCCCO)C(=O)O e74122a9d6568952a472c09508ba2fad [0,2,0,0,0,0|0,0,2]=4 2541 B11R0.78 C#CC[C@@H](NCCCS)C(=O)O a0d05e64afdc35d149d1e37c810ed0b7 [0,2,0,0,0,0|0,0,2]=4 2542 B11R0.78 C#CC[C@@H](NCCOC)C(=O)O 782bd1fa5812bd6d7adacd4a92863a7a [0,2,0,0,0,0|0,0,2]=4 2543 B11R0.78 C#CC[C@@H](NCCSC)C(=O)O c313c42c10eb8feb4f2f73923efa81e1 [0,2,0,0,0,0|0,0,2]=4 2544 B11R0.78 C#CC[C@H](NCCCC)C(=O)O 74f9a2891573e402e96684386286a23d [0,2,0,0,0,0|0,0,2]=4 2545 B11R0.78 C#CC[C@H](NCCCF)C(=O)O f0d6331818bc34df92e279352b6e41e9 [0,2,0,0,0,0|0,0,2]=4 2546 B11R0.78 C#CC[C@H](NCCCO)C(=O)O bf07e2003eadeda79ea67cd2f0e49965 [0,2,0,0,0,0|0,0,2]=4 2547 B11R0.78 C#CC[C@H](NCCCS)C(=O)O f1debe0224ab6d5156422387eb7a7091 [0,2,0,0,0,0|0,0,2]=4 2548 B11R0.78 C#CC[C@H](NCCOC)C(=O)O 052ee77255fca7a72383da53c84328d3 [0,2,0,0,0,0|0,0,2]=4 2549 B11R0.78 C#CC[C@H](NCCSC)C(=O)O 855719410842ca4eacd1b07ac3dc2491 [0,2,0,0,0,0|0,0,2]=4 2550 B11R0.78 C/C=C/CNC(CCC)C(=O)O a914a2e3e87662918af0a1b3ac7b8492 [0,2,0,0,0,0|0,0,1]=3 2551 B11R0.78 C/C=C/CNC(CCO)C(=O)O c11f4559bc1730d89e75444052bdf862 [0,2,0,0,0,0|1,0,1]=4 2552 B11R0.78 C/C=C/CNC(CCS)C(=O)O 3dc7527216462a1c4c5776f5e782cce3 [0,2,0,0,0,0|1,0,1]=4 2553 B11R0.78 C/C=C/CNC(COC)C(=O)O d550cb6aeda7cefb1cc0e6978e1cbbb5 [0,2,0,0,0,0|1,0,1]=4 2554 B11R0.78 C/C=C/CNC(CSC)C(=O)O c87896f126957dea3ad37157e0abadc7 [0,2,0,0,0,0|1,0,1]=4 2555 B11R0.78 C/C=C/CN[C@@H](CCC)C(=O)O aaabd12eca42ea5d96529946115c5942 [0,2,0,0,0,0|0,0,1]=3 2556 B11R0.78 C/C=C/CN[C@@H](CCO)C(=O)O 31f7649c3a28cb6e533836d3b787b371 [0,2,0,0,0,0|1,0,1]=4 2557 B11R0.78 C/C=C/CN[C@@H](CCS)C(=O)O 4b93c98cc72d5fc82d9a267f19e60120 [0,2,0,0,0,0|1,0,1]=4 2558 B11R0.78 C/C=C/CN[C@@H](COC)C(=O)O bb2ec91381ddc0ee184a87788279bf5e [0,2,0,0,0,0|1,0,1]=4 2559 B11R0.78 C/C=C/CN[C@@H](CSC)C(=O)O 567d3e77d89ac59e73b03244d1e27189 [0,2,0,0,0,0|1,0,1]=4 2560 B11R0.78 C/C=C/CN[C@H](CCC)C(=O)O e5d11a81b8d7e0b6b70099872357d8c1 [0,2,0,0,0,0|0,0,1]=3 2561 B11R0.78 C/C=C/CN[C@H](CCO)C(=O)O 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C/C=C/SC[C@H](NCC)C(=O)O aa1df95316a636c91748cf25aa7548fe [0,2,0,0,0,0|1,0,1]=4 2573 B11R0.78 C/C=C\CNC(CCC)C(=O)O c669f8811a03c5b8328d681a48336f58 [0,2,0,0,0,0|0,0,1]=3 2574 B11R0.78 C/C=C\CNC(CCO)C(=O)O 03f38e7468cdcf7e8cfef77014981f34 [0,2,0,0,0,0|1,0,1]=4 2575 B11R0.78 C/C=C\CNC(CCS)C(=O)O 46b2087be25f2dd718de62afe2964f4e [0,2,0,0,0,0|1,0,1]=4 2576 B11R0.78 C/C=C\CNC(COC)C(=O)O 312d36476a53e0e9621051f9da6b588c [0,2,0,0,0,0|1,0,1]=4 2577 B11R0.78 C/C=C\CNC(CSC)C(=O)O 960925f3727f280663330fbe41a7ba2d [0,2,0,0,0,0|1,0,1]=4 2578 B11R0.78 C/C=C\CN[C@@H](CCC)C(=O)O 861031de71ed6829d58e01bf4e45d5bf [0,2,0,0,0,0|0,0,1]=3 2579 B11R0.78 C/C=C\CN[C@@H](CCO)C(=O)O a9690e7bdf4455790e35840df4294981 [0,2,0,0,0,0|1,0,1]=4 2580 B11R0.78 C/C=C\CN[C@@H](CCS)C(=O)O 46475daed82c13687e21b6461186f238 [0,2,0,0,0,0|1,0,1]=4 2581 B11R0.78 C/C=C\CN[C@@H](COC)C(=O)O bc871885c877f3010d7c2ae7d2e0307a [0,2,0,0,0,0|1,0,1]=4 2582 B11R0.78 C/C=C\CN[C@@H](CSC)C(=O)O 96a9c0b568fc3973a3c0d7385e94f778 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CSCC(OCCC#N)C(=O)O 8b22f5cc30b1b3e3401083c0c7e1e2e6 [0,2,0,0,0,0|1,0,1]=4 2891 B11R0.78 CSCC(OCCC=O)C(=O)O b5c4940c6310ba6b5e46f6db9af04cc8 [0,2,0,0,0,0|1,0,1]=4 2892 B11R0.78 CSCC(OCCCF)C(=O)O c5149b16a2401da5631dacf702d8e7d6 [0,2,0,0,0,0|1,0,0]=3 2893 B11R0.78 CSCCCC(NCF)C(=O)O 0d2bb89ffec1bd084e8a6a985d8eadff [0,2,0,0,0,0|2,0,0]=4 2894 B11R0.78 CSCCCC(NCO)C(=O)O 15766f09ce7223c2f67b0f1a0a2b3135 [0,2,0,0,0,0|2,0,0]=4 2895 B11R0.78 CSCCC[C@@H](NCF)C(=O)O 5932406c24e2908e48a2b85071150a36 [0,2,0,0,0,0|2,0,0]=4 2896 B11R0.78 CSCCC[C@@H](NCO)C(=O)O c1d36442cb8a56557bad8009687d0039 [0,2,0,0,0,0|2,0,0]=4 2897 B11R0.78 CSCCC[C@H](NCF)C(=O)O 5f7902eb01a96d78282a5f1dbce07a0c [0,2,0,0,0,0|2,0,0]=4 2898 B11R0.78 CSCCC[C@H](NCO)C(=O)O b2730f5406d658c778cd474f28f683e1 [0,2,0,0,0,0|2,0,0]=4 2899 B11R0.78 CSCCNC(CC#N)C(=O)O 3a3f972acac89fc9f6343cd945245791 [0,2,0,0,0,0|1,0,1]=4 2900 B11R0.78 CSCCNC(CCO)C(=O)C 097f648a77cef51031d01fb5cfa6eef0 [0,2,0,0,0,0|2,0,0]=4 2901 B11R0.78 CSCCNC(CCO)C(=O)O 6e4859227e27970e5360cfd8bde04c13 [0,2,0,0,0,0|1,0,0]=3 2902 B11R0.78 CSCCNC(CCS)C(=O)O a6fe1b50a9e741ddb4bdd41f55ecd513 [0,2,0,0,0,0|1,0,0]=3 2903 B11R0.78 CSCCNC(CSC)C(=O)O 806d2f6458cc04fb45b229f8a6a11804 [0,2,0,0,0,0|1,0,0]=3 2904 B11R0.78 CSCCN[C@@H](CC#N)C(=O)O ccea1ce5b639285e2d89a8399f99dae9 [0,2,0,0,0,0|1,0,1]=4 2905 B11R0.78 CSCCN[C@@H](CCO)C(=O)O f15f01a02640b23ec03be18b2c21b701 [0,2,0,0,0,0|1,0,0]=3 2906 B11R0.78 CSCCN[C@@H](CCS)C(=O)O b8b20c8e5cb9ea16b9cd14558f0c750f [0,2,0,0,0,0|1,0,0]=3 2907 B11R0.78 CSCCN[C@@H](CSC)C(=O)O 260dd4cda32647e9e2e4b7734ac45c15 [0,2,0,0,0,0|1,0,0]=3 2908 B11R0.78 CSCCN[C@H](CCO)C(=O)O c8d0c61ecdc9a31382eede83f32efe49 [0,2,0,0,0,0|1,0,0]=3 2909 B11R0.78 CSCCN[C@H](CCS)C(=O)O 7e59b81d0acf8a85a11da6ae458d520d [0,2,0,0,0,0|1,0,0]=3 2910 B11R0.78 CSCCN[C@H](CSC)C(=O)O f43e569023961297a91a150661cce1eb [0,2,0,0,0,0|1,0,0]=3 2911 B11R0.78 CSCCOC(CSC)C(=O)O 58586c7a138ac0de068c34ce07bdaaeb [0,2,0,0,0,0|1,0,0]=3 2912 B11R0.78 CSC[C@@H](NCCC#N)C(=O)O b7b7cc4d97105b65f1648234ccaff3c7 [0,2,0,0,0,0|1,0,1]=4 2913 B11R0.78 CSC[C@@H](NCCC=O)C(=O)O f0950d47823a1ace9ad351a85112a2d4 [0,2,0,0,0,0|1,0,1]=4 2914 B11R0.78 CSC[C@@H](NCCCF)C(=O)O ed4cd90e8cc94b4e9a80a421a7cf6afd [0,2,0,0,0,0|1,0,0]=3 2915 B11R0.78 CSC[C@@H](NCCCO)C(=O)O eb34d17a915045f27fb2becf0cedddfc [0,2,0,0,0,0|1,0,0]=3 2916 B11R0.78 CSC[C@@H](NCCCS)C(=O)O 37b2cdf49a55914e82721d7fdfb30f6b [0,2,0,0,0,0|1,0,0]=3 2917 B11R0.78 CSC[C@H](NCCC#N)C(=O)O af0fdf227d53199828bf3411d58a3761 [0,2,0,0,0,0|1,0,1]=4 2918 B11R0.78 CSC[C@H](NCCC=O)C(=O)O f159d8d2704ed5477942c7258935c339 [0,2,0,0,0,0|1,0,1]=4 2919 B11R0.78 CSC[C@H](NCCCF)C(=O)O e72a9f544d3b4566ec5924b93a784d5a [0,2,0,0,0,0|1,0,0]=3 2920 B11R0.78 CSC[C@H](NCCCO)C(=O)O 1a436f64a01f3b6c0dad7d4022a925d1 [0,2,0,0,0,0|1,0,0]=3 2921 B11R0.78 CSC[C@H](NCCCS)C(=O)O 3b74612fb1ed5dea3c7bc3d0d8e6c8fc [0,2,0,0,0,0|1,0,0]=3 2922 B11R0.78 N#CCC(NCCCF)C(=O)O 29d98997dd8e560b66853849a357e9c3 [0,2,0,0,0,0|1,0,1]=4 2923 B11R0.78 N#CCC(NCCCO)C(=O)O 8532a0eb4e0937aa16a61d95e7bd0246 [0,2,0,0,0,0|1,0,1]=4 2924 B11R0.78 N#CCC(NCCCS)C(=O)O 5dc38e931ee5f332d7dd43e43fda36c2 [0,2,0,0,0,0|1,0,1]=4 2925 B11R0.78 N#CCCNC(CCO)C(=O)O 2a999bb4b2982b707e2271e824cf9727 [0,2,0,0,0,0|1,0,1]=4 2926 B11R0.78 N#CCCNC(CCS)C(=O)O 838b49cfeb4420915375dee7b3924d6d [0,2,0,0,0,0|1,0,1]=4 2927 B11R0.78 N#CCCN[C@@H](CCO)C(=O)O dd70df87ac179266a9d45d34c5a6d943 [0,2,0,0,0,0|1,0,1]=4 2928 B11R0.78 N#CCCN[C@@H](CCS)C(=O)O 5b28fb3d3a1d4964342343c0503bf624 [0,2,0,0,0,0|1,0,1]=4 2929 B11R0.78 N#CCCN[C@H](CCO)C(=O)O 766b1a9fe98f6453ad90522e19ce8e57 [0,2,0,0,0,0|1,0,1]=4 2930 B11R0.78 N#CCCN[C@H](CCS)C(=O)O d04717dadc7ca42916a650b784801b56 [0,2,0,0,0,0|1,0,1]=4 2931 B11R0.78 N#CC[C@H](NCCCF)C(=O)O 7eea4e3fc2a5cd3e5ef321441ceeb7fa [0,2,0,0,0,0|1,0,1]=4 2932 B11R0.78 N#CC[C@H](NCCCO)C(=O)O 6af5d79d494155822ee4f901acd3a7db [0,2,0,0,0,0|1,0,1]=4 2933 B11R0.78 N#CC[C@H](NCCCS)C(=O)O e36cceacfeccd26c5421cea0dab40938 [0,2,0,0,0,0|1,0,1]=4 2934 B11R0.78 O=C(O)C(CCO)NCCCF ecc2bc710fe22e94dcf3c2d674f3e330 [0,2,0,0,0,0|1,0,0]=3 2935 B11R0.78 O=C(O)C(CCO)NCCCO 8f071811d222761ba3c2358e2f79fe06 [0,2,0,0,0,0|1,0,0]=3 2936 B11R0.78 O=C(O)C(CCO)NCCCS 3ea89c61eb8907868aba58fe15ed2836 [0,2,0,0,0,0|1,0,0]=3 2937 B11R0.78 O=C(O)C(CCS)NCCCF 69d3ee5dce444b3007080209682c23cd [0,2,0,0,0,0|1,0,0]=3 2938 B11R0.78 O=C(O)C(CCS)NCCCO 6fbc6bb96b97c7d7562dccade94420d5 [0,2,0,0,0,0|1,0,0]=3 2939 B11R0.78 O=C(O)C(CCS)NCCCS 5c58fc22872c3bd9df161457c278261b [0,2,0,0,0,0|1,0,0]=3 2940 B11R0.78 O=C(O)C(CSCCO)NCF a4351df9105779815e78d85691a4fd1f [0,2,0,0,0,0|2,0,0]=4 2941 B11R0.78 O=C(O)C(CSCCO)NCO 3e6c600ac1c900a94d342da83ad57f42 [0,2,0,0,0,0|2,0,0]=4 2942 B11R0.78 O=C(O)[C@@H](CCCCO)NCF dc7d21cebdfc569af2e83775f459693f [0,2,0,0,0,0|2,0,0]=4 2943 B11R0.78 O=C(O)[C@@H](CCCCO)NCO d6c8b911bfc76e0c61082fde7b8d9d62 [0,2,0,0,0,0|2,0,0]=4 2944 B11R0.78 O=C(O)[C@@H](CCO)NCCCF 306eaad7ff35f12ef27e7ef41c6cce7b [0,2,0,0,0,0|1,0,0]=3 2945 B11R0.78 O=C(O)[C@@H](CCO)NCCCO ef24a745c1d3f61da047a394a94168ec [0,2,0,0,0,0|1,0,0]=3 2946 B11R0.78 O=C(O)[C@@H](CCO)NCCCS bcbd72766b28de22da67dadab51a03ff [0,2,0,0,0,0|1,0,0]=3 2947 B11R0.78 O=C(O)[C@@H](CCS)NCCCF 943457b994b2ee1450a75818cfa9ccc9 [0,2,0,0,0,0|1,0,0]=3 2948 B11R0.78 O=C(O)[C@@H](CCS)NCCCO 01edb19c16f5511ad7f5d6baa745257a [0,2,0,0,0,0|1,0,0]=3 2949 B11R0.78 O=C(O)[C@@H](CCS)NCCCS 1d938f0d8fcb02a852301eb0e0567921 [0,2,0,0,0,0|1,0,0]=3 2950 B11R0.78 O=C(O)[C@H](CCCCO)NCF 05afc1ac83a3b64eff063cf072af96c0 [0,2,0,0,0,0|2,0,0]=4 2951 B11R0.78 O=C(O)[C@H](CCCCO)NCO f176638f6e9199b6b134dfa40d87ce65 [0,2,0,0,0,0|2,0,0]=4 2952 B11R0.78 O=C(O)[C@H](CCO)NCCCF 3ff057b0caa2b357c7ffb249626a4c6d [0,2,0,0,0,0|1,0,0]=3 2953 B11R0.78 O=C(O)[C@H](CCO)NCCCO 222effc4e502a3b93cdf9ea43c307f99 [0,2,0,0,0,0|1,0,0]=3 2954 B11R0.78 O=C(O)[C@H](CCO)NCCCS 1c9344b9f55cb79ab0ae4836ebfa5dc3 [0,2,0,0,0,0|1,0,0]=3 2955 B11R0.78 O=C(O)[C@H](CCS)NCCCF e96552783629138a684c063ccae021f3 [0,2,0,0,0,0|1,0,0]=3 2956 B11R0.78 O=C(O)[C@H](CCS)NCCCO 96cd054cdc753aea1b46ee7dcd4ddccc [0,2,0,0,0,0|1,0,0]=3 2957 B11R0.78 O=C(O)[C@H](CCS)NCCCS ce9634c736529046aa9c52781e307daf [0,2,0,0,0,0|1,0,0]=3 2958 B11R0.78 O=C(O)[C@H](CSCCO)NCF 3e141581eb8aa19b8fd147ee7e63623e [0,2,0,0,0,0|2,0,0]=4 2959 B11R0.78 O=C(O)[C@H](CSCCO)NCO 325d3a9e88498315b4a65dded9096ee2 [0,2,0,0,0,0|2,0,0]=4 2960 B11R0.78 O=CCCNC(CCO)C(=O)O 3e3a5b186e120c128a6bff6e3d70dd23 [0,2,0,0,0,0|1,0,1]=4 2961 B11R0.78 O=CCCNC(CCS)C(=O)O 9a905b7488fe2cf44546305fdcc2d1ca [0,2,0,0,0,0|1,0,1]=4 2962 B11R0.78 O=CCCN[C@@H](CCO)C(=O)O c99a8f845c9097083196524bce310c35 [0,2,0,0,0,0|1,0,1]=4 2963 B11R0.78 O=CCCN[C@@H](CCS)C(=O)O debe3bf8fa4a09281d6fdaadfe7174c5 [0,2,0,0,0,0|1,0,1]=4 2964 B11R0.78 O=CCCN[C@H](CCO)C(=O)O 1932e922ebcdfa0b61390b6a5e0c9363 [0,2,0,0,0,0|1,0,1]=4 2965 B11R0.78 O=CCCN[C@H](CCS)C(=O)O a214e0a90f918fd93c285003afe97da0 [0,2,0,0,0,0|1,0,1]=4 2966 B11R0.146 C#CCC(NCC(C)C)C(=O)O f2c6b039e8bb44a1910d5841f856a909 [0,2,0,0,0,0|0,0,2]=4 2967 B11R0.146 C#CCC(NCC(C)O)C(=O)O d35db58d627f78898884d0ca99de1042 [0,2,0,0,0,0|0,0,2]=4 2968 B11R0.146 C#CCC(NC[C@@H](C)O)C(=O)O c96b7263e9a1b0c1ffac1f6f752dfd7b [0,2,0,0,0,0|0,0,2]=4 2969 B11R0.146 C#CCC(NC[C@H](C)O)C(=O)O e3bf748bf31ce7f08e9a26f6735d6d7b [0,2,0,0,0,0|0,0,2]=4 2970 B11R0.146 C#CCC(OCC(C)C)C(=O)O 2c5ba3b81ac505d5ce403141fe10874a [0,2,0,0,0,0|0,0,2]=4 2971 B11R0.146 C#CC[C@@H](NCC(C)C)C(=O)O b3fcb1300570495ad4067575807a315d [0,2,0,0,0,0|0,0,2]=4 2972 B11R0.146 C#CC[C@@H](NCC(C)O)C(=O)O 7aff7ad6b991a61e478f0161ea76a6c4 [0,2,0,0,0,0|0,0,2]=4 2973 B11R0.146 C#CC[C@@H](NC[C@@H](C)O)C(=O)O 476d26afa1f73b7fbe125da892cad26b [0,2,0,0,0,0|0,0,2]=4 2974 B11R0.146 C#CC[C@@H](NC[C@H](C)O)C(=O)O 1d0b4ccf3124aec1eae009751b0e6101 [0,2,0,0,0,0|0,0,2]=4 2975 B11R0.146 C#CC[C@H](NCC(C)C)C(=O)O 923fbe59b4f8067f2a9b742f6328ee40 [0,2,0,0,0,0|0,0,2]=4 2976 B11R0.146 C#CC[C@H](NCC(C)O)C(=O)O 31cd0bb26d664d6a0ec534a42b6f38f5 [0,2,0,0,0,0|0,0,2]=4 2977 B11R0.146 C#CC[C@H](NC[C@@H](C)O)C(=O)O d02ea4b3ad6a585c6a77ae46b64447c1 [0,2,0,0,0,0|0,0,2]=4 2978 B11R0.146 C#CC[C@H](NC[C@H](C)O)C(=O)O 587ba33cc6c1908f66a0c284198cf469 [0,2,0,0,0,0|0,0,2]=4 2979 B11R0.146 C=C(Br)CNC(CCC)C(=O)O 1fa7829c4011d69b11eee33f1c1ea158 [0,2,0,0,0,0|0,0,2]=4 2980 B11R0.146 C=C(Br)CN[C@@H](CCC)C(=O)O aacfefaa1be1f8a6a4c16c3a0420f101 [0,2,0,0,0,0|0,0,2]=4 2981 B11R0.146 C=C(Br)CN[C@H](CCC)C(=O)O 7d876a3de8323cee15107dc66b039f4b [0,2,0,0,0,0|0,0,2]=4 2982 B11R0.146 C=C(Br)COC(CCC)C(=O)O 3fa8fb2acbedf24711e73bbbdcf0aa50 [0,2,0,0,0,0|0,0,2]=4 2983 B11R0.146 C=C(Br)CO[C@@H](CCC)C(=O)O f9f31a09bb0c185dfb46ddd3ce6fae8a [0,2,0,0,0,0|0,0,2]=4 2984 B11R0.146 C=C(Br)CO[C@H](CCC)C(=O)O 2afceae5c7d11cf7895a8cead2cfa658 [0,2,0,0,0,0|0,0,2]=4 2985 B11R0.146 C=C(C)CC[C@@H](NCC)C(=O)O 7b79a49035d61afcb40af8c02e2bb5a2 [0,2,0,0,0,0|1,0,0]=3 2986 B11R0.146 C=C(C)CC[C@@H](NCF)C(=O)O 51d36e3f88203e8401cf88e4db88f9e8 [0,2,0,0,0,0|2,0,0]=4 2987 B11R0.146 C=C(C)CC[C@H](NCC)C(=O)O ae7619f15f3808255970a2eb070d8868 [0,2,0,0,0,0|1,0,0]=3 2988 B11R0.146 C=C(C)CC[C@H](NCF)C(=O)O 2ac9469362f17029809240405c1f0cb8 [0,2,0,0,0,0|2,0,0]=4 2989 B11R0.146 C=C(C)CNC(CCC)C(=O)C 869400890335f7e7e21579fc808aba94 [0,2,0,0,0,0|1,0,1]=4 2990 B11R0.146 C=C(C)CNC(CCC)C(=O)O 57240256ff5142b69354f53e0367e1bd [0,2,0,0,0,0|0,0,1]=3 2991 B11R0.146 C=C(C)CNC(CCO)C(=O)O 2f41ecdc01a8cfbb25dad3e468a600ba [0,2,0,0,0,0|1,0,1]=4 2992 B11R0.146 C=C(C)CNC(CCS)C(=O)O c4bbc9629b7dc61b88b00ab4b87e14b7 [0,2,0,0,0,0|1,0,1]=4 2993 B11R0.146 C=C(C)CNC(COC)C(=O)O 735594585ae7bc05cab240f53cace833 [0,2,0,0,0,0|1,0,1]=4 2994 B11R0.146 C=C(C)CNC(CSC)C(=O)O ee164747c2cba55898e61e21605c13a6 [0,2,0,0,0,0|1,0,1]=4 2995 B11R0.146 C=C(C)CN[C@@H](CCC)C(=O)O 0797445e7cf8a421f6ea13a587153049 [0,2,0,0,0,0|0,0,1]=3 2996 B11R0.146 C=C(C)CN[C@@H](CCO)C(=O)O e1c9e3428b55496d049cd631557f9a2b [0,2,0,0,0,0|1,0,1]=4 2997 B11R0.146 C=C(C)CN[C@@H](CCS)C(=O)O 60b1f78c8ad5a01f1981d6813a0ddf9b [0,2,0,0,0,0|1,0,1]=4 2998 B11R0.146 C=C(C)CN[C@@H](COC)C(=O)O dbad547c397eaa87af7456117b0276e2 [0,2,0,0,0,0|1,0,1]=4 2999 B11R0.146 C=C(C)CN[C@@H](CSC)C(=O)O 1e8e260553c2b83aed907108ee4eb70f [0,2,0,0,0,0|1,0,1]=4 3000 B11R0.146 C=C(C)CN[C@H](CCC)C(=O)O 9f2fc8da74e19d249edba0cc7445cc2d [0,2,0,0,0,0|0,0,1]=3 3001 B11R0.146 C=C(C)CN[C@H](CCO)C(=O)O a61b74e3a4dd66c88d3bfcba552f59bd [0,2,0,0,0,0|1,0,1]=4 3002 B11R0.146 C=C(C)CN[C@H](CCS)C(=O)O 61b6e68c92f73cf1eb72649c96aae674 [0,2,0,0,0,0|1,0,1]=4 3003 B11R0.146 C=C(C)CN[C@H](COC)C(=O)O 66b9dca5081dff3f43bd93d77d609d1b [0,2,0,0,0,0|1,0,1]=4 3004 B11R0.146 C=C(C)CN[C@H](CSC)C(=O)O 7fa073a060d750315d33da934e411e5f [0,2,0,0,0,0|1,0,1]=4 3005 B11R0.146 C=C(C)COC(CCC)C(=O)C 0c8b1c6ec8369b3069ce74377c7dacfa [0,2,0,0,0,0|1,0,1]=4 3006 B11R0.146 C=C(C)COC(CCC)C(=O)N c8188032b2f11e3b841b964c377974d8 [0,2,0,0,0,0|1,0,1]=4 3007 B11R0.146 C=C(C)COC(CCC)C(=O)O 2886bfaa7c0e3fb08327176d4b00da4c [0,2,0,0,0,0|0,0,1]=3 3008 B11R0.146 C=C(C)COC(COC)C(=O)O 255fd0ecd2e20ae15fdbd7fe1b9d2b76 [0,2,0,0,0,0|1,0,1]=4 3009 B11R0.146 C=C(C)COC(CSC)C(=O)O aa30d5745e03083d4bbc620c1f2c5f35 [0,2,0,0,0,0|1,0,1]=4 3010 B11R0.146 C=C(C)CO[C@@H](CCC)C(=O)O 379817583cfaede515674fdcc2f8ecf5 [0,2,0,0,0,0|0,0,1]=3 3011 B11R0.146 C=C(C)CO[C@H](CCC)C(=O)O c1e61532674185cca72472e6a29dfc50 [0,2,0,0,0,0|0,0,1]=3 3012 B11R0.146 C=C(Cl)CNC(CCC)C(=O)O a46cfd791912fec9d79314aad840a217 [0,2,0,0,0,0|0,0,2]=4 3013 B11R0.146 C=C(Cl)CN[C@@H](CCC)C(=O)O 4320cadd3b88e04ea619ddc92c633a24 [0,2,0,0,0,0|0,0,2]=4 3014 B11R0.146 C=C(Cl)CN[C@H](CCC)C(=O)O ef68c21ff4ca470cea862c6944e1b7e0 [0,2,0,0,0,0|0,0,2]=4 3015 B11R0.146 C=C(Cl)COC(CCC)C(=O)O 16cb4ff5b2645f90c8042f16fdbf000b [0,2,0,0,0,0|0,0,2]=4 3016 B11R0.146 C=C(Cl)CO[C@@H](CCC)C(=O)O 0b77c6c357f8038aebe8fc7d245df8fe [0,2,0,0,0,0|0,0,2]=4 3017 B11R0.146 C=C(Cl)CO[C@H](CCC)C(=O)O db028bd8d9032ca9ecbad3b1757b5adf [0,2,0,0,0,0|0,0,2]=4 3018 B11R0.146 C=C(F)CNC(CCC)C(=O)O ac1705adb2ac6ad8c0df747240219f8f [0,2,0,0,0,0|0,0,2]=4 3019 B11R0.146 C=C(F)CN[C@@H](CCC)C(=O)O 2e33654e80d57426f80bb98af2a2b195 [0,2,0,0,0,0|0,0,2]=4 3020 B11R0.146 C=C(F)CN[C@H](CCC)C(=O)O 17d1b51628405152c491fe8b8f1d8da5 [0,2,0,0,0,0|0,0,2]=4 3021 B11R0.146 C=C(F)COC(CCC)C(=O)O fec3575e8b93cd73e6de8c7a0d673c3e [0,2,0,0,0,0|0,0,2]=4 3022 B11R0.146 C=C(F)CO[C@@H](CCC)C(=O)O 90392b7dc084cf040e39d9be0de08bb8 [0,2,0,0,0,0|0,0,2]=4 3023 B11R0.146 C=C(F)CO[C@H](CCC)C(=O)O 5070bbb2f50c07a35166a088454ff8df [0,2,0,0,0,0|0,0,2]=4 3024 B11R0.146 C=CCC(NCC(C)C)C(=O)O f454fbe483695784b3288a48f7941d14 [0,2,0,0,0,0|0,0,2]=4 3025 B11R0.146 C=CCC(NCC(C)O)C(=O)O d623995a3753c0436cce801b0b0cd38c [0,2,0,0,0,0|0,0,2]=4 3026 B11R0.146 C=CCC(NC[C@@H](C)O)C(=O)O 4356733f2b75b3593df8a9c4d8518d4e [0,2,0,0,0,0|0,0,2]=4 3027 B11R0.146 C=CCC(NC[C@H](C)O)C(=O)O 7907d19043943f27f6d03b2a6f37b78e [0,2,0,0,0,0|0,0,2]=4 3028 B11R0.146 C=CC[C@@H](NCC(C)C)C(=O)O d520e70b5ab564501605294f28e88df2 [0,2,0,0,0,0|0,0,2]=4 3029 B11R0.146 C=CC[C@@H](NCC(C)O)C(=O)O 5044e1094aeb644a61f32b2beab263b4 [0,2,0,0,0,0|0,0,2]=4 3030 B11R0.146 C=CC[C@@H](NC[C@@H](C)O)C(=O)O 32599a7205b88dcecc191b8bf59623e2 [0,2,0,0,0,0|0,0,2]=4 3031 B11R0.146 C=CC[C@@H](NC[C@H](C)O)C(=O)O 63bec6cb9641020bc1e0145c5b4da857 [0,2,0,0,0,0|0,0,2]=4 3032 B11R0.146 C=CC[C@H](NCC(C)C)C(=O)O 5689603c8b3fd071758885ed5491d839 [0,2,0,0,0,0|0,0,2]=4 3033 B11R0.146 C=CC[C@H](NCC(C)O)C(=O)O 92e70ebbd059651769238ae4878243e0 [0,2,0,0,0,0|0,0,2]=4 3034 B11R0.146 C=CC[C@H](NC[C@@H](C)O)C(=O)O 2efc523651eafdc72a562474aa6a158b [0,2,0,0,0,0|0,0,2]=4 3035 B11R0.146 C=CC[C@H](NC[C@H](C)O)C(=O)O ffc3b0c1911f968bec8cdef1e0b7e138 [0,2,0,0,0,0|0,0,2]=4 3036 B11R0.146 CC(=O)C(CCO)NCC(C)C fc0da1217a10297ad776e51f17e92136 [0,2,0,0,0,0|2,0,0]=4 3037 B11R0.146 CC(=O)C(CCO)NCC(C)O e96c57b4c2ad594f6fabaa1fded6b68f [0,2,0,0,0,0|2,0,0]=4 3038 B11R0.146 CC(=O)C(CCO)NC[C@@H](C)O 16053221522d9e10cdb5333212de9ff5 [0,2,0,0,0,0|2,0,0]=4 3039 B11R0.146 CC(=O)C(CCO)NC[C@H](C)O c0f9c1dcda300dd712a007f69b7fd90e [0,2,0,0,0,0|2,0,0]=4 3040 B11R0.146 CC(C)CCC(NCF)C(=O)O 767ac81f62bd5968cb4668678abc1c5b [0,2,0,0,0,0|2,0,0]=4 3041 B11R0.146 CC(C)CC[C@@H](NCF)C(=O)O 94da594cff832960948ffe026489728d [0,2,0,0,0,0|2,0,0]=4 3042 B11R0.146 CC(C)CC[C@@H](OCF)C(=O)O 1789a70ef1af1f232ee5c77d523ff02e [0,2,0,0,0,0|2,0,0]=4 3043 B11R0.146 CC(C)CC[C@H](NCF)C(=O)O 25a19fa8fc96af6f183c1c29a4201e5b [0,2,0,0,0,0|2,0,0]=4 3044 B11R0.146 CC(C)CC[C@H](OCF)C(=O)O 253c26bae69d65166d70c24582028a5f [0,2,0,0,0,0|2,0,0]=4 3045 B11R0.146 CC(C)CNC(CC#N)C(=O)O 2e81ce3a1aa01d74732a4c492e220bd7 [0,2,0,0,0,0|1,0,1]=4 3046 B11R0.146 CC(C)CNC(CCO)C(=O)O 977d43a48a57d066528e74ba388db694 [0,2,0,0,0,0|1,0,0]=3 3047 B11R0.146 CC(C)CNC(CCS)C(=O)O 1c5e21bec0a1b541e9b234b20a00557f [0,2,0,0,0,0|1,0,0]=3 3048 B11R0.146 CC(C)CN[C@@H](CC#N)C(=O)O 8bdc46c735528807073db5bff9bdd38c [0,2,0,0,0,0|1,0,1]=4 3049 B11R0.146 CC(C)CN[C@@H](CCO)C(=O)O b962d2a06901dad634f19163a0dff282 [0,2,0,0,0,0|1,0,0]=3 3050 B11R0.146 CC(C)CN[C@@H](CCS)C(=O)O ecfac63927e22420e6fb31a6725b63e7 [0,2,0,0,0,0|1,0,0]=3 3051 B11R0.146 CC(C)CN[C@H](CCO)C(=O)O 0a805641481657bdded1b54f49f4dbe7 [0,2,0,0,0,0|1,0,0]=3 3052 B11R0.146 CC(C)CN[C@H](CCS)C(=O)O 3e2b0aefd9921c92cec8ed7eb0e601f8 [0,2,0,0,0,0|1,0,0]=3 3053 B11R0.146 CC(O)CNC(CC#N)C(=O)O b491f6c974b939d344960961b2cd6e04 [0,2,0,0,0,0|1,0,1]=4 3054 B11R0.146 CC(O)CNC(CCO)C(=O)O e09b5902e4c586075df19cab0ab6aa7e [0,2,0,0,0,0|1,0,0]=3 3055 B11R0.146 CC(O)CNC(CCS)C(=O)O e59640fb7fb3db968f2018b95fb59750 [0,2,0,0,0,0|1,0,0]=3 3056 B11R0.146 CC(O)CN[C@@H](CC#N)C(=O)O 497cf3aaf7a14793b5046884c772fcf6 [0,2,0,0,0,0|1,0,1]=4 3057 B11R0.146 CC(O)CN[C@@H](CCO)C(=O)O 711a3489a55799381aceb5fb8558e49b [0,2,0,0,0,0|1,0,0]=3 3058 B11R0.146 CC(O)CN[C@@H](CCS)C(=O)O ecc0a846c1dce394f066133490208e22 [0,2,0,0,0,0|1,0,0]=3 3059 B11R0.146 CC(O)CN[C@H](CCO)C(=O)O 48be551ca26d75568d095dde7f7ae974 [0,2,0,0,0,0|1,0,0]=3 3060 B11R0.146 CC(O)CN[C@H](CCS)C(=O)O 78bc5b7035a40b013babb9fe4378f1c1 [0,2,0,0,0,0|1,0,0]=3 3061 B11R0.146 CCCC(CNC(C)C)C(=O)O dfa1bf7238303c3631b5bb816333bbf6 [0,2,0,0,0,0|0,0,0]=2 3062 B11R0.146 CCCC(NCC(=O)C)C(=O)C ab57f64ec578d52bbb5f9d473fc650ca [0,2,0,0,0,0|1,0,1]=4 3063 B11R0.146 CCCC(NCC(=O)N)C(=O)O e87a1a06288934495398fe19b0bb71c8 [0,2,0,0,0,0|1,0,1]=4 3064 B11R0.146 CCCC(NCC(=O)O)C(=O)O 310c4fcc0b7d098e7b467bd5fc9014cc [0,2,0,0,0,0|1,0,1]=4 3065 B11R0.146 CCCC(NCC(C)C)C(=O)C f06b28ff0ecc6a5d00925575f4e3a6f8 [0,2,0,0,0,0|1,0,0]=3 3066 B11R0.146 CCCC(NCC(C)C)C(=O)O 931b2903669a6431fa203852a684b40f [0,2,0,0,0,0|0,0,0]=2 3067 B11R0.146 CCCC(NCC(C)O)C(=O)C 3af81af91ef44ec790803947f0a7e2fc [0,2,0,0,0,0|1,0,0]=3 3068 B11R0.146 CCCC(NCC(C)O)C(=O)O 490e5cf938264c8a77b5a05699690ee3 [0,2,0,0,0,0|0,0,0]=2 3069 B11R0.146 CCCC(NCC(F)F)C(=O)C 6fc9a04eac1d7579494ccd1c26f041ae [0,2,0,0,0,0|2,0,0]=4 3070 B11R0.146 CCCC(NCC(F)F)C(=O)O 53789302bde675b8861ee7dded11259f [0,2,0,0,0,0|1,0,0]=3 3071 B11R0.146 CCCC(NCN(C)C)C(=O)O f3b7fd15c06b7b4a22d08ae88d15ddaf [0,2,0,0,0,0|1,0,0]=3 3072 B11R0.146 CCCC(NC[C@@H](C)O)C(=O)C d39a48a87f372f9b3b5663b67e0f2669 [0,2,0,0,0,0|1,0,0]=3 3073 B11R0.146 CCCC(NC[C@@H](C)O)C(=O)O f5d897c6bdf9d55d1b4c54c7855db1b7 [0,2,0,0,0,0|0,0,0]=2 3074 B11R0.146 CCCC(NC[C@H](C)O)C(=O)C 8d1a8e8ea11c22c8a22324b478910f33 [0,2,0,0,0,0|1,0,0]=3 3075 B11R0.146 CCCC(NC[C@H](C)O)C(=O)O 3651d08eb4034d9f4947efa20de1798a [0,2,0,0,0,0|0,0,0]=2 3076 B11R0.146 CCCC(NC[N+](=O)[O-])C(=O)O eb482ff10f11455c6a5e72e57bebe4d3 [0,2,0,0,0,0|2,0,0]=4 3077 B11R0.146 CCCC(OCC(=O)C)C(=O)C 48beb34b469cae26472e38a0a5152863 [0,2,0,0,0,0|1,0,1]=4 3078 B11R0.146 CCCC(OCC(=O)N)C(=O)O 41315bee4bcfe77abdd3d51bfc68e349 [0,2,0,0,0,0|1,0,1]=4 3079 B11R0.146 CCCC(OCC(=O)O)C(=O)O 2b91728c16707a446fa824da0fe83053 [0,2,0,0,0,0|1,0,1]=4 3080 B11R0.146 CCCC(OCC(C)C)C(=O)C fccad9ffcd85c286a28688df3b950d65 [0,2,0,0,0,0|1,0,0]=3 3081 B11R0.146 CCCC(OCC(C)C)C(=O)N ed81b1252a43d33b17a63fad752638d0 [0,2,0,0,0,0|1,0,0]=3 3082 B11R0.146 CCCC(OCC(C)C)C(=O)O f34a3fd83b51d29ede61c3fce980504f [0,2,0,0,0,0|0,0,0]=2 3083 B11R0.146 CCCC(OCC(C)F)C(=O)C 14a5b4683f55c40082515767fad299d9 [0,2,0,0,0,0|1,0,0]=3 3084 B11R0.146 CCCC(OCC(C)S)C(=O)C 18df4306f193a3ab0511d2d00b64ea68 [0,2,0,0,0,0|1,0,0]=3 3085 B11R0.146 CCCC(OCC(F)F)C(=O)C fb5e8ce39563db86b1dacffa49eae2bb [0,2,0,0,0,0|2,0,0]=4 3086 B11R0.146 CCCC(OCC(F)F)C(=O)N afabf8967bf01e5e52490e4de5a0f9c9 [0,2,0,0,0,0|2,0,0]=4 3087 B11R0.146 CCCC(OCC(F)F)C(=O)O e6f813441a38ade8cb3625239fe98258 [0,2,0,0,0,0|1,0,0]=3 3088 B11R0.146 CCCC(OCN(C)C)C(=O)N de259d3582546b59133475b34e2bf9e8 [0,2,0,0,0,0|2,0,0]=4 3089 B11R0.146 CCCC(OCN(C)C)C(=O)O 7cbbe51a69238c54de7a2513c359bda4 [0,2,0,0,0,0|1,0,0]=3 3090 B11R0.146 CCCC(OC[C@@H](C)F)C(=O)C c2ab7b1bfbe48c219d01825b3b203ab1 [0,2,0,0,0,0|1,0,0]=3 3091 B11R0.146 CCCC(OC[C@H](C)F)C(=O)C e5d137534338ae385c1b5c8d07c33ddc [0,2,0,0,0,0|1,0,0]=3 3092 B11R0.146 CCCC(OC[N+](=O)[O-])C(=O)O d34e068a3eae30a4c5548fc7866973bd [0,2,0,0,0,0|2,0,0]=4 3093 B11R0.146 CCCN(CCN(C)C)C(=O)C 41c177988485c5e5dd3e819ae023b25a [0,2,0,0,0,0|2,0,0]=4 3094 B11R0.146 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C#CCN[C@@](C)(CCC)C(=O)O 25cf0d820c554de9bddb48128ba0b159 [0,2,0,0,0,0|0,0,2]=4 3231 B11R0.217 C#CCN[C@](C)(CCC)C(=O)O b66c887f27d82af867327b05756ee0a8 [0,2,0,0,0,0|0,0,2]=4 3232 B11R0.217 C#CC[C@](C)(NCCC)C(=O)O 196fa1822eff22dcc720e5876f20292b [0,2,0,0,0,0|0,0,2]=4 3233 B11R0.217 C=CCC(C)(NCCC)C(=O)O 72ff748edbdad7d3bab96f88f9e4c6d2 [0,2,0,0,0,0|0,0,2]=4 3234 B11R0.217 C=CCNC(C)(CCC)C(=O)O 3f0c59e6a64257db20cb9831ffa39168 [0,2,0,0,0,0|0,0,2]=4 3235 B11R0.217 C=CCN[C@@](C)(CCC)C(=O)O def4cc2a3804dfceb8db808a759e3bb3 [0,2,0,0,0,0|0,0,2]=4 3236 B11R0.217 C=CCN[C@](C)(CCC)C(=O)O f91c4297f4a146612206cf7beac3d002 [0,2,0,0,0,0|0,0,2]=4 3237 B11R0.217 C=CC[C@@](C)(NCCC)C(=O)O b86c68a54eaaadca3f8e3fb62b70f7b3 [0,2,0,0,0,0|0,0,2]=4 3238 B11R0.217 C=CC[C@](C)(NCCC)C(=O)O b2f2ea0393014453e4029524df269fba [0,2,0,0,0,0|0,0,2]=4 3239 B11R0.217 CCCC(C)(NCC#N)C(=O)O 053a5ae28ad1c234014f33294513c6b1 [0,2,0,0,0,0|1,0,1]=4 3240 B11R0.217 CCCC(C)(NCC=O)C(=O)O 9baecd90e79842d277ebd95647e9075b 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B11R0.217 CCC[C@](C)(NCSC)C(=O)O 0db8673715e56aacf4db734184fe1009 [0,2,0,0,0,0|1,0,0]=3 3263 B11R0.217 CCN[C@@](C)(CCSC)C(=O)O a0223d300e083546b2cb8e40c2038c6f [0,2,0,0,0,0|1,0,0]=3 3264 B11R0.217 CSCC[C@](C)(NCF)C(=O)O 56b2eae6cf82e3dcc4fa6503aa87b829 [0,2,0,0,0,0|2,0,0]=4 3265 B11R0.217 CSCC[C@](C)(NCO)C(=O)O a9b4a58e3617485e34808400ef568e3e [0,2,0,0,0,0|2,0,0]=4 3266 B9R1.33 CCNC1CCNC1=O 7ca8029da61d3d4038e53b166243ebeb [1,0,0,1,0,0|2,0,0]=4 3267 B9R1.33 CCNC1CCSC1=O b170125bf493751e42532dd86c219256 [1,0,0,1,0,0|1,1,0]=4 3268 B9R1.33 CCN[C@@H]1CCNC1=O b778b480924bfa692e02248b56fb56cd [1,0,0,1,0,0|2,0,0]=4 3269 B9R1.33 CCN[C@@H]1CCOC1=O 74b3897799f45738d0bb44924384c10e [1,0,0,1,0,0|1,0,0]=3 3270 B9R1.33 CCN[C@H]1CCNC1=O 659170641ab39dc9cbd8871033438dcc [1,0,0,1,0,0|2,0,0]=4 3271 B9R1.33 CCN[C@H]1CCOC1=O 5ec21f69d9ce47df74aa6d4e2b7c83d0 [1,0,0,1,0,0|1,0,0]=3 3272 B9R1.33 CCOC1CCCC1=O 19fd59f8b378305519536cfc5c950157 [1,0,0,1,0,0|2,0,0]=4 3273 B9R1.33 CCOC1CCNC1=O 8fdacff95d4ce2d1c3d495fa66f75dd5 [1,0,0,1,0,0|2,0,0]=4 3274 B9R1.33 CCO[C@@H]1CCNC1=O d615de1523fb9db14752de0db1c501b4 [1,0,0,1,0,0|2,0,0]=4 3275 B9R1.33 CCO[C@H]1CCNC1=O 5eaae9c583183b85f65e479b22e5ff87 [1,0,0,1,0,0|2,0,0]=4 3276 B9R1.33 O=C1OCCC1OCF b85388f82f2377d14f86f51a66ceceb4 [1,0,0,1,0,0|2,0,0]=4 3277 B9R1.33 O=C1OCC[C@@H]1NCF e1dd4e315ccdd3ee423490069e903050 [1,0,0,1,0,0|2,0,0]=4 3278 B9R1.33 O=C1OCC[C@@H]1NCO fd71f95ebb01bbdbbb2ef25d589937b3 [1,0,0,1,0,0|2,0,0]=4 3279 B9R1.33 O=C1OCC[C@@H]1OCF 04d97e9b330871c6652fe82ab6503f03 [1,0,0,1,0,0|2,0,0]=4 3280 B9R1.33 O=C1OCC[C@H]1NCF f31145c15fd3ca3d3a6551d0366095af [1,0,0,1,0,0|2,0,0]=4 3281 B9R1.33 O=C1OCC[C@H]1NCO e4d04d631c6f331f98f78546df6deaf9 [1,0,0,1,0,0|2,0,0]=4 3282 B9R1.33 O=C1OCC[C@H]1OCF 120575dbb395d8d5ab73f91874f52789 [1,0,0,1,0,0|2,0,0]=4 3283 B9R1.35 CC(=O)N1CCC(C1)C 62fae45163ab5fc8df8ad46633eee0ac [1,0,0,1,0,0|2,0,0]=4 3284 B9R1.41 CC(=O)N1CCCC1C f3ed72e102a18b3ca7365fff10aeb6f8 [1,0,0,1,0,0|2,0,0]=4 3285 B9R1.41 CC(=O)N1CCC[C@@H]1C 45c9778b44581f9933633398df3c02d2 [1,0,0,1,0,0|2,0,0]=4 3286 B9R1.41 CC(=O)N1CCC[C@H]1C 77e41bde24aa3c51a340cfebe6f455b1 [1,0,0,1,0,0|2,0,0]=4 3287 B9R1.96 CCC1CCN1C(=O)C f8a8c2660e185a53a38bd009b5fd9a1e [1,0,0,1,0,0|2,0,0]=4 3288 B9R1.96 CCN1CCC1C(=O)N 1cfe5ebf987ecebafa868cbdeb4b7422 [1,0,0,1,0,0|2,0,0]=4 3289 B9R1.96 CCN1CCC1C(=O)O ca0bbfd670281167636f7e4dd4cc56bf [1,0,0,1,0,0|1,0,0]=3 3290 B9R1.96 CCN1CC[C@@H]1C(=O)N d26915c9d0e6ed65803bfdf786a1b1ce [1,0,0,1,0,0|2,0,0]=4 3291 B9R1.96 CCN1CC[C@@H]1C(=O)O e809f9b39a76e5f73ee720d520f2d8da [1,0,0,1,0,0|1,0,0]=3 3292 B9R1.96 CCN1CC[C@H]1C(=O)N 32f8eb51fb894d3b554c30dd0433e814 [1,0,0,1,0,0|2,0,0]=4 3293 B9R1.96 CCN1CC[C@H]1C(=O)O 90d4ef3b77b2d2edfd444739e71a1146 [1,0,0,1,0,0|1,0,0]=3 3294 B9R1.96 O=C(O)C1CCN1CF a73c50a5747fbf1c9dcb89ff140eef56 [1,0,0,1,0,0|2,0,0]=4 3295 B9R1.96 O=C(O)C1CCN1CO dcd47fec92d7cd22c146c2f982367c0e [1,0,0,1,0,0|2,0,0]=4 3296 B9R1.96 O=C(O)[C@@H]1CCN1CF 33bf6032edb12ba6e0c6af4b3ab637c5 [1,0,0,1,0,0|2,0,0]=4 3297 B9R1.96 O=C(O)[C@@H]1CCN1CO 2d3df4b77e74f2ed1add2f1fa0f35f44 [1,0,0,1,0,0|2,0,0]=4 3298 B9R1.96 O=C(O)[C@H]1CCN1CF 732a43f42ed58b977b82331718d13123 [1,0,0,1,0,0|2,0,0]=4 3299 B9R1.96 O=C(O)[C@H]1CCN1CO 49245c491708831bcf451e59d5634aff [1,0,0,1,0,0|2,0,0]=4 3300 B9R1.116 CCN(C(=O)C)C1CC1 adf3bae0c69d176b44948d48f82bf8cc [1,0,0,1,0,0|2,0,0]=4 3301 B9R1.179 CCNC1(CC1)C(=O)N e593d1881c6d607250b3c7550aeff4fd [1,0,0,1,0,0|2,0,0]=4 3302 B9R1.179 CCNC1(CC1)C(=O)O 1cafb4c96edddb896ab28b54eff680f2 [1,0,0,1,0,0|1,0,0]=3 3303 B9R1.179 O=C(O)C1(CC1)NCF b533b440962bae39cc6c8a18b2abc8df [1,0,0,1,0,0|2,0,0]=4 3304 B9R1.179 O=C(O)C1(CC1)NCO af15281f3dcfcc5aef6f47c67b1bcbcb [1,0,0,1,0,0|2,0,0]=4 3305 B9R1.2 CC1CCCN(C1)C=O 5a06aa6b42e18f18aee9823269dae409 [1,0,0,1,0,0|1,0,0]=3 3306 B9R1.2 CC1CCCN(C1)CO 26652d230bcc9a1195d63435a97c512d [1,0,0,1,0,0|1,0,1]=4 3307 B9R1.2 CC1CN(CCO1)C=O 419911434d41e805d16780cbe76cce9d [1,0,0,1,0,0|2,0,0]=4 3308 B9R1.2 C[C@@H]1CCCN(C1)C=O b5e680c9235a8f69b3718f41b577e428 [1,0,0,1,0,0|1,0,0]=3 3309 B9R1.2 C[C@@H]1CCCN(C1)CO 6675ecf83c8b49544e3561e3282b0e83 [1,0,0,1,0,0|1,0,1]=4 3310 B9R1.2 C[C@@H]1CN(CCO1)C=O b5db532eab9a99bf3ba15375dd3b6f02 [1,0,0,1,0,0|2,0,0]=4 3311 B9R1.2 C[C@H]1CCCN(C1)C=O 4dab749a75683c45748ebdcac3ae2c8b [1,0,0,1,0,0|1,0,0]=3 3312 B9R1.2 C[C@H]1CCCN(C1)CO 612f7806a77df61f3b60bf95e73ba9e6 [1,0,0,1,0,0|1,0,1]=4 3313 B9R1.2 C[C@H]1CN(CCO1)C=O df29ae4feffabe0da5bd47bb2c69d059 [1,0,0,1,0,0|2,0,0]=4 3314 B9R1.2 O=CN1CCCC(C1)F 04917882399611fcb80fb86df59a89e2 [1,0,0,1,0,0|2,0,0]=4 3315 B9R1.2 O=CN1CCCC(C1)O 0df930667a84d8d3d91a613bfd57f133 [1,0,0,1,0,0|2,0,0]=4 3316 B9R1.2 O=CN1CCC[C@@H](C1)F 8bf0e6ef9ed8e1b7cb36e4499af92a58 [1,0,0,1,0,0|2,0,0]=4 3317 B9R1.2 O=CN1CCC[C@@H](C1)O 50e0b44fd1f0b47772960747a9d4dc2e [1,0,0,1,0,0|2,0,0]=4 3318 B9R1.2 O=CN1CCC[C@H](C1)F ec017dd9294189577b258dfb95fb493e [1,0,0,1,0,0|2,0,0]=4 3319 B9R1.2 O=CN1CCC[C@H](C1)O 1099b25f2d4ea20dc0b6d23f3ff3e4f6 [1,0,0,1,0,0|2,0,0]=4 3320 B9R1.7 CCOC1COC(C1)C 3e91a0d24859f42f4cfd5c657a58260e [1,0,0,1,0,0|1,0,1]=4 3321 B9R1.8 CCCN1CCCOC1 f24207267ec2bfd6a98a300d3d8157f4 [1,0,0,1,0,0|1,0,1]=4 3322 B9R1.8 CCNC1C=CCCC1 381b66b498fdea5c28ca09d8304c5d3a [1,0,0,1,0,0|2,0,0]=4 3323 B9R1.8 CCNC1CCCOC1 44e7a9c60ab74c80ef1160380a9b9fb7 [1,0,0,1,0,0|1,0,1]=4 3324 B9R1.8 CCN[C@@H]1CCCOC1 6c80b60090682b5fd207bb8d7a62fd53 [1,0,0,1,0,0|1,0,1]=4 3325 B9R1.8 CCN[C@H]1CCCOC1 e5738a32ab8207497f49a57ad67aa158 [1,0,0,1,0,0|1,0,1]=4 3326 B9R1.8 CCOC1C=CCCC1 7b09c8f3de0d6e6b8ab9978bfcb2c07e [1,0,0,1,0,0|2,0,0]=4 3327 B9R1.8 CCOC1CCCOC1 28e0b80b41504c5ce6342a42ff1482ae [1,0,0,1,0,0|1,0,1]=4 3328 B9R1.8 CCO[C@@H]1CCCOC1 e2635ce7ad18ae3f1004b0745c859319 [1,0,0,1,0,0|1,0,1]=4 3329 B9R1.8 CCO[C@H]1CCCOC1 bd7b8624ac6ebefc862948904b1aa0ec [1,0,0,1,0,0|1,0,1]=4 3330 B9R1.14 CCC1CCCN1C=O 9bfd3104fb9bd3ec80e56f7f40a87d09 [1,0,0,1,0,0|1,0,0]=3 3331 B9R1.14 CCC1CCCN1CO c6b0552297ecd81b340673988242e49e [1,0,0,1,0,0|1,0,1]=4 3332 B9R1.14 CCN1CCCC1CO 4cc70a524b6a49ae6ff776db26f663d6 [1,0,0,1,0,0|1,0,1]=4 3333 B9R1.14 CCN1CCC[C@@H]1CO 06f5f2fca38eb9626faec3727a8f59e6 [1,0,0,1,0,0|1,0,1]=4 3334 B9R1.14 CCN1CCC[C@H]1CO e5330ba4d388a8e39b15a149c876b607 [1,0,0,1,0,0|1,0,1]=4 3335 B9R1.14 CC[C@@H]1CCCN1C=O da9d0e05329f820d63cc29621bd7430d [1,0,0,1,0,0|1,0,0]=3 3336 B9R1.14 CC[C@@H]1CCCN1CO 79102ed9add4e6c642219a59503e87a6 [1,0,0,1,0,0|1,0,1]=4 3337 B9R1.14 COC1CCCN1C=O 8aa7b22777bc471212d982f27b92f5fd [1,0,0,1,0,0|2,0,0]=4 3338 B9R1.14 O=CN1CCCC1CO 75b12ffa9bd2f35acc3b984d4ad2e6f7 [1,0,0,1,0,0|2,0,0]=4 3339 B9R1.14 O=CN1CCC[C@@H]1CF 45884ece6cccc8922acf889d282db837 [1,0,0,1,0,0|2,0,0]=4 3340 B9R1.14 O=CN1CCC[C@@H]1CO b2e4d0ee0a911eac6a5bfd92181e1f8a [1,0,0,1,0,0|2,0,0]=4 3341 B9R1.14 O=CN1CCC[C@H]1CF efa94b1e9832aaf370863a6f8233628a [1,0,0,1,0,0|2,0,0]=4 3342 B9R1.14 O=CN1CCC[C@H]1CO 6edb00daf504246f581ca4815eae2e10 [1,0,0,1,0,0|2,0,0]=4 3343 B9R1.23 CC1CN(CC1O)C=O e5049aa63a8e06f5e219ee239354308d [1,0,0,1,0,0|2,0,0]=4 3344 B9R1.23 C[C@@H]1CN(C[C@@H]1O)C=O 96d5c42bedcd59c76259b00312f00664 [1,0,0,1,0,0|2,0,0]=4 3345 B9R1.89 O=CN1CCCCCC1 4a543573026aecbb7f088b43cea970d5 [1,0,0,1,0,0|1,0,0]=3 3346 B9R1.89 O=CN1CCCOCC1 ac69421f50e86b391ee77e2bd7abf564 [1,0,0,1,0,0|2,0,0]=4 3347 B9R1.89 OCN1CCCCCC1 62c49bb1745f5c0f3dee14a3d4e5f5d5 [1,0,0,1,0,0|1,0,1]=4 3348 B9R1.175 CCNC1(CCC1)CO 7938d0b4dbabeb7c50e27bfa4062f3da [1,0,0,1,0,0|1,0,1]=4 3349 B11R1.34 CCCN1CC(=O)NC(C1)C 0ce434795abc8ce5f131f8f2870f476e [0,0,0,1,0,1|2,0,0]=4 3350 B11R1.34 CCCN1CC(=O)N[C@@H](C1)C ea67f3e6133b2791f7bfdbcc4696c9c8 [0,0,0,1,0,1|2,0,0]=4 3351 B11R1.34 CCCN1CC(=O)N[C@H](C1)C 0cbed5741f98a05fb34af427ec09ce68 [0,0,0,1,0,1|2,0,0]=4 3352 B11R1.34 CCOC1=CC(=O)O[C@@H](C1)C 85e2ce6765c04e646c177cb38cdb6f01 [0,0,0,1,0,1|1,0,1]=4 3353 B11R1.57 CC(=O)N[C@H]1CCC[C@H]1CO a01a5b4ecb6f8524b3e56b92ecdec507 [0,0,0,1,0,1|2,0,0]=4 3354 B11R1.57 CCC1CCCN1CC(=O)N c185fb22daa4500a714a8bda72f3f491 [0,0,0,1,0,1|2,0,0]=4 3355 B11R1.57 CCC1CCCN1CC(=O)O c31ac8bd4b3eeed7b5beb09db1545ade [0,0,0,1,0,1|1,0,0]=3 3356 B11R1.57 CCN1CCCC1CC(=O)O 8035896eb0b4ccf9532ccab0532ab2dc [0,0,0,1,0,1|1,0,0]=3 3357 B11R1.57 CCN1CCC[C@@H]1CC(=O)O 078da1d03ae15c1dbe297412c6b8c765 [0,0,0,1,0,1|1,0,0]=3 3358 B11R1.57 CCN1CCC[C@H]1CC(=O)O e31ed026b01212112bf4b9b75bdf0a78 [0,0,0,1,0,1|1,0,0]=3 3359 B11R1.57 CC[C@@H]1CCCN1CC(=O)N f3ff600658ba91efc1a54dbee891c810 [0,0,0,1,0,1|2,0,0]=4 3360 B11R1.57 CC[C@@H]1CCCN1CC(=O)O fcbfc0397f95ebb582b031ed6c75b8f9 [0,0,0,1,0,1|1,0,0]=3 3361 B11R1.57 CC[C@@H]1CCC[C@H]1NC(=O)C 3e0e1d15d776c3dcd038aea6de3e4dfb [0,0,0,1,0,1|1,0,0]=3 3362 B11R1.57 COC1CCCC1NC(=O)C 8da7fbc7ec54ef4f28a2ee6769a7a8cf [0,0,0,1,0,1|2,0,0]=4 3363 B11R1.57 COC1CCCN1CC(=O)O b53221ba908aeb459ede6db241de034a [0,0,0,1,0,1|2,0,0]=4 3364 B11R1.57 CO[C@@H]1CCC[C@@H]1NC(=O)C 38043d3afc7f72488101da25572db660 [0,0,0,1,0,1|2,0,0]=4 3365 B11R1.57 CO[C@@H]1CCC[C@H]1NC(=O)C 4db371906024f4bac2c8b094a6772760 [0,0,0,1,0,1|2,0,0]=4 3366 B11R1.57 CO[C@H]1CCC[C@@H]1NC(=O)C 4d51e586caacf78fcf1ab76d6db4a3ed [0,0,0,1,0,1|2,0,0]=4 3367 B11R1.57 O=C(O)CC1CCCN1CF 3a287768ef1b7da7171a674ab376bf68 [0,0,0,1,0,1|2,0,0]=4 3368 B11R1.57 O=C(O)CC1CCCN1CO 78657bf49c2c1b688e1cc7669dba9593 [0,0,0,1,0,1|2,0,0]=4 3369 B11R1.57 O=C(O)CN1CCCC1CO 18fd863028aad275999bc40f6d591e61 [0,0,0,1,0,1|2,0,0]=4 3370 B11R1.57 O=C(O)CN1CCC[C@@H]1CF 263fe6a95009679abd398b22b26de003 [0,0,0,1,0,1|2,0,0]=4 3371 B11R1.57 O=C(O)CN1CCC[C@@H]1CO c0e96541a04d6ea32d8c88e1d4d3476d [0,0,0,1,0,1|2,0,0]=4 3372 B11R1.57 O=C(O)CN1CCC[C@H]1CF b4a8362b840c2d285203cd7edfef101f [0,0,0,1,0,1|2,0,0]=4 3373 B11R1.57 O=C(O)CN1CCC[C@H]1CO 09199b79d3f006b679a7584910181061 [0,0,0,1,0,1|2,0,0]=4 3374 B11R1.57 O=C(O)C[C@@H]1CCCN1CF 328c792f31f63a96fa9363b323d175d3 [0,0,0,1,0,1|2,0,0]=4 3375 B11R1.57 O=C(O)C[C@@H]1CCCN1CO 0e5cbe2fc4622eadc3c287c533b5b280 [0,0,0,1,0,1|2,0,0]=4 3376 B11R1.57 O=C(O)C[C@H]1CCCN1CF 616b727bab28ac72371577c1d1597e86 [0,0,0,1,0,1|2,0,0]=4 3377 B11R1.57 O=C(O)C[C@H]1CCCN1CO 73db8aa3e045ecef15245ee6b0a1259b [0,0,0,1,0,1|2,0,0]=4 3378 B11R1.80 CC(=O)N[C@@H]1C[C@@H](N(C1)C)C 82e54f0b392408781095e45187dc5c0a [0,0,0,1,0,1|2,0,0]=4 3379 B11R1.80 CC(=O)N[C@@H]1C[C@H](N(C1)C)C 2d514acfeb146db655dd0eeb2e7d7ccb [0,0,0,1,0,1|2,0,0]=4 3380 B11R1.80 CC(=O)N[C@H]1C[C@@H](N(C1)C)C 8a36eb19548e88941e7254a9368d6971 [0,0,0,1,0,1|2,0,0]=4 3381 B11R1.80 CC(=O)N[C@H]1C[C@H](N(C1)C)C e39fbe8f0bd81ae3f02d324057443e8c [0,0,0,1,0,1|2,0,0]=4 3382 B11R1.80 CC1CN(CC1O)CC(=O)O 50069c51367afc0c5f4fa2b6ae076300 [0,0,0,1,0,1|2,0,0]=4 3383 B11R1.80 C[C@@H]1CN(C[C@@H]1O)CC(=O)O 45d799423237fec4413ad0319f98e4d9 [0,0,0,1,0,1|2,0,0]=4 3384 B11R1.110 CCCN1CCCNC(=O)C1 f406ce3053c9c608ac4e8ba7b28a00e2 [0,0,0,1,0,1|2,0,0]=4 3385 B11R1.110 CCOC1CCCNC(=O)C1 826321f04ddcae70bc5b8b57f6c60b43 [0,0,0,1,0,1|2,0,0]=4 3386 B11R1.157 CC(=O)NC1CCCC(C1)C 2210d24c85aacb9ca5ad7d0be5468509 [0,0,0,1,0,1|1,0,0]=3 3387 B11R1.157 CC(=O)NC1CCCC(C1)O 967c8e42f6277b130f66885e6b186eb9 [0,0,0,1,0,1|2,0,0]=4 3388 B11R1.157 CC(=O)NC1CCCN(C1)C 34d6a502a6adfde883aef908a2ef9edd [0,0,0,1,0,1|2,0,0]=4 3389 B11R1.157 CC(=O)NC1CCOC(C1)C 0099ccc8c17d071fd81ba5664844dee7 [0,0,0,1,0,1|2,0,0]=4 3390 B11R1.157 CC(=O)N[C@@H]1CCCN(C1)C c757489c05f54677c333d5d1a5094257 [0,0,0,1,0,1|2,0,0]=4 3391 B11R1.157 CC(=O)N[C@@H]1CCC[C@@H](C1)O 036cedc2973fe4851309407026c34750 [0,0,0,1,0,1|2,0,0]=4 3392 B11R1.157 CC(=O)N[C@@H]1CCC[C@H](C1)C 71f4655f46cf4d4862a6cce1470e6ac9 [0,0,0,1,0,1|1,0,0]=3 3393 B11R1.157 CC(=O)N[C@@H]1CCC[C@H](C1)O 133d6afedfa5f62b0664ee93a2cd1962 [0,0,0,1,0,1|2,0,0]=4 3394 B11R1.157 CC(=O)N[C@@H]1CCO[C@@H](C1)C 522cc936fcd44ff7fe6fb47e9d0d3554 [0,0,0,1,0,1|2,0,0]=4 3395 B11R1.157 CC(=O)N[C@@H]1CCO[C@H](C1)C d0134359fa0892a6ae31761566406572 [0,0,0,1,0,1|2,0,0]=4 3396 B11R1.157 CC(=O)N[C@H]1CCCN(C1)C 7e2c23441263993d81fce59ecbac3164 [0,0,0,1,0,1|2,0,0]=4 3397 B11R1.157 CC(=O)N[C@H]1CCC[C@@H](C1)O 292207cd518c12ebcc52dfe886a419f2 [0,0,0,1,0,1|2,0,0]=4 3398 B11R1.157 CC(=O)N[C@H]1CCC[C@H](C1)O 39171aab208d3c96c4e74e0e531fdbfd [0,0,0,1,0,1|2,0,0]=4 3399 B11R1.157 CC(=O)N[C@H]1CCO[C@@H](C1)C 1282e3b2a5bbe38d539f7f9cb6e56cf1 [0,0,0,1,0,1|2,0,0]=4 3400 B11R1.157 CC(=O)N[C@H]1CCO[C@H](C1)C 86b839821b0a6c40bd50bead6fe2f529 [0,0,0,1,0,1|2,0,0]=4 3401 B11R1.157 CC1CCCN(C1)CC(=O)N e447a44f6aaeb356f7e500f1b96df590 [0,0,0,1,0,1|2,0,0]=4 3402 B11R1.157 CC1CCCN(C1)CC(=O)O d4ebd15284a303f50f85ba6b4d90a793 [0,0,0,1,0,1|1,0,0]=3 3403 B11R1.157 CC1CN(CCO1)CC(=O)O 65a4eae5f096b9d591902c15eb7b227f [0,0,0,1,0,1|2,0,0]=4 3404 B11R1.157 C[C@@H]1CCCN(C1)CC(=O)N 4a45d3fffe869f1cabc2186339f1e6d2 [0,0,0,1,0,1|2,0,0]=4 3405 B11R1.157 C[C@@H]1CCCN(C1)CC(=O)O 870d6379068dbf78f34bb30d36be26d2 [0,0,0,1,0,1|1,0,0]=3 3406 B11R1.157 C[C@@H]1CN(CCO1)CC(=O)O 5173402d4fdebf8295e061525cc11bc6 [0,0,0,1,0,1|2,0,0]=4 3407 B11R1.157 C[C@H]1CCCN(C1)CC(=O)N de0fec5a29957430feafb98f70a91f3e [0,0,0,1,0,1|2,0,0]=4 3408 B11R1.157 C[C@H]1CCCN(C1)CC(=O)O 4c02b5b686cf18ffb51df551db136b7c [0,0,0,1,0,1|1,0,0]=3 3409 B11R1.157 C[C@H]1CN(CCO1)CC(=O)O 8cc45e12876a56b76924cb11e6d57c90 [0,0,0,1,0,1|2,0,0]=4 3410 B11R1.157 O=C(O)CN1CCCC(C1)F df26d481d723ae859133b1dd45263f8b [0,0,0,1,0,1|2,0,0]=4 3411 B11R1.157 O=C(O)CN1CCCC(C1)O 8a9081ae81f569ea0a4f01bce3eedfa1 [0,0,0,1,0,1|2,0,0]=4 3412 B11R1.157 O=C(O)CN1CCC[C@@H](C1)F 3877c0bc29adfde3b5f9efc3b6d550a4 [0,0,0,1,0,1|2,0,0]=4 3413 B11R1.157 O=C(O)CN1CCC[C@@H](C1)O ff18856f3d9fccfbb76f3f7e4a4cf5e0 [0,0,0,1,0,1|2,0,0]=4 3414 B11R1.157 O=C(O)CN1CCC[C@H](C1)F af0bc4e19c0db595d39589bdbc4a3cc0 [0,0,0,1,0,1|2,0,0]=4 3415 B11R1.157 O=C(O)CN1CCC[C@H](C1)O 50428b9f90feb50aec1d3ab69a75f460 [0,0,0,1,0,1|2,0,0]=4 3416 B11R1.193 CC(=O)N1CCCC1CCO 3012c5631b659808eb0b1bbb485470e0 [0,0,0,1,0,1|2,0,0]=4 3417 B11R1.193 CC(=O)N1CCC[C@@H]1CCO f2afe1a8bb4e088cfac0dceb2854f076 [0,0,0,1,0,1|2,0,0]=4 3418 B11R1.193 CCCC1SCCN1C(=O)C 3b7be28ad8fa800c8763215e27f5ee4a [0,0,0,1,0,1|2,0,0]=4 3419 B11R1.193 CCCN1CCCC1C(=O)N aaa74460d602676b8bd29264bd9e93fc [0,0,0,1,0,1|2,0,0]=4 3420 B11R1.193 CCCN1CCCC1C(=O)O 4e7638d6e465e449e2846c4f858986b5 [0,0,0,1,0,1|1,0,0]=3 3421 B11R1.193 CCCN1CCC[C@@H]1C(=O)N e559f668f68faa8c20d450e622203fae [0,0,0,1,0,1|2,0,0]=4 3422 B11R1.193 CCCN1CCC[C@@H]1C(=O)O a65b32b4a51d2d27a5db27b0d392a38d [0,0,0,1,0,1|1,0,0]=3 3423 B11R1.193 CCCN1CCC[C@H]1C(=O)N cf657feec0a26af1e6c950bbff97ced5 [0,0,0,1,0,1|2,0,0]=4 3424 B11R1.193 CCCN1CCC[C@H]1C(=O)O 033cfafcfdfb4af6deb3dd8bda7c1f7a [0,0,0,1,0,1|1,0,0]=3 3425 B11R1.193 CCCN1CCSC1C(=O)O dcccc13ebce68f0da27a0353246611f1 [0,0,0,1,0,1|2,0,0]=4 3426 B11R1.193 CCCN1CSCC1C(=O)O 33526ae8bccf71536cd41e10b08f1bf7 [0,0,0,1,0,1|2,0,0]=4 3427 B11R1.193 CCCN1CSC[C@@H]1C(=O)O 649cf8fae54c1c1088922db51405da49 [0,0,0,1,0,1|2,0,0]=4 3428 B11R1.193 CCCN1CSC[C@H]1C(=O)O 89f722a6ab4caf990426f9742195498f [0,0,0,1,0,1|2,0,0]=4 3429 B11R1.193 CCN[C@@H]1CCC[C@@H]1C(=O)O b2ead36aea0026ad8ed16725daac4c95 [0,0,0,1,0,1|1,0,0]=3 3430 B11R1.193 CCN[C@@H]1COC[C@@H]1C(=O)O 7d81b8e3c741e5dc82a972a47b06950f [0,0,0,1,0,1|2,0,0]=4 3431 B11R1.193 CCN[C@@H]1COC[C@H]1C(=O)O e4064d0f4b6359ba24feea558387a737 [0,0,0,1,0,1|2,0,0]=4 3432 B11R1.193 CCN[C@H]1CCC[C@@H]1C(=O)O a1d8cdb84c1ab2cc4fea18698e55320b [0,0,0,1,0,1|1,0,0]=3 3433 B11R1.193 CCN[C@H]1CCC[C@H]1C(=O)O 440dea2e0cba6f26d509a31d9785c0da [0,0,0,1,0,1|1,0,0]=3 3434 B11R1.193 CCN[C@H]1COC[C@@H]1C(=O)O fedef230878c22aeb195fbbc677439cb [0,0,0,1,0,1|2,0,0]=4 3435 B11R1.193 CCN[C@H]1COC[C@H]1C(=O)O 1ca08115f1b21789ab94fb088edb806b [0,0,0,1,0,1|2,0,0]=4 3436 B11R1.193 CCOC1CCCC1C(=O)N fd4361e5f7d2100add3537fe95f410ed [0,0,0,1,0,1|2,0,0]=4 3437 B11R1.193 CCOC1CCCC1C(=O)O 6ad27e553386c0a619230f65cf1d4ee8 [0,0,0,1,0,1|1,0,0]=3 3438 B11R1.193 CCO[C@@H]1CCC[C@@H]1C(=O)O 51717747c2e0db16e69c0bef3ae1669c [0,0,0,1,0,1|1,0,0]=3 3439 B11R1.193 CCO[C@@H]1CCC[C@H]1C(=O)O 2f9295612b88cddd0cfa1365f5a6dac6 [0,0,0,1,0,1|1,0,0]=3 3440 B11R1.193 CCO[C@H]1CCC[C@H]1C(=O)O 6f30227e4b6c0e5ec303f7332c8a25fc [0,0,0,1,0,1|1,0,0]=3 3441 B11R1.193 COCC1CCCN1C(=O)C 7e153f859b4feb64a9692d36ebb9a7ce [0,0,0,1,0,1|2,0,0]=4 3442 B11R1.193 COCN1CCCC1C(=O)O d70ccb1f97b1d07fb81e9ccd96855ed1 [0,0,0,1,0,1|2,0,0]=4 3443 B11R1.193 COCN1CCC[C@@H]1C(=O)O 04b355077c321b7ab19f468474bdbc37 [0,0,0,1,0,1|2,0,0]=4 3444 B11R1.193 COCN1CCC[C@H]1C(=O)O 67d34329ad2e305b6818488e23648da5 [0,0,0,1,0,1|2,0,0]=4 3445 B11R1.193 COC[C@@H]1CCCN1C(=O)C e8718aac3c934cd4ec76c7bc786a90f6 [0,0,0,1,0,1|2,0,0]=4 3446 B11R1.193 COC[C@H]1CCCN1C(=O)C fd08fc828ba86e1f3e0babc83b4b6a12 [0,0,0,1,0,1|2,0,0]=4 3447 B11R1.193 CSCC1CCCN1C(=O)C 57dd4f07173c6dc832c3ab34d3791f30 [0,0,0,1,0,1|2,0,0]=4 3448 B11R1.193 CSCN1CCCC1C(=O)O a48fc74dbc2a3a5e6bf44b3a61d887f4 [0,0,0,1,0,1|2,0,0]=4 3449 B11R1.193 CSCN1CCC[C@@H]1C(=O)O 54d740731b18ede86277f10b9b883a0c [0,0,0,1,0,1|2,0,0]=4 3450 B11R1.193 CSCN1CCC[C@H]1C(=O)O 059540469c7d88b54cc6f17ab6e84a04 [0,0,0,1,0,1|2,0,0]=4 3451 B11R1.193 O=C(O)C1CCCC1OCF 221b6e44990c505f847e6ea476a5b2bf [0,0,0,1,0,1|2,0,0]=4 3452 B11R1.193 O=C(O)C1CCCN1CCF 0037817eaf90c09486502ddef2cef7ee [0,0,0,1,0,1|2,0,0]=4 3453 B11R1.193 O=C(O)C1CCCN1CCO 02323466b00d5b3db258cac6faa71d97 [0,0,0,1,0,1|2,0,0]=4 3454 B11R1.193 O=C(O)C1CCCN1CCS 367736afa66da1e4285904289c65cdac [0,0,0,1,0,1|2,0,0]=4 3455 B11R1.193 O=C(O)[C@@H]1CCCN1CCF 5a8d7359c0e5bfb9c39a5805e38e909b [0,0,0,1,0,1|2,0,0]=4 3456 B11R1.193 O=C(O)[C@@H]1CCCN1CCO ea4e1f8ddd662905bdf353ccdeefaac3 [0,0,0,1,0,1|2,0,0]=4 3457 B11R1.193 O=C(O)[C@@H]1CCCN1CCS b22e0ff73dc1a6ffaa09ad78da27870c [0,0,0,1,0,1|2,0,0]=4 3458 B11R1.193 O=C(O)[C@@H]1CCC[C@@H]1NCF d2dc954a0af594d319fc00f35b9e6d45 [0,0,0,1,0,1|2,0,0]=4 3459 B11R1.193 O=C(O)[C@@H]1CCC[C@@H]1NCO edbeba536296e5ac2461e823518ccede [0,0,0,1,0,1|2,0,0]=4 3460 B11R1.193 O=C(O)[C@@H]1CCC[C@@H]1OCF 4c78155a0d36b8dfd114079cc3fa4a7a [0,0,0,1,0,1|2,0,0]=4 3461 B11R1.193 O=C(O)[C@@H]1CCC[C@H]1OCF 94b884409436cf3f44ca21e265bc6d44 [0,0,0,1,0,1|2,0,0]=4 3462 B11R1.193 O=C(O)[C@H]1CCCN1CCF f146a1d7287e4f1df93392aeed24f9da [0,0,0,1,0,1|2,0,0]=4 3463 B11R1.193 O=C(O)[C@H]1CCCN1CCO 0dfe3149168fd7335620ca286efb877f [0,0,0,1,0,1|2,0,0]=4 3464 B11R1.193 O=C(O)[C@H]1CCCN1CCS 266421005a3f5018c5d7c473810c7fd7 [0,0,0,1,0,1|2,0,0]=4 3465 B11R1.193 O=C(O)[C@H]1CCC[C@@H]1NCF 382c83b7e8097118f94a1bd03ca17ddb [0,0,0,1,0,1|2,0,0]=4 3466 B11R1.193 O=C(O)[C@H]1CCC[C@@H]1NCO 415db64b2a99e568f980f51c8ccd6689 [0,0,0,1,0,1|2,0,0]=4 3467 B11R1.193 O=C(O)[C@H]1CCC[C@H]1NCF 92ebc06c5a33e08f5f7967cb82455328 [0,0,0,1,0,1|2,0,0]=4 3468 B11R1.193 O=C(O)[C@H]1CCC[C@H]1NCO e10a84110579d44386cb06277e13de1b [0,0,0,1,0,1|2,0,0]=4 3469 B11R1.193 O=C(O)[C@H]1CCC[C@H]1OCF 3c79c23f3d7c54b05c716a7d0956740d [0,0,0,1,0,1|2,0,0]=4 3470 B11R1.475 CCCN1C[C@H]([C@H]1C(=O)O)C ce010efa90305e56cdd4eafaf686b70f [0,0,0,1,0,1|1,0,0]=3 3471 B11R1.475 COCN1C[C@H]([C@H]1C(=O)O)C cf7076a18c44fa33b1412ee79268c46a [0,0,0,1,0,1|2,0,0]=4 3472 B11R1.475 CSCN1C[C@H]([C@H]1C(=O)O)C 46ed5aeb1f8316269909225d15b2540d [0,0,0,1,0,1|2,0,0]=4 3473 B11R1.475 C[C@@H]1CN([C@@H]1C(=O)O)CCF 60f891f13d7b8bc163c253ac371267f3 [0,0,0,1,0,1|2,0,0]=4 3474 B11R1.475 C[C@@H]1CN([C@@H]1C(=O)O)CCO 33e31eeb93f51cfc60f81d7bf66e28e9 [0,0,0,1,0,1|2,0,0]=4 3475 B11R1.475 C[C@@H]1CN([C@@H]1C(=O)O)CCS 10647d8427ea7cce0c1f0dd021f567a9 [0,0,0,1,0,1|2,0,0]=4 3476 B11R1.742 CC(=O)NC1CCCCCC1 980c21986259e09356273dbf1a23f9df [0,0,0,1,0,1|1,0,0]=3 3477 B11R1.742 CC(=O)NC1CCCOCC1 faa609e7c510cdc55c5bbc154131a5e7 [0,0,0,1,0,1|2,0,0]=4 3478 B11R1.742 NC(=O)CN1CCCCCC1 3c6bdaed56195046700c5f9a02a73e34 [0,0,0,1,0,1|2,0,0]=4 3479 B11R1.742 O=C(O)CN1CCCCCC1 d9f9edaddb25360088e69733dfba1666 [0,0,0,1,0,1|1,0,0]=3 3480 B11R1.742 O=C(O)CN1CCCOCC1 621646c1635481e8abe6c4a7848bde48 [0,0,0,1,0,1|2,0,0]=4 3481 B11R1.771 CCNC1(CCC1)CC(=O)O 3998661d60b58c7db7ab8c02f37c104e [0,0,0,1,0,1|1,0,0]=3 3482 B11R1.771 CCNC1(COC1)CC(=O)O ea3255ce8365b557d123151750cd59ec [0,0,0,1,0,1|2,0,0]=4 3483 B11R1.771 O=C(O)CC1(CCC1)NCF 9faaf1fcafa2700e82abe6a833b074a5 [0,0,0,1,0,1|2,0,0]=4 3484 B11R1.771 O=C(O)CC1(CCC1)NCO 0c4dd9ab9bfb9696238fc7fb5cf528ae [0,0,0,1,0,1|2,0,0]=4 3485 B11R1.804 CC(=O)NC(CCO)C1CC1 c1345e6bf227679be9285819ad03b2c9 [0,0,0,1,0,1|2,0,0]=4 3486 B11R1.804 CCCN(CC(=O)N)C1CC1 38815e01b21719a35c9f0c073d3d3859 [0,0,0,1,0,1|2,0,0]=4 3487 B11R1.804 CCCN(CC(=O)O)C1CC1 e5b08a15e75884d84e8965a646380cf5 [0,0,0,1,0,1|1,0,0]=3 3488 B11R1.804 CCNC(CC(=O)O)C1CC1 2d63e5764d1d8e2c318a7810abd28204 [0,0,0,1,0,1|1,0,0]=3 3489 B11R1.804 CCOC(CC(=O)O)C1CC1 8c8c33630dee5f8974e4ff2ad6dc5204 [0,0,0,1,0,1|1,0,0]=3 3490 B11R1.804 COCC(NC(=O)C)C1CC1 e8bdc9b1ed2c67db13647f1e9f15bf2b [0,0,0,1,0,1|2,0,0]=4 3491 B11R1.804 COCN(CC(=O)O)C1CC1 112487fa02e765ddce249285cd9cbb42 [0,0,0,1,0,1|2,0,0]=4 3492 B11R1.804 CSCN(CC(=O)O)C1CC1 9e6ad889855832d3df21bfb61a21890a [0,0,0,1,0,1|2,0,0]=4 3493 B11R1.804 O=C(O)CC(NCF)C1CC1 a27d384c4b6e96260f54c92d623865f8 [0,0,0,1,0,1|2,0,0]=4 3494 B11R1.804 O=C(O)CC(NCO)C1CC1 b7954a7e3c774f86b5f8a2b07f4c06e3 [0,0,0,1,0,1|2,0,0]=4 3495 B11R1.804 O=C(O)CC(OCF)C1CC1 53e9efd9ccbab29c822679d04c7c4e71 [0,0,0,1,0,1|2,0,0]=4 3496 B11R1.804 O=C(O)CN(CCF)C1CC1 2951558e6a73e0fec10e3642665cae64 [0,0,0,1,0,1|2,0,0]=4 3497 B11R1.804 O=C(O)CN(CCO)C1CC1 3821cf7bd9a1c333890a0447c13cef61 [0,0,0,1,0,1|2,0,0]=4 3498 B11R1.804 O=C(O)CN(CCS)C1CC1 53814b495a22026b24238f6af5416211 [0,0,0,1,0,1|2,0,0]=4 3499 B11R1.49 CC1CC(N(C1)CF)C(=O)O ed807f4d5e2c10e9511e12de15427deb [0,1,0,1,0,0|2,0,0]=4 3500 B11R1.49 CC1CC(N(C1)CO)C(=O)O c08087eec317cd391972a69628f3e822 [0,1,0,1,0,0|2,0,0]=4 3501 B11R1.49 CCN1CC(=O)C[C@@H]1C(=O)O 595159ac670d3ac4fb6e555c3d0c5d6e [0,1,0,1,0,0|1,0,1]=4 3502 B11R1.49 CCN1CC(=O)C[C@H]1C(=O)O e93a971333f8c0f03e40ad63c74beec8 [0,1,0,1,0,0|1,0,1]=4 3503 B11R1.49 CCN1CC(CC1C(=O)N)O f47f15db4001af90ed3836abc4cde5d8 [0,1,0,1,0,0|2,0,0]=4 3504 B11R1.49 CCN1CC(CC1C(=O)O)C bb01de55fbeb56537612f7a8bbc2cd94 [0,1,0,1,0,0|1,0,0]=3 3505 B11R1.49 CCN1CC(CC1C(=O)O)F f30e2ba42a43ffd3e580c8aa4989fb9f [0,1,0,1,0,0|1,0,0]=3 3506 B11R1.49 CCN1CC(CC1C(=O)O)O 019c8f069c80e5eb4a5a23fd0e7fc495 [0,1,0,1,0,0|1,0,0]=3 3507 B11R1.49 CCN1C[C@@H](C[C@@H]1C(=O)O)F 087e745286d29729b755eb808a075d7e [0,1,0,1,0,0|1,0,0]=3 3508 B11R1.49 CCN1C[C@@H](C[C@@H]1C(=O)O)O f2af1e03a8d3a059496973ee668b87a6 [0,1,0,1,0,0|1,0,0]=3 3509 B11R1.49 CCN1C[C@@H](C[C@H]1C(=O)N)O e80ed0aea619dfb3bf9b1169555b8bab [0,1,0,1,0,0|2,0,0]=4 3510 B11R1.49 CCN1C[C@@H](C[C@H]1C(=O)O)F 5b20be64730953ac1b4ab7965a4f7425 [0,1,0,1,0,0|1,0,0]=3 3511 B11R1.49 CCN1C[C@@H](C[C@H]1C(=O)O)O 7e4cb7bc191462e3dbd9f5ad0511f76c [0,1,0,1,0,0|1,0,0]=3 3512 B11R1.49 CCN1C[C@H](C[C@@H]1C(=O)O)F 66354419b7a0c5d028f5abe161a04c8f [0,1,0,1,0,0|1,0,0]=3 3513 B11R1.49 CCN1C[C@H](C[C@@H]1C(=O)O)O c5a47a6ff3f43fab4dddd1318646fe82 [0,1,0,1,0,0|1,0,0]=3 3514 B11R1.49 CCN1C[C@H](C[C@H]1C(=O)N)F 8b21878d0c34c09902135993246587f5 [0,1,0,1,0,0|2,0,0]=4 3515 B11R1.49 CCN1C[C@H](C[C@H]1C(=O)O)C b538ec52340da5598fc048f616de605d [0,1,0,1,0,0|1,0,0]=3 3516 B11R1.49 CCN1C[C@H](C[C@H]1C(=O)O)F 61fd5632aa5ab884af2e5cecea6e949e [0,1,0,1,0,0|1,0,0]=3 3517 B11R1.49 CCN1C[C@H](C[C@H]1C(=O)O)O e999d6da7568d74f9ff9770757e40fa4 [0,1,0,1,0,0|1,0,0]=3 3518 B11R1.49 CCN1C[C@H](C[C@H]1C(=O)O)S ebf3dd56d7c23a53361af035214b459d [0,1,0,1,0,0|1,0,0]=3 3519 B11R1.49 C[C@H]1C[C@H](N(C1)CF)C(=O)O 664778f63fd5d9111e187cfe95ee7aa6 [0,1,0,1,0,0|2,0,0]=4 3520 B11R1.49 C[C@H]1C[C@H](N(C1)CO)C(=O)O 6b154a4f914ec3b7dd98e9f25e782b88 [0,1,0,1,0,0|2,0,0]=4 3521 B11R1.49 O=C(O)C1CC(CN1CF)F ef5144dcb77728cbe874600e68f9b374 [0,1,0,1,0,0|2,0,0]=4 3522 B11R1.49 O=C(O)C1CC(CN1CF)O 10b84389add531b8ac4b08b485f3caa2 [0,1,0,1,0,0|2,0,0]=4 3523 B11R1.49 O=C(O)C1CC(CN1CO)F 34fb44c46c144f5805263e4f37b5725d [0,1,0,1,0,0|2,0,0]=4 3524 B11R1.49 O=C(O)C1CC(CN1CO)O fc3e62d02eb0f75a4bbdaab566efc04b [0,1,0,1,0,0|2,0,0]=4 3525 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CF)F e94904e9bc69cad3e970592559fb1290 [0,1,0,1,0,0|2,0,0]=4 3526 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CF)O 9d44cbef843dc52a595a5aa169adad09 [0,1,0,1,0,0|2,0,0]=4 3527 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CF)S 89c24c48a3a454640f12025145ea4d61 [0,1,0,1,0,0|2,0,0]=4 3528 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CO)F d3e9bfee802a4d0916d26ded29ee4d44 [0,1,0,1,0,0|2,0,0]=4 3529 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CO)O 3cc068e2131fa1a6c0519579ab5fd76f [0,1,0,1,0,0|2,0,0]=4 3530 B11R1.49 O=C(O)[C@@H]1C[C@@H](CN1CO)S edcabcbf4f72ba7a9e7becc5277b74fa [0,1,0,1,0,0|2,0,0]=4 3531 B11R1.49 O=C(O)[C@@H]1C[C@H](CN1CF)F a443e67b0fdb7d9ec668221c73972aed [0,1,0,1,0,0|2,0,0]=4 3532 B11R1.49 O=C(O)[C@@H]1C[C@H](CN1CF)O 7ad8ddf5a5a1435bde27e219577a0853 [0,1,0,1,0,0|2,0,0]=4 3533 B11R1.49 O=C(O)[C@@H]1C[C@H](CN1CO)F 74d37f22444df9757e18c783f057db35 [0,1,0,1,0,0|2,0,0]=4 3534 B11R1.49 O=C(O)[C@@H]1C[C@H](CN1CO)O 7df899de1e4c485e7191a741ec99cdef [0,1,0,1,0,0|2,0,0]=4 3535 B11R1.49 O=C(O)[C@H]1C[C@@H](CN1CF)F 96573a92b48165d50bd783a9064a40be [0,1,0,1,0,0|2,0,0]=4 3536 B11R1.49 O=C(O)[C@H]1C[C@@H](CN1CF)O 872fef9e851458e8918f2a2ab5df65d5 [0,1,0,1,0,0|2,0,0]=4 3537 B11R1.49 O=C(O)[C@H]1C[C@@H](CN1CO)F c398826ead4d278b2caf67191d0e2689 [0,1,0,1,0,0|2,0,0]=4 3538 B11R1.49 O=C(O)[C@H]1C[C@@H](CN1CO)O 344d8d96f09f2ca1b15df1fcafa71544 [0,1,0,1,0,0|2,0,0]=4 3539 B11R1.49 O=C(O)[C@H]1C[C@H](CN1CF)F 88c27d1d83dd75ec49ef1358d94678ca [0,1,0,1,0,0|2,0,0]=4 3540 B11R1.49 O=C(O)[C@H]1C[C@H](CN1CF)O 837926af819e7ff37c4af3165713c2df [0,1,0,1,0,0|2,0,0]=4 3541 B11R1.49 O=C(O)[C@H]1C[C@H](CN1CO)F 793e0c5a80d68b7ac6b37664896af6b2 [0,1,0,1,0,0|2,0,0]=4 3542 B11R1.49 O=C(O)[C@H]1C[C@H](CN1CO)O b00898cdb8e9ed5fed9b8076443a7ee5 [0,1,0,1,0,0|2,0,0]=4 3543 B11R1.74 CC(=O)N1CC(CC(C1)C)C a3e68577170be7fdf0944d576f853f85 [0,1,0,1,0,0|2,0,0]=4 3544 B11R1.74 CC(=O)N1CC(OC(C1)C)C 5db835fd53cfaff44de4cd565a7717a3 [0,1,0,1,0,0|2,0,0]=4 3545 B11R1.74 CC(=O)N1C[C@@H](C[C@@H](C1)C)C 41a33a502ce590c11d8fe4cb41bd8f81 [0,1,0,1,0,0|2,0,0]=4 3546 B11R1.74 CC(=O)N1C[C@@H](O[C@H](C1)C)C 7fc454011b83fcd27f877a90c41f36ed [0,1,0,1,0,0|2,0,0]=4 3547 B11R1.74 CC(=O)N1C[C@H](O[C@@H](C1)C)C f3678a23b706faa224194dab3f381a8e [0,1,0,1,0,0|2,0,0]=4 3548 B11R1.74 CC(=O)N1C[C@H](O[C@H](C1)C)C 31dfe09f9077fa52b3c02134f0073dd0 [0,1,0,1,0,0|2,0,0]=4 3549 B11R1.86 CC(C)NC1CCCNC1=O 38de1d955226696470b81e6d9f7ed703 [0,1,0,1,0,0|2,0,0]=4 3550 B11R1.86 CC(C)N[C@@H]1CCCNC1=O e9424ba23b15112a73d136e8544b3faa [0,1,0,1,0,0|2,0,0]=4 3551 B11R1.86 CC(C)N[C@H]1CCCNC1=O bafcd00042fb983db32dcf9036985f65 [0,1,0,1,0,0|2,0,0]=4 3552 B11R1.86 CC(C)OC1CCCCC1=O 014a72d8eb0482260ac98580c8ab987f [0,1,0,1,0,0|2,0,0]=4 3553 B11R1.86 CC(C)OC1CCCNC1=O ebc99dc3d0926ce6fa1273db494c125f [0,1,0,1,0,0|2,0,0]=4 3554 B11R1.86 CC(C)OC1CCCOC1=O 7070cea31e8001ca056e61c73c7497b0 [0,1,0,1,0,0|1,0,0]=3 3555 B11R1.86 CC(C)O[C@@H]1CCCNC1=O 8c5b2d7514ccf845e44b345d146dce68 [0,1,0,1,0,0|2,0,0]=4 3556 B11R1.86 CC(C)O[C@H]1CCCNC1=O 35c33550caf85025b800125449803732 [0,1,0,1,0,0|2,0,0]=4 3557 B11R1.108 CC(C)N1[C@@H](C[C@H]1C(=O)O)C b532117ec759b713edbffec0b683d591 [0,1,0,1,0,0|1,0,0]=3 3558 B11R1.108 CC(C)N1[C@H](C[C@H]1C(=O)O)C 04caf581d599ec8eb8f0394b7d22bc6a [0,1,0,1,0,0|1,0,0]=3 3559 B11R1.178 CC(=O)N1CCCC1C(C)C 4ce209838c647d7d4d498e814ecd2467 [0,1,0,1,0,0|2,0,0]=4 3560 B11R1.178 CC(=O)N1CCCC1C(C)O 9f8e94851b1373bc70952c43a1f4d7dd [0,1,0,1,0,0|2,0,0]=4 3561 B11R1.178 CC(=O)N1CCC[C@@H]1C(C)O b6a441c711cebecc18681a5553488a28 [0,1,0,1,0,0|2,0,0]=4 3562 B11R1.178 CC(=O)N1CCC[C@H]1C(C)C 5225fb80429c973d33f65f26e7a41510 [0,1,0,1,0,0|2,0,0]=4 3563 B11R1.178 CC(=O)N1CCC[C@H]1[C@H](C)O d5e83cec14aa1ac18979f6a5e58e48e1 [0,1,0,1,0,0|2,0,0]=4 3564 B11R1.178 CC(C)N1CCCC1C(=O)N da5c893cbf5ec65ed45873c80ecaf0eb [0,1,0,1,0,0|2,0,0]=4 3565 B11R1.178 CC(C)N1CCCC1C(=O)O dca2facd5d723d340de769a76483186c [0,1,0,1,0,0|1,0,0]=3 3566 B11R1.178 CC(C)N1CCC[C@@H]1C(=O)N b85134dc2aa03e027d6c78f76c18c85a [0,1,0,1,0,0|2,0,0]=4 3567 B11R1.178 CC(C)N1CCC[C@@H]1C(=O)O 5f937897216410dc2051de69b28f3c79 [0,1,0,1,0,0|1,0,0]=3 3568 B11R1.178 CC(C)N1CCC[C@H]1C(=O)N 80e9bf92652771e43f1888ed8bad07e6 [0,1,0,1,0,0|2,0,0]=4 3569 B11R1.178 CC(C)N1CCC[C@H]1C(=O)O 481938a3ddc2dbb397617125e3724a6f [0,1,0,1,0,0|1,0,0]=3 3570 B11R1.178 CC(C)N1CCSC1C(=O)O c9b58fbbfcb11ebdd6af95f22d6de4d4 [0,1,0,1,0,0|2,0,0]=4 3571 B11R1.184 CCOC1CC(CC1=O)(C)C c2a6cf08c7c53b767ba106beb3794bd7 [0,1,0,1,0,0|2,0,0]=4 3572 B11R1.497 CC(=O)N1CCCCC(C1)O 4cd02de1ff6ee31ef2344ef07a2d1192 [0,1,0,1,0,0|2,0,0]=4 3573 B11R1.497 CC(=O)N1CCCC[C@H](C1)O ce4462bec135013b9dda13203379a851 [0,1,0,1,0,0|2,0,0]=4 3574 B11R1.497 CC(=O)N1CCCOC(C1)C 9c3f494828caca6404fc13dc5a414e22 [0,1,0,1,0,0|2,0,0]=4 3575 B11R1.596 C#CCN1[C@@H](C[C@H]1C(=O)O)C 016f254fc5b1f53a0d99bbe6c3cfe925 [0,1,0,1,0,0|0,0,2]=4 3576 B11R1.596 C#CCN1[C@H](C[C@H]1C(=O)O)C e290466fb230844dde0831dbfae1bc02 [0,1,0,1,0,0|0,0,2]=4 3577 B11R1.596 C=CCN1[C@@H](C[C@H]1C(=O)O)C 775ce75e2fb3d44706d6f5acca0d462c [0,1,0,1,0,0|0,0,2]=4 3578 B11R1.596 C=CCN1[C@H](C[C@H]1C(=O)O)C aa2e2c781231a8a01e1bf44742f8446f [0,1,0,1,0,0|0,0,2]=4 3579 B11R1.596 CCCN1[C@@H](C[C@H]1C(=O)O)C e9bf2cd816048fe2d577d41a5c1316c8 [0,1,0,1,0,0|0,0,0]=2 3580 B11R1.596 CCCN1[C@H](C[C@H]1C(=O)O)C fa5846fd21d11da0f874e40ce9c7394d [0,1,0,1,0,0|0,0,0]=2 3581 B11R1.596 COCN1[C@@H](C[C@H]1C(=O)O)C 30f021203d2d51dc1615f87ccab23291 [0,1,0,1,0,0|1,0,0]=3 3582 B11R1.596 COCN1[C@H](C[C@H]1C(=O)O)C 303b410731ff2672a4f4dc5117474575 [0,1,0,1,0,0|1,0,0]=3 3583 B11R1.596 CSCN1[C@@H](C[C@H]1C(=O)O)C e967d89135b59b618868ac5d5fab19ba [0,1,0,1,0,0|1,0,0]=3 3584 B11R1.596 CSCN1[C@H](C[C@H]1C(=O)O)C d78072030d33eb0d5c1ab6f824bb9b99 [0,1,0,1,0,0|1,0,0]=3 3585 B11R1.596 C[C@@H]1C[C@H](N1CC#N)C(=O)O 02f8c118e26c9074955a1e936796e19f [0,1,0,1,0,0|1,0,1]=4 3586 B11R1.596 C[C@@H]1C[C@H](N1CC=O)C(=O)O ab74cd6677890fe4b218748aae9888ce [0,1,0,1,0,0|1,0,1]=4 3587 B11R1.596 C[C@@H]1C[C@H](N1CCF)C(=O)O 95d99db88ae23a608a6d6e5363e48f2d [0,1,0,1,0,0|1,0,0]=3 3588 B11R1.596 C[C@@H]1C[C@H](N1CCO)C(=O)O 9d574833a29b02074d4c6bf80e030034 [0,1,0,1,0,0|1,0,0]=3 3589 B11R1.596 C[C@@H]1C[C@H](N1CCS)C(=O)O 50e4e270d6a4c9150352fec56ac7d217 [0,1,0,1,0,0|1,0,0]=3 3590 B11R1.596 C[C@H]1C[C@H](N1CC#N)C(=O)O 6030b0b62fc38f1ab7198a1e44b1a105 [0,1,0,1,0,0|1,0,1]=4 3591 B11R1.596 C[C@H]1C[C@H](N1CC=O)C(=O)O cd375137d9f977bb4d7ad50f8abe84d6 [0,1,0,1,0,0|1,0,1]=4 3592 B11R1.596 C[C@H]1C[C@H](N1CCF)C(=O)O 9862afad869e9c675c57b403593b2423 [0,1,0,1,0,0|1,0,0]=3 3593 B11R1.596 C[C@H]1C[C@H](N1CCO)C(=O)O 4de8a7a886f7e87260f0a975790724ba [0,1,0,1,0,0|1,0,0]=3 3594 B11R1.596 C[C@H]1C[C@H](N1CCS)C(=O)O 2485d48d8ab075a6a830e505d9d2e9ec [0,1,0,1,0,0|1,0,0]=3 3595 B11R1.645 CC(C)OC1CC(OC1=O)C 1d0b8ad623d9066a599b8f27baa3cd4f [0,1,0,1,0,0|1,0,0]=3 3596 B11R1.645 CC(C)O[C@@H]1C[C@@H](NC1=O)C 09e4b151d422c6f3ed5a8d798a0c460c [0,1,0,1,0,0|2,0,0]=4 3597 B11R1.730 CC(=O)N1CCCC(C1)(C)C 5a07d00bbb3237976a28767c1fe1c9e0 [0,1,0,1,0,0|2,0,0]=4 3598 B11R1.730 CC(=O)N1CCCC(C1)(C)O 0918cd23eb91f0c098327cef690453da [0,1,0,1,0,0|2,0,0]=4 3599 B11R1.730 CC(=O)N1CCC[C@@](C1)(C)O d72efd118cf067ad44ec4ad0f4a4ca71 [0,1,0,1,0,0|2,0,0]=4 3600 B11R1.730 CC(=O)N1CCC[C@](C1)(C)O 18053dea614b2c86e5e9cfbc421d3525 [0,1,0,1,0,0|2,0,0]=4 3601 B11R1.782 CC1CC(C1)(NCF)C(=O)O 6875567c6a181230755d7876b42dc2dc [0,1,0,1,0,0|2,0,0]=4 3602 B11R1.782 CC1CC(C1)(NCO)C(=O)O 3dbe69135f577a838097812fcaa11318 [0,1,0,1,0,0|2,0,0]=4 3603 B11R1.782 CCNC1(CC(C1)C)C(=O)O 7eadf70b2ad41c2dbe81997a54543a24 [0,1,0,1,0,0|1,0,0]=3 3604 B11R1.782 CCNC1(CC(C1)F)C(=O)O 75fb469c8a9312175c17975e1fb60532 [0,1,0,1,0,0|1,0,0]=3 3605 B11R1.782 CCNC1(CC(C1)O)C(=O)O b80affed479ffb13a06ce346c1c2906b [0,1,0,1,0,0|1,0,0]=3 3606 B11R1.782 CCN[C@@]1(C[C@@H](C1)C)C(=O)O cc7c2051d46358a46eda23a5603a00ba [0,1,0,1,0,0|1,0,0]=3 3607 B11R1.782 CCN[C@@]1(C[C@@H](C1)F)C(=O)O 67eb70f0c1b290d312fd8f0a957c24d7 [0,1,0,1,0,0|1,0,0]=3 3608 B11R1.782 CCN[C@@]1(C[C@H](C1)C)C(=O)O 716f900100bb8db8eb9ebc062ed4f49f [0,1,0,1,0,0|1,0,0]=3 3609 B11R1.782 C[C@H]1C[C@@](C1)(NCF)C(=O)O 7f305c14ebdeee6b5ae8137f6799149f [0,1,0,1,0,0|2,0,0]=4 3610 B11R1.782 C[C@H]1C[C@@](C1)(NCO)C(=O)O 00c7b6d677055dc01c6e0a7280639605 [0,1,0,1,0,0|2,0,0]=4 3611 B11R1.782 C[C@H]1C[C@](C1)(NCF)C(=O)O 9e530a60844333aa6fd49606c4079537 [0,1,0,1,0,0|2,0,0]=4 3612 B11R1.782 C[C@H]1C[C@](C1)(NCO)C(=O)O 0dd67859cd2a5fc72e510934636613c4 [0,1,0,1,0,0|2,0,0]=4 3613 B11R1.782 O=C(O)C1(CC(C1)F)NCF 68c8f45daa631fd91eec71ca462b8c66 [0,1,0,1,0,0|2,0,0]=4 3614 B11R1.782 O=C(O)C1(CC(C1)F)NCO 174e09dd5aabc1618d70d77d73c5db57 [0,1,0,1,0,0|2,0,0]=4 3615 B11R1.782 O=C(O)C1(CC(C1)O)NCF 0996bd1727eb6fae51be0fa74d4a4480 [0,1,0,1,0,0|2,0,0]=4 3616 B11R1.782 O=C(O)C1(CC(C1)O)NCO 1da71fca0020c088591cd0b25d14aa30 [0,1,0,1,0,0|2,0,0]=4 3617 B11R1.782 O=C(O)[C@@]1(C[C@H](C1)F)NCF 8510e7af0589a0dbed6ea968197ceac8 [0,1,0,1,0,0|2,0,0]=4 3618 B11R1.782 O=C(O)[C@@]1(C[C@H](C1)F)NCO c7f46ce2ee7bc4990b34313c32d78c2f [0,1,0,1,0,0|2,0,0]=4 3619 B11R1.793 CCNC1(CC1(F)F)C(=O)O d0bf27a987d28dcb015df9dd21d2a6a0 [0,1,0,1,0,0|2,0,0]=4 3620 B11R1.793 CCN[C@]1(CC1(F)F)C(=O)O 7a3a7df76ba187c419f0c62e7ebba888 [0,1,0,1,0,0|2,0,0]=4 3621 B11R1.806 C#CCC(NC1CC1)C(=O)O c7c76b83ce668c5dc7b93e61d8183d36 [0,1,0,1,0,0|0,0,2]=4 3622 B11R1.806 C#CC[C@@H](NC1CC1)C(=O)O 38c48827a2d269fc65d1764f0dc390ab [0,1,0,1,0,0|0,0,2]=4 3623 B11R1.806 C#CC[C@H](NC1CC1)C(=O)O 76b531e3110310c7857e0d67612ee479 [0,1,0,1,0,0|0,0,2]=4 3624 B11R1.806 C=CCC(NC1CC1)C(=O)O 5761e17771a217d4b86865ea7ff91aae [0,1,0,1,0,0|0,0,2]=4 3625 B11R1.806 C=CC[C@@H](NC1CC1)C(=O)O d87c55f91da6d7f6894ec73e9010a2a9 [0,1,0,1,0,0|0,0,2]=4 3626 B11R1.806 C=CC[C@H](NC1CC1)C(=O)O 2b992e19ab8fffe35ed90338d41ef5f1 [0,1,0,1,0,0|0,0,2]=4 3627 B11R1.806 CC(=O)C(CCO)NC1CC1 26def163ba1c97ce03cacb9cffb8338c [0,1,0,1,0,0|2,0,0]=4 3628 B11R1.806 CCCC(NC1CC1)C(=O)C 5bd65f0e2449669f4b2b819900c137a3 [0,1,0,1,0,0|1,0,0]=3 3629 B11R1.806 CCCC(NC1CC1)C(=O)O 6cc565d75f070b327fd2cab6cd3e16d3 [0,1,0,1,0,0|0,0,0]=2 3630 B11R1.806 CCCC(OC1CC1)C(=O)C 2e74d3f194d09143c169b3bf723b5474 [0,1,0,1,0,0|1,0,0]=3 3631 B11R1.806 CCCC(OC1CC1)C(=O)N 9427514d461337de2cf2c18aea24c83d [0,1,0,1,0,0|1,0,0]=3 3632 B11R1.806 CCCN(CC1CC1)C(=O)C b2137af6c54cb537f4af62e93d46f4a4 [0,1,0,1,0,0|2,0,0]=4 3633 B11R1.806 CCC[C@@H](NC1CC1)C(=O)O 957e985d2dd6de24e4e133ab8858e4ff [0,1,0,1,0,0|0,0,0]=2 3634 B11R1.806 CCC[C@H](NC1CC1)C(=O)O 8bc1de672d84fe0ddb8fca24a7747066 [0,1,0,1,0,0|0,0,0]=2 3635 B11R1.806 CCNC(CC1CC1)C(=O)O d0be95b4a0ffd028622e690deb8c3c8d [0,1,0,1,0,0|1,0,0]=3 3636 B11R1.806 CCN[C@@H](CC1CC1)C(=O)O 9ce9e7b9ec72d159bded68a189549309 [0,1,0,1,0,0|1,0,0]=3 3637 B11R1.806 CCN[C@H](CC1CC1)C(=O)O dfa3269ca1bd537d58453944e2944062 [0,1,0,1,0,0|1,0,0]=3 3638 B11R1.806 CCOC(CC1CC1)C(=O)O 70695026217df9a87049e1b62d55f81b [0,1,0,1,0,0|1,0,0]=3 3639 B11R1.806 CCO[C@@H](CC1CC1)C(=O)O 640057e358c6590d2ca2fd9404e70cd4 [0,1,0,1,0,0|1,0,0]=3 3640 B11R1.806 CCO[C@H](CC1CC1)C(=O)O f57747577f1ddf0d57b9cc7e8ca317ae [0,1,0,1,0,0|1,0,0]=3 3641 B11R1.806 COCC(NC1CC1)C(=O)O 9470b2666e212afac842f46576ae4a1b [0,1,0,1,0,0|1,0,0]=3 3642 B11R1.806 COCC(OC1CC1)C(=O)O c7303ae3c962ea9044afff4e6aaf9833 [0,1,0,1,0,0|1,0,0]=3 3643 B11R1.806 CSCC(NC1CC1)C(=O)O a28b2889690147f0c31812cadba677e3 [0,1,0,1,0,0|1,0,0]=3 3644 B11R1.806 CSC[C@@H](NC1CC1)C(=O)O c2f0bf4916c16ea6daeaa49ff562ba1d [0,1,0,1,0,0|1,0,0]=3 3645 B11R1.806 CSC[C@H](NC1CC1)C(=O)O f5e0872fdf0b4efa33514d068ddf0bbc [0,1,0,1,0,0|1,0,0]=3 3646 B11R1.806 N#CCC(NC1CC1)C(=O)O be33a461a5aa31599907bd58b0e04f94 [0,1,0,1,0,0|1,0,1]=4 3647 B11R1.806 N#CC[C@H](NC1CC1)C(=O)O 6e6d1a2b7894dbbc79a5fd88d7431167 [0,1,0,1,0,0|1,0,1]=4 3648 B11R1.806 O=C(O)C(CC1CC1)NCF f6c50a952447b2a80f2e086f0c4791fa [0,1,0,1,0,0|2,0,0]=4 3649 B11R1.806 O=C(O)C(CC1CC1)NCO e62d4c16781d0eab5d7a15a7bff56ff4 [0,1,0,1,0,0|2,0,0]=4 3650 B11R1.806 O=C(O)C(CC1CC1)OCF c5f4a1724dc970a5b4fc654b8ddaf7cd [0,1,0,1,0,0|2,0,0]=4 3651 B11R1.806 O=C(O)C(CCO)NC1CC1 ab2ecbf63194122b8cb75fca1b97fd1a [0,1,0,1,0,0|1,0,0]=3 3652 B11R1.806 O=C(O)C(CCS)NC1CC1 5dccf15d403753782ca72b9d736ae354 [0,1,0,1,0,0|1,0,0]=3 3653 B11R1.806 O=C(O)[C@@H](CC1CC1)NCF 6b1bdc719f2870303d9e8554c8a41818 [0,1,0,1,0,0|2,0,0]=4 3654 B11R1.806 O=C(O)[C@@H](CC1CC1)NCO d1307036ba4e2bbb5596f7089b20c011 [0,1,0,1,0,0|2,0,0]=4 3655 B11R1.806 O=C(O)[C@@H](CC1CC1)OCF 0fb765755c6028395f7c484aba6b88f1 [0,1,0,1,0,0|2,0,0]=4 3656 B11R1.806 O=C(O)[C@@H](CCO)NC1CC1 db7378492aba8d414fb54d18c2e349d2 [0,1,0,1,0,0|1,0,0]=3 3657 B11R1.806 O=C(O)[C@@H](CCS)NC1CC1 1788035dfd1aaf7f01469d23891602fe [0,1,0,1,0,0|1,0,0]=3 3658 B11R1.806 O=C(O)[C@H](CC1CC1)NCF 046d02dd81e7f02b437a8ac9bf3ac1ee [0,1,0,1,0,0|2,0,0]=4 3659 B11R1.806 O=C(O)[C@H](CC1CC1)NCO 7dae6067d4442907affb244375859b18 [0,1,0,1,0,0|2,0,0]=4 3660 B11R1.806 O=C(O)[C@H](CC1CC1)OCF c8f94e267401c6a86bb34d6b048ef93b [0,1,0,1,0,0|2,0,0]=4 3661 B11R1.806 O=C(O)[C@H](CCO)NC1CC1 6176019b412bed813bccd1beb8182712 [0,1,0,1,0,0|1,0,0]=3 3662 B11R1.806 O=C(O)[C@H](CCS)NC1CC1 7b0c35a26ddcc250dd8abeab1a78d5b9 [0,1,0,1,0,0|1,0,0]=3 3663 B11R1.925 CC(=O)N(CC(C)C)C1CC1 4c819bbe63ebcd079d405d0144670340 [0,1,0,1,0,0|2,0,0]=4 3664 B11R1.925 CC(C)NC(C(=O)N)C1CC1 81653ab705d25483205d7b12c2ce390d [0,1,0,1,0,0|2,0,0]=4 3665 B11R1.925 CC(C)NC(C(=O)O)C1CC1 217727cb48bb5ccb6eff2ea4e8a7766d [0,1,0,1,0,0|1,0,0]=3 3666 B11R1.925 CC(C)N[C@@H](C(=O)N)C1CC1 14154fa7d66cc171371c063e9cd3ed1d [0,1,0,1,0,0|2,0,0]=4 3667 B11R1.925 CC(C)N[C@@H](C(=O)O)C1CC1 805d77ee0a0de452caecd7d25b46604c [0,1,0,1,0,0|1,0,0]=3 3668 B11R1.925 CC(C)N[C@H](C(=O)N)C1CC1 5b5a58dca359bc41acd001462ade4ad9 [0,1,0,1,0,0|2,0,0]=4 3669 B11R1.925 CC(C)N[C@H](C(=O)O)C1CC1 0a0426748147e568e3ea00e0b5d023d4 [0,1,0,1,0,0|1,0,0]=3 3670 B11R1.925 CC(C)OC(C(=O)N)C1CC1 f33633a6a83f15071913963501a8f116 [0,1,0,1,0,0|2,0,0]=4 3671 B11R1.929 CC(C)NC1(CCC1)C(=O)N 0acbb7555ba5b675da6c7b694e7a5fb9 [0,1,0,1,0,0|2,0,0]=4 3672 B11R1.929 CC(C)NC1(CCC1)C(=O)O e53085d2d81b19ec6229f1f64540a55b [0,1,0,1,0,0|1,0,0]=3 3673 B11R1.53 CCC1CCCCN1C(=O)C 8d91af042ec3ee454d245c12958ebfeb [0,1,0,1,0,0|2,0,0]=4 3674 B11R1.53 CCC1COCCN1C(=O)C 8dd2029cb4d1d2f81e06c54a1f5dbb35 [0,1,0,1,0,0|2,0,0]=4 3675 B11R1.53 CCN1CC=CC[C@H]1C(=O)O 31ffa7d9aa542b33e89e7c925519016f [0,1,0,1,0,0|1,0,1]=4 3676 B11R1.53 CCN1CCCCC1C(=O)C 66e745e3acee9cfa447bccc577764815 [0,1,0,1,0,0|2,0,0]=4 3677 B11R1.53 CCN1CCCCC1C(=O)N 00aa29d87fd7cc18aead98e4fddba9f3 [0,1,0,1,0,0|2,0,0]=4 3678 B11R1.53 CCN1CCCCC1C(=O)O 48e64a80b74ee0d57ef5f2c51793a0e0 [0,1,0,1,0,0|1,0,0]=3 3679 B11R1.53 CCN1CCCC[C@@H]1C(=O)N d88b4e4bdd088665793e230ad88658f8 [0,1,0,1,0,0|2,0,0]=4 3680 B11R1.53 CCN1CCCC[C@@H]1C(=O)O ffabe4d2c3400a07ec9d9a1b02445d18 [0,1,0,1,0,0|1,0,0]=3 3681 B11R1.53 CCN1CCCC[C@H]1C(=O)N 5ef3247fbd176524430d9698606233d1 [0,1,0,1,0,0|2,0,0]=4 3682 B11R1.53 CCN1CCCC[C@H]1C(=O)O bfa902a3d396d93371caf449fec9a938 [0,1,0,1,0,0|1,0,0]=3 3683 B11R1.53 CCN1CCCSC1C(=O)O 714ab7d5f47ac73dbab4bf4e7ca0563f [0,1,0,1,0,0|1,0,0]=3 3684 B11R1.53 CCN1CCOCC1C(=O)N 4597521994485702f168a2eb7373e877 [0,1,0,1,0,0|2,0,0]=4 3685 B11R1.53 CCN1CCOCC1C(=O)O 4e8e486d19bce548ce5dcd44da88bf93 [0,1,0,1,0,0|1,0,0]=3 3686 B11R1.53 CCN1CCOC[C@@H]1C(=O)N da28acb7b209a7aab0a297b67677ee3d [0,1,0,1,0,0|2,0,0]=4 3687 B11R1.53 CCN1CCOC[C@@H]1C(=O)O 29a626e348d78eb3932bfc1fc9125b04 [0,1,0,1,0,0|1,0,0]=3 3688 B11R1.53 CCN1CCOC[C@H]1C(=O)N ac29a60bce32229f4b74f5ee34b1d8cc [0,1,0,1,0,0|2,0,0]=4 3689 B11R1.53 CCN1CCOC[C@H]1C(=O)O fc40095b000bc9c3ac27524d64195911 [0,1,0,1,0,0|1,0,0]=3 3690 B11R1.53 CCN1CCSCC1C(=O)O d27fac1ccb72015ed59835c66ff0e5b1 [0,1,0,1,0,0|1,0,0]=3 3691 B11R1.53 CCN1CCSC[C@@H]1C(=O)O 98b6db6175552733deff2eab6f15041f [0,1,0,1,0,0|1,0,0]=3 3692 B11R1.53 CCN1CCSC[C@H]1C(=O)O 20d7734a9f8d49660c707d7b8bbe747d [0,1,0,1,0,0|1,0,0]=3 3693 B11R1.53 CC[C@@H]1CCCCN1C(=O)C 6739e20465d74f218273c8bb16bd22bb [0,1,0,1,0,0|2,0,0]=4 3694 B11R1.53 CC[C@@H]1COCCN1C(=O)C 7fdffc15c971fbe37aea280231e59131 [0,1,0,1,0,0|2,0,0]=4 3695 B11R1.53 CC[C@H]1CCCCN1C(=O)C 3f882d1db31c87fd415fbe582bfecb93 [0,1,0,1,0,0|2,0,0]=4 3696 B11R1.53 CC[C@H]1COCCN1C(=O)C 9048e0bf415d52b57570f4aa3fbdca7c [0,1,0,1,0,0|2,0,0]=4 3697 B11R1.53 O=C(O)C1CCCCN1CF 34780400456104861d4e67d872dd68cc [0,1,0,1,0,0|2,0,0]=4 3698 B11R1.53 O=C(O)C1CCCCN1CO 830196dd603a43de36b162d205ac7bc0 [0,1,0,1,0,0|2,0,0]=4 3699 B11R1.53 O=C(O)C1COCCN1CF 950ffb9861cab7e58ca3ddf2be32e7ed [0,1,0,1,0,0|2,0,0]=4 3700 B11R1.53 O=C(O)C1COCCN1CO e8380119c9c4da5f35942b9bb9f2824e [0,1,0,1,0,0|2,0,0]=4 3701 B11R1.53 O=C(O)C1CSCCN1CF c371482562f36618f566cd1870efa133 [0,1,0,1,0,0|2,0,0]=4 3702 B11R1.53 O=C(O)C1CSCCN1CO b3fbc93091fd314451c40acda6a898f3 [0,1,0,1,0,0|2,0,0]=4 3703 B11R1.53 O=C(O)C1SCCCN1CF c414adcba490cfd86193afcb0ce6934b [0,1,0,1,0,0|2,0,0]=4 3704 B11R1.53 O=C(O)C1SCCCN1CO fc51dd5c7ae2d2029aaf4924dc653467 [0,1,0,1,0,0|2,0,0]=4 3705 B11R1.53 O=C(O)[C@@H]1CCCCN1CF b60cc8661b897ad6dadfa25aed592a67 [0,1,0,1,0,0|2,0,0]=4 3706 B11R1.53 O=C(O)[C@@H]1CCCCN1CO 1797d9998a13c93a688e0dced50d88f8 [0,1,0,1,0,0|2,0,0]=4 3707 B11R1.53 O=C(O)[C@@H]1COCCN1CF f6e7def076d244d589c7cfd941bed02e [0,1,0,1,0,0|2,0,0]=4 3708 B11R1.53 O=C(O)[C@@H]1COCCN1CO c3bf7c6a468e7d5a5453cb31a4bd69ce [0,1,0,1,0,0|2,0,0]=4 3709 B11R1.53 O=C(O)[C@@H]1CSCCN1CF 9f60c905731680dbf0d9257be26502d2 [0,1,0,1,0,0|2,0,0]=4 3710 B11R1.53 O=C(O)[C@@H]1CSCCN1CO 548129fa3818cc4b42c7e63972c15e9b [0,1,0,1,0,0|2,0,0]=4 3711 B11R1.53 O=C(O)[C@H]1CCCCN1CF ed9720e01c313c693f0b3f314ea15507 [0,1,0,1,0,0|2,0,0]=4 3712 B11R1.53 O=C(O)[C@H]1CCCCN1CO ae5de522198bb26e4b7ecb78dfb11746 [0,1,0,1,0,0|2,0,0]=4 3713 B11R1.53 O=C(O)[C@H]1COCCN1CF b0b0b703f831f9fb373123ac7806a148 [0,1,0,1,0,0|2,0,0]=4 3714 B11R1.53 O=C(O)[C@H]1COCCN1CO e198f883a27174862e88d2a495cb47fc [0,1,0,1,0,0|2,0,0]=4 3715 B11R1.53 O=C(O)[C@H]1CSCCN1CF 8c884b22a9c287cef6bc19f8233fae4b [0,1,0,1,0,0|2,0,0]=4 3716 B11R1.53 O=C(O)[C@H]1CSCCN1CO 9984b05b620cf2817a5b202bbefd1fe2 [0,1,0,1,0,0|2,0,0]=4 3717 B11R1.143 CC(=O)N1CCCCCC1C 0b0f11c018b77ceb673643adf08c2408 [0,1,0,1,0,0|2,0,0]=4 3718 B11R1.225 CCN(C)C1CC(OC1=O)C 8d5ad896062a76a6681a4e8ca4944a90 [0,1,0,1,0,0|1,0,0]=3 3719 B11R1.471 CCN1CCC(C1C(=O)O)O b5306d3a9dd1fbfa677739816206b6c0 [0,1,0,1,0,0|1,0,0]=3 3720 B11R1.471 CCN1CC[C@@H]([C@@H]1C(=O)O)F 712b216f100f6dff8cb2340acbbadb3a [0,1,0,1,0,0|1,0,0]=3 3721 B11R1.471 CCN1CC[C@@H]([C@@H]1C(=O)O)O 903e1b97194c67789b3f53248d5c86c9 [0,1,0,1,0,0|1,0,0]=3 3722 B11R1.471 CCN1CC[C@@H]([C@H]1C(=O)N)O 972a0f9efc524a8fe5d3afe42b935bdd [0,1,0,1,0,0|2,0,0]=4 3723 B11R1.471 CCN1CC[C@@H]([C@H]1C(=O)O)C 4c7d5fe1a9c02bf6718ced526a6d8c5f [0,1,0,1,0,0|1,0,0]=3 3724 B11R1.471 CCN1CC[C@@H]([C@H]1C(=O)O)O b4264395e1ed292f688c5d6214d088f5 [0,1,0,1,0,0|1,0,0]=3 3725 B11R1.471 CCN1CC[C@H]([C@@H]1C(=O)O)O 1ce074ebf1b97b1b94473395b5c89119 [0,1,0,1,0,0|1,0,0]=3 3726 B11R1.471 CCN1CC[C@H]([C@H]1C(=O)O)F a69791ff660973614ab93a334a49424c [0,1,0,1,0,0|1,0,0]=3 3727 B11R1.471 CCN1CC[C@H]([C@H]1C(=O)O)O ab7ac0db3889e4f92e513d0338572d91 [0,1,0,1,0,0|1,0,0]=3 3728 B11R1.471 C[C@H]1CCN([C@@H]1C(=O)O)CF 0e13e3ac52ceeba6de721b16460929a7 [0,1,0,1,0,0|2,0,0]=4 3729 B11R1.471 C[C@H]1CCN([C@@H]1C(=O)O)CO a9fb8bc6716565541786da607d253625 [0,1,0,1,0,0|2,0,0]=4 3730 B11R1.471 O=C(O)C1C(CCN1CF)O e7900b613bc808f85c22808b1ae67588 [0,1,0,1,0,0|2,0,0]=4 3731 B11R1.471 O=C(O)C1C(CCN1CO)O 7f2e27ec9464b0eadc394466c58f8bc9 [0,1,0,1,0,0|2,0,0]=4 3732 B11R1.471 O=C(O)[C@@H]1[C@@H](CCN1CF)F c21c6be4a1a355386c80a6517aa3838a [0,1,0,1,0,0|2,0,0]=4 3733 B11R1.471 O=C(O)[C@@H]1[C@@H](CCN1CF)O f64868f72f7e06b05289099823f01aad [0,1,0,1,0,0|2,0,0]=4 3734 B11R1.471 O=C(O)[C@@H]1[C@@H](CCN1CO)F bb829133eea6583f95ce6a5fd4267209 [0,1,0,1,0,0|2,0,0]=4 3735 B11R1.471 O=C(O)[C@@H]1[C@@H](CCN1CO)O 9e248af9a7a0521e2c7ad48f71a65f0b [0,1,0,1,0,0|2,0,0]=4 3736 B11R1.471 O=C(O)[C@@H]1[C@H](CCN1CF)O 6d5aec549ef90acece3218af8723004b [0,1,0,1,0,0|2,0,0]=4 3737 B11R1.471 O=C(O)[C@@H]1[C@H](CCN1CO)O e5729cf892af3e32fb73a86891b76ed0 [0,1,0,1,0,0|2,0,0]=4 3738 B11R1.471 O=C(O)[C@H]1[C@@H](CCN1CF)O 639b58c05db65101eb76cb1b45952c6a [0,1,0,1,0,0|2,0,0]=4 3739 B11R1.471 O=C(O)[C@H]1[C@@H](CCN1CO)O 0ff96fa99b909e6957606415c1863782 [0,1,0,1,0,0|2,0,0]=4 3740 B11R1.471 O=C(O)[C@H]1[C@H](CCN1CF)F 3adb0f2bad5ed01f8d5ba8c1cc800bee [0,1,0,1,0,0|2,0,0]=4 3741 B11R1.471 O=C(O)[C@H]1[C@H](CCN1CF)O ed2f0c85d50ad2d7ec32bad327347828 [0,1,0,1,0,0|2,0,0]=4 3742 B11R1.471 O=C(O)[C@H]1[C@H](CCN1CO)F 51ffbcc76e1dcc165aea38953a26960c [0,1,0,1,0,0|2,0,0]=4 3743 B11R1.471 O=C(O)[C@H]1[C@H](CCN1CO)O 6035535635e4be4d820f94fc2ae00a31 [0,1,0,1,0,0|2,0,0]=4 3744 B11R1.527 C#CC(=O)N(CCC)C1CC1 2b18e9d6cd3b84ef20dbd9677cfb1be8 [0,1,0,1,0,0|2,0,0]=4 3745 B11R1.527 C=CC(=O)N(CCC)C1CC1 e877c510f6ceb174311dd937afeb684c [0,1,0,1,0,0|2,0,0]=4 3746 B11R1.527 CCCN(C(=O)C=O)C1CC1 8633282fc9fc3f6ff5557a334bd9babb [0,1,0,1,0,0|1,0,1]=4 3747 B11R1.527 CCCN(C(=O)CC)C1CC1 25ddc7e27aa23093a31fd8d60678e687 [0,1,0,1,0,0|2,0,0]=4 3748 B11R1.527 CCCN(C(=O)CF)C1CC1 cfcf05d607c9907d1681969daa4f128d [0,1,0,1,0,0|2,0,0]=4 3749 B11R1.527 CCCN(C(=O)CO)C1CC1 b98daf313b52642f1b6e9e3f62533bb2 [0,1,0,1,0,0|1,0,0]=3 3750 B11R1.527 CCCN(C(=O)CS)C1CC1 6f58fd4fe99fe03c5fd7b93076acafa0 [0,1,0,1,0,0|1,1,0]=4 3751 B11R1.527 CCNC(C(=O)OC)C1CC1 7719ed551d42a38529dcaa0d1c4b6c0c [0,1,0,1,0,0|1,0,0]=3 3752 B11R1.527 CCN[C@@H](C(=O)OC)C1CC1 7ae7c455bd82307989405de5c2af663f [0,1,0,1,0,0|1,0,0]=3 3753 B11R1.527 CCN[C@H](C(=O)OC)C1CC1 769710b05bff28432fe37b4bffe30421 [0,1,0,1,0,0|1,0,0]=3 3754 B11R1.527 COC(=O)C(NCF)C1CC1 624b511a519493d23e20978dba21cbd2 [0,1,0,1,0,0|2,0,0]=4 3755 B11R1.527 COC(=O)C(NCO)C1CC1 fa474326b127fda2f700bc67ae4e896e [0,1,0,1,0,0|2,0,0]=4 3756 B11R1.527 COC(=O)[C@@H](NCF)C1CC1 f1191d34f2908b9f6a63bc71030aca8e [0,1,0,1,0,0|2,0,0]=4 3757 B11R1.527 COC(=O)[C@@H](NCO)C1CC1 b5e6a041374800c57cab9a8a7fb1c642 [0,1,0,1,0,0|2,0,0]=4 3758 B11R1.527 COC(=O)[C@H](NCF)C1CC1 e0e126d8b2fe5ebec0dbe65f1968ce20 [0,1,0,1,0,0|2,0,0]=4 3759 B11R1.527 COC(=O)[C@H](NCO)C1CC1 04817678ba9a981f55431e7606387732 [0,1,0,1,0,0|2,0,0]=4 3760 B11R1.527 O=C(CO)N(CCO)C1CC1 2dbcfd751aab3c691934095dfbc94e52 [0,1,0,1,0,0|2,0,0]=4 3761 B11R1.760 CC(=O)C(CCO)N1CCC1 a2cc07d05ded33daaafbf74d013a5afd [0,1,0,1,0,0|2,0,0]=4 3762 B11R1.760 CCCC(C(=O)C)N1CCC1 1d37216e1956a9ba7413065ea99082c6 [0,1,0,1,0,0|1,0,0]=3 3763 B11R1.760 CCNC(C(=O)O)C1CCC1 a9e84d5cd0bad4e3fa2e46d8adfd9cac [0,1,0,1,0,0|1,0,0]=3 3764 B11R1.760 CCNC(C(=O)O)C1COC1 68edd3d0b5c9fca0ebff08e3cd1b8667 [0,1,0,1,0,0|1,0,0]=3 3765 B11R1.760 CCN[C@@H](C(=O)O)C1CCC1 7b75a84df46547fca0b2a0701b090107 [0,1,0,1,0,0|1,0,0]=3 3766 B11R1.760 CCN[C@@H](C(=O)O)C1COC1 d5bb0501d4631393a39108016d6cac7a [0,1,0,1,0,0|1,0,0]=3 3767 B11R1.760 CCN[C@H](C(=O)O)C1CCC1 59c291c1e854f7e64b0dd8c37c950a1d [0,1,0,1,0,0|1,0,0]=3 3768 B11R1.760 CCN[C@H](C(=O)O)C1COC1 f678ce540ac931323c817dd7a30996ca [0,1,0,1,0,0|1,0,0]=3 3769 B11R1.760 CCOC(C(=O)O)C1CCC1 95ea1a1e144d9e8ed8579fd46f34514b [0,1,0,1,0,0|1,0,0]=3 3770 B11R1.760 CCO[C@@H](C(=O)O)C1CCC1 87df978a5867e218a51485bcfdfce32b [0,1,0,1,0,0|1,0,0]=3 3771 B11R1.760 COCC(C(=O)O)N1CCC1 774426eb46aac8a068a0a79737a72811 [0,1,0,1,0,0|1,0,0]=3 3772 B11R1.760 O=C(O)C(NCF)C1CCC1 9a71edb4010c20493ad98c30e495090a [0,1,0,1,0,0|2,0,0]=4 3773 B11R1.760 O=C(O)C(NCF)C1COC1 2747929077d17112c61209300973fb72 [0,1,0,1,0,0|2,0,0]=4 3774 B11R1.760 O=C(O)C(NCO)C1CCC1 ab898c5fb39571271b1bb61899ac36c3 [0,1,0,1,0,0|2,0,0]=4 3775 B11R1.760 O=C(O)C(NCO)C1COC1 c2fa43266c07f52fb805145e235ece1b [0,1,0,1,0,0|2,0,0]=4 3776 B11R1.760 O=C(O)C(OCF)C1CCC1 8c631cb3f72d56747be9ade47b962cea [0,1,0,1,0,0|2,0,0]=4 3777 B11R1.760 O=C(O)[C@@H](NCF)C1CCC1 abb032840ede37fbaa840064c8c0ee76 [0,1,0,1,0,0|2,0,0]=4 3778 B11R1.760 O=C(O)[C@@H](NCF)C1COC1 733fc9bbb722d3042c88769f75a7e28a [0,1,0,1,0,0|2,0,0]=4 3779 B11R1.760 O=C(O)[C@@H](NCO)C1CCC1 00b119bdfa369d2afadca466752514cb [0,1,0,1,0,0|2,0,0]=4 3780 B11R1.760 O=C(O)[C@@H](NCO)C1COC1 45bbf3a82a01a1e57eebbd405320c6df [0,1,0,1,0,0|2,0,0]=4 3781 B11R1.760 O=C(O)[C@H](NCF)C1CCC1 bad1bd03e576b3e6264e48c97bbd244a [0,1,0,1,0,0|2,0,0]=4 3782 B11R1.760 O=C(O)[C@H](NCF)C1COC1 9cc0d0a5196f9787e1c00291882c135f [0,1,0,1,0,0|2,0,0]=4 3783 B11R1.760 O=C(O)[C@H](NCO)C1CCC1 b6cc97dd1a66a94e53a04e13524950b3 [0,1,0,1,0,0|2,0,0]=4 3784 B11R1.760 O=C(O)[C@H](NCO)C1COC1 d567197b912fb6ac2e9dba9a67a469dc [0,1,0,1,0,0|2,0,0]=4 3785 B11R1.760 O=C(O)[C@H](OCF)C1CCC1 d4e1e1bfc99f8de8424dd152e6f75f0e [0,1,0,1,0,0|2,0,0]=4 3786 B11R1.805 CC1(CC1)C(OCF)C(=O)O a570e11173eddee2b8202ed718380feb [0,1,0,1,0,0|2,0,0]=4 3787 B11R1.805 CCN[C@@H](C(=O)O)C1(CC1)O 7b3fd7da235498513e6d011c6732c580 [0,1,0,1,0,0|1,0,0]=3 3788 B11R1.805 CCN[C@H](C(=O)O)C1(CC1)O 13f0a693c2f16da3c554f5d8c1e603ff [0,1,0,1,0,0|1,0,0]=3 3789 B11R1.805 CCOC(C(=O)O)C1(CC1)C 2446745976992f4e564c489949a57be8 [0,1,0,1,0,0|1,0,0]=3 3790 B11R1.805 CCOC(C(=O)O)C1(CC1)F 099091190144c74fbbf9867858bc6b9e [0,1,0,1,0,0|1,0,0]=3 3791 B11R1.805 O=C(O)C(OCF)C1(CC1)F 1aa0c875f69baf6cc31842a0ea5127df [0,1,0,1,0,0|2,0,0]=4 3792 B11R1.805 O=C(O)[C@@H](NCF)C1(CC1)O 4d4d7df8a1547a68f161f9c619f41062 [0,1,0,1,0,0|2,0,0]=4 3793 B11R1.805 O=C(O)[C@@H](NCO)C1(CC1)O d604207b4653c753c4bde92dbfcb3591 [0,1,0,1,0,0|2,0,0]=4 3794 B11R1.805 O=C(O)[C@H](NCF)C1(CC1)O fe9ba91910a93ffc613926ed92402281 [0,1,0,1,0,0|2,0,0]=4 3795 B11R1.805 O=C(O)[C@H](NCO)C1(CC1)O 542acdce57cff06d229babc85cc7f565 [0,1,0,1,0,0|2,0,0]=4 3796 B11R1.980 CCC1CN([C@@H]1C(=O)O)CC 137a3574f8e5eb506ad82b5194eb7271 [0,1,0,1,0,0|1,0,0]=3 3797 B11R1.980 CCC1CN([C@@H]1C(=O)O)CF bbc7cb9bec6e7c27272479dfeea318e4 [0,1,0,1,0,0|2,0,0]=4 3798 B11R1.980 CCC1CN([C@@H]1C(=O)O)CO d416731cc28045808ac71e1a08a4fd5c [0,1,0,1,0,0|2,0,0]=4 3799 B11R1.5 CCNC1CCCCNC1=O 098d09f495a66ed384979d824580bfa2 [0,1,0,1,0,0|2,0,0]=4 3800 B11R1.5 CCN[C@@H]1CCCCNC1=O 7a7dafe68975c76ed141e35a2aec69d7 [0,1,0,1,0,0|2,0,0]=4 3801 B11R1.5 CCN[C@H]1CCCCNC1=O 2a68e47f98077e779c5902456b420aa5 [0,1,0,1,0,0|2,0,0]=4 3802 B11R1.5 CCOC1CCCCCC1=O 6f512a9e711095b873eeb84a2a48b1a3 [0,1,0,1,0,0|2,0,0]=4 3803 B11R1.13 CCNC1CCCN(C1=O)C ccd4f9fb53da2e6269db4a190a842de6 [0,1,0,1,0,0|2,0,0]=4 3804 B11R1.13 CCN[C@@H]1CCCN(C1=O)C c84a245eb1ff6af1affc242e83079afc [0,1,0,1,0,0|2,0,0]=4 3805 B11R1.13 CCN[C@H]1CCCN(C1=O)C 4c86c381e77047a06ab28b717a3492ec [0,1,0,1,0,0|2,0,0]=4 3806 B11R1.23 C#CC(=O)N1CCCC(C1)C ac67083ad4ab9a73fdc9e62ac8207110 [0,1,0,1,0,0|2,0,0]=4 3807 B11R1.23 C#CC(=O)N1CCC[C@@H](C1)C ae3aae037ac56e307ef994e306cac293 [0,1,0,1,0,0|2,0,0]=4 3808 B11R1.23 C#CC(=O)N1CCC[C@H](C1)C 91726797f4fcca6a952a5f73d008f0e2 [0,1,0,1,0,0|2,0,0]=4 3809 B11R1.23 C=CC(=O)N1CCCC(C1)C 071db2849b18a228ae599caa77caa86f [0,1,0,1,0,0|2,0,0]=4 3810 B11R1.23 C=CC(=O)N1CCC[C@@H](C1)C 8c1d00aa787c49662c438ddada7689f4 [0,1,0,1,0,0|2,0,0]=4 3811 B11R1.23 C=CC(=O)N1CCC[C@H](C1)C 8b7e11af966a640cf29917fa5daf12dd [0,1,0,1,0,0|2,0,0]=4 3812 B11R1.23 CC1CCCN(C1)C(=O)C=O fc16aa0c34ca78f8a62d27cad7a7bdeb [0,1,0,1,0,0|1,0,1]=4 3813 B11R1.23 CC1CCCN(C1)C(=O)CF 4a85552a56c49eb72866f31a5c81d31e [0,1,0,1,0,0|2,0,0]=4 3814 B11R1.23 CC1CCCN(C1)C(=O)CO 5a9b8d1293f3400687ec9093c0a4f784 [0,1,0,1,0,0|1,0,0]=3 3815 B11R1.23 CC1CCCN(C1)C(=O)CS 4094deda3b0a588cdd7c789f76e9aa64 [0,1,0,1,0,0|1,1,0]=4 3816 B11R1.23 CC1CN(CCO1)C(=O)CO b53e05d3d84d6a9c102cba59825c8456 [0,1,0,1,0,0|2,0,0]=4 3817 B11R1.23 CCC(=O)N1CCCC(C1)C 4e57e3dfb9866093b5cffcdef1d774b8 [0,1,0,1,0,0|2,0,0]=4 3818 B11R1.23 CCC(=O)N1CCC[C@@H](C1)C 155d25339585a6337863069b50c07a39 [0,1,0,1,0,0|2,0,0]=4 3819 B11R1.23 CCC(=O)N1CCC[C@H](C1)C 4efaf12040bbd4cc1a5e5a5062f987b9 [0,1,0,1,0,0|2,0,0]=4 3820 B11R1.23 C[C@@H]1CCCN(C1)C(=O)C=O d7b75cf711e4001c7d4df82df242904c [0,1,0,1,0,0|1,0,1]=4 3821 B11R1.23 C[C@@H]1CCCN(C1)C(=O)CF 9a1a47281aa08b6d718c361b45fd18a9 [0,1,0,1,0,0|2,0,0]=4 3822 B11R1.23 C[C@@H]1CCCN(C1)C(=O)CO f15c013290c68d93528ee03683adcdfd [0,1,0,1,0,0|1,0,0]=3 3823 B11R1.23 C[C@@H]1CCCN(C1)C(=O)CS 7f27178b073e176d61008d3c958c66e2 [0,1,0,1,0,0|1,1,0]=4 3824 B11R1.23 C[C@@H]1CN(CCO1)C(=O)CO f80df496f08c0a9f9f0e1c5e340c8bf7 [0,1,0,1,0,0|2,0,0]=4 3825 B11R1.23 C[C@H]1CCCN(C1)C(=O)C=O 6093b15ace88bc127962456c3021fc2a [0,1,0,1,0,0|1,0,1]=4 3826 B11R1.23 C[C@H]1CCCN(C1)C(=O)CF 37f231b40427401177e4f0bc76f7a585 [0,1,0,1,0,0|2,0,0]=4 3827 B11R1.23 C[C@H]1CCCN(C1)C(=O)CO 7779c9bac5d48a8eddc266b43a708414 [0,1,0,1,0,0|1,0,0]=3 3828 B11R1.23 C[C@H]1CCCN(C1)C(=O)CS d93e8330765759fa586de096815eb8ae [0,1,0,1,0,0|1,1,0]=4 3829 B11R1.23 C[C@H]1CN(CCO1)C(=O)CO 32a9f04fcb3806f6f8cf59eeb58776d0 [0,1,0,1,0,0|2,0,0]=4 3830 B11R1.23 O=C(CO)N1CCCC(C1)F e7e5f8d8ff99f13c72d01aac0cff6e68 [0,1,0,1,0,0|2,0,0]=4 3831 B11R1.23 O=C(CO)N1CCCC(C1)O 53a11ced452d3f968c076c6ae31253b7 [0,1,0,1,0,0|2,0,0]=4 3832 B11R1.23 O=C(CO)N1CCC[C@@H](C1)F f32fb37a795418c55cc82f157e7e7027 [0,1,0,1,0,0|2,0,0]=4 3833 B11R1.23 O=C(CO)N1CCC[C@@H](C1)O dc55870d5eb9500a412b83203631bb62 [0,1,0,1,0,0|2,0,0]=4 3834 B11R1.23 O=C(CO)N1CCC[C@H](C1)F 74ec00c49c453c3dc0c940093229f8cd [0,1,0,1,0,0|2,0,0]=4 3835 B11R1.23 O=C(CO)N1CCC[C@H](C1)O 368cdb7c0947334a1aeb848b99d4f50a [0,1,0,1,0,0|2,0,0]=4 3836 B11R1.59 C#CC(=O)N1CCCC1CC fb538397b576914d28b5e7e9e6dca3c5 [0,1,0,1,0,0|2,0,0]=4 3837 B11R1.59 C#CC(=O)N1CCC[C@H]1CC 3cc1db87c57795b34ced25c07c40b8d3 [0,1,0,1,0,0|2,0,0]=4 3838 B11R1.59 C=CC(=O)N1CCCC1CC 31afd921b77d2cb98e7a5c763493f979 [0,1,0,1,0,0|2,0,0]=4 3839 B11R1.59 C=CC(=O)N1CCC[C@H]1CC 3b37299cc59fceab3a7578c5970cf222 [0,1,0,1,0,0|2,0,0]=4 3840 B11R1.59 CCC(=O)N1CCCC1CC 2ce87378127394d65266906acf474f6e [0,1,0,1,0,0|2,0,0]=4 3841 B11R1.59 CCC(=O)N1CCC[C@H]1CC 6dd4884ad62ec61fc10830857b5556fa [0,1,0,1,0,0|2,0,0]=4 3842 B11R1.59 CCC1CCCN1C(=O)C=O f1df7d15d0a5438d7392311c4ab99a27 [0,1,0,1,0,0|1,0,1]=4 3843 B11R1.59 CCC1CCCN1C(=O)CF f1ec72c708cfe8359aeebefbb83a2bb0 [0,1,0,1,0,0|2,0,0]=4 3844 B11R1.59 CCC1CCCN1C(=O)CO a6fe23a8d97bd8a3bcaaf6c6878f2b20 [0,1,0,1,0,0|1,0,0]=3 3845 B11R1.59 CCC1CCCN1C(=O)CS 2990aaaad8906e7ab767552f7ab9c7d3 [0,1,0,1,0,0|1,1,0]=4 3846 B11R1.59 CCN1CCCC1C(=O)NC 4e0005b1af551fac9bc40da3c0ef3e15 [0,1,0,1,0,0|2,0,0]=4 3847 B11R1.59 CCN1CCCC1C(=O)OC 57fe510e52d7fd74edb8165001a3cb0f [0,1,0,1,0,0|1,0,0]=3 3848 B11R1.59 CCN1CCC[C@@H]1C(=O)NC 50fc31fc10eb1fd66448ab198ab633a3 [0,1,0,1,0,0|2,0,0]=4 3849 B11R1.59 CCN1CCC[C@H]1C(=O)NC 64bddbf68793da4b8296553b56b491f5 [0,1,0,1,0,0|2,0,0]=4 3850 B11R1.59 CCN1CCC[C@H]1C(=O)NO 2a956f6da47996609f8cf5c0a82f63fa [0,1,0,1,0,0|1,0,0]=3 3851 B11R1.59 CCN1CCC[C@H]1C(=O)OC dadddfa392d6d0edd0fd11c46811b3b9 [0,1,0,1,0,0|1,0,0]=3 3852 B11R1.59 CCN1CSCC1C(=O)OC 34bbdd28c55317ef263ed6b67ff014eb [0,1,0,1,0,0|2,0,0]=4 3853 B11R1.59 CCN1CSC[C@H]1C(=O)OC a9513961a2c57182379c47cbc8dd6f3c [0,1,0,1,0,0|2,0,0]=4 3854 B11R1.59 CC[C@@H]1CCCN1C(=O)C=O f0731dc4df7e6debb7f69265ecf30c1c [0,1,0,1,0,0|1,0,1]=4 3855 B11R1.59 CC[C@@H]1CCCN1C(=O)CF c56e06baf84edd593aecc5eb52dee85a [0,1,0,1,0,0|2,0,0]=4 3856 B11R1.59 CC[C@@H]1CCCN1C(=O)CO e9a793273f1ff379a973956361ab8bb9 [0,1,0,1,0,0|1,0,0]=3 3857 B11R1.59 CC[C@@H]1CCCN1C(=O)CS 7efc59165130ee1584e935438064b11b [0,1,0,1,0,0|1,1,0]=4 3858 B11R1.59 COC(=O)C1CCCN1CF 0d71f9d6b0cd7f18b5362fc49b9c812a [0,1,0,1,0,0|2,0,0]=4 3859 B11R1.59 COC(=O)C1CCCN1CO 753ccab52d36892144e40aaad29127ef [0,1,0,1,0,0|2,0,0]=4 3860 B11R1.59 COC(=O)[C@@H]1CCCN1CF 3cf375eef25821e889eca26766fb4f1a [0,1,0,1,0,0|2,0,0]=4 3861 B11R1.59 COC(=O)[C@@H]1CCCN1CO 72a5c73508812c745f7f922f87d07f09 [0,1,0,1,0,0|2,0,0]=4 3862 B11R1.59 COC1CCCN1C(=O)CO 0578a9bf22ccf53053792f0e6fe25128 [0,1,0,1,0,0|2,0,0]=4 3863 B11R1.59 O=C(CO)N1CCCC1CO a40fc2fdc917cc097d2ab870f928554e [0,1,0,1,0,0|2,0,0]=4 3864 B11R1.59 O=C(CO)N1CCC[C@@H]1CF 71a0866b15fb16b7f8298fb826a67eeb [0,1,0,1,0,0|2,0,0]=4 3865 B11R1.59 O=C(CO)N1CCC[C@@H]1CO 3acaa3f7e1f93f8d605791407683f932 [0,1,0,1,0,0|2,0,0]=4 3866 B11R1.59 O=C(CO)N1CCC[C@H]1CF 476f242ce5fa87f3a4621a54ac04727f [0,1,0,1,0,0|2,0,0]=4 3867 B11R1.59 O=C(CO)N1CCC[C@H]1CO 20d8ebe9d8e3712f5febc1fb49a41763 [0,1,0,1,0,0|2,0,0]=4 3868 B11R1.59 O=C(NO)[C@@H]1CCCN1CF f4e86a2c1ab18b8e449df19745392b94 [0,1,0,1,0,0|2,0,0]=4 3869 B11R1.59 O=C(NO)[C@@H]1CCCN1CO 986857c233ca2c018a51093e190ee110 [0,1,0,1,0,0|2,0,0]=4 3870 B11R1.226 CC1CN(CC1O)C(=O)CO f524de6519367de331e785e74b91063b [0,1,0,1,0,0|2,0,0]=4 3871 B11R1.226 C[C@@H]1CN(C[C@@H]1O)C(=O)CO 85654e9b727e74f3da0aee40f3985e85 [0,1,0,1,0,0|2,0,0]=4 3872 B11R1.768 COC(=O)C1(CCC1)NCO e6097c68a92b68b3a28186fc607ba433 [0,1,0,1,0,0|2,0,0]=4 3873 B11R1.852 C#CC(=O)N1CCCCCC1 5217ec2866b7af66855d0a8163c54e52 [0,1,0,1,0,0|2,0,0]=4 3874 B11R1.852 C=CC(=O)N1CCCCCC1 e5873e16e8d7ff10334d83ab064926bb [0,1,0,1,0,0|2,0,0]=4 3875 B11R1.852 CCC(=O)N1CCCCCC1 ad10cabe38a2ba06b9fbc202cc4d0017 [0,1,0,1,0,0|2,0,0]=4 3876 B11R1.852 CN(CO)C1CCCCCC1 2065b84ccd5f58a2f110ac8553179087 [0,1,0,1,0,0|2,0,0]=4 3877 B11R1.852 O=C(CF)N1CCCCCC1 1c95e42af8af133957704485dc4da987 [0,1,0,1,0,0|2,0,0]=4 3878 B11R1.852 O=C(CO)N1CCCCCC1 d1c31dd67819daac890df5180aa87f09 [0,1,0,1,0,0|1,0,0]=3 3879 B11R1.852 O=C(CO)N1CCCOCC1 f66135ce179e65849e76fd2d8d4970c8 [0,1,0,1,0,0|2,0,0]=4 3880 B11R1.852 O=C(CS)N1CCCCCC1 14f03e05a0fe91a27efd6a0d4c9ca632 [0,1,0,1,0,0|1,1,0]=4 3881 B11R1.852 O=CC(=O)N1CCCCCC1 7431d7858aca3be4e39cb356c3397529 [0,1,0,1,0,0|1,0,1]=4 3882 B11R1.17 C#CCOC1CCCOC1=O 6e4d1451eaa8f6dc237d1419a381dde6 [0,1,0,1,0,0|0,0,2]=4 3883 B11R1.17 C=CCOC1CCCOC1=O 81bfa0a6ffb92c604e94fa17ffd03406 [0,1,0,1,0,0|0,0,2]=4 3884 B11R1.17 CCCNC1CCCCC1=O 0cb59e2cec2f653dc474888b981af37e [0,1,0,1,0,0|1,0,0]=3 3885 B11R1.17 CCCNC1CCCCC1O a7a69cea9f0e251081de7c555541f76e [0,1,0,1,0,0|1,0,1]=4 3886 B11R1.17 CCCNC1CCCNC1=O 55abc9603bc8ad72c941140f99c710d8 [0,1,0,1,0,0|1,0,0]=3 3887 B11R1.17 CCCNC1COCCC1=O cc1336d3470e5f929ba83ad086081887 [0,1,0,1,0,0|2,0,0]=4 3888 B11R1.17 CCCNC1SCCCC1=O 8381da6070669fe6af4b89cf8bbf52f5 [0,1,0,1,0,0|2,0,0]=4 3889 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O 305c976006d68d744857563374a03bf7 [0,1,0,1,0,0|1,0,1]=4 3890 B11R1.17 CCCN[C@@H]1CCCNC1=O 7d1db2f72e530a6681cc97b5e4db3ee2 [0,1,0,1,0,0|1,0,0]=3 3891 B11R1.17 CCCN[C@H]1CCCC[C@@H]1O d1feb4a032f6483fe5a8ed49ec4dc95c [0,1,0,1,0,0|1,0,1]=4 3892 B11R1.17 CCCN[C@H]1CCCC[C@H]1O daad993687adc821be8d24c275cce592 [0,1,0,1,0,0|1,0,1]=4 3893 B11R1.17 CCCN[C@H]1CCCNC1=O 4916f2a94ebc0e2edb168ccc952724f1 [0,1,0,1,0,0|1,0,0]=3 3894 B11R1.17 CCCOC1CCCC=C1Br 4b592f5b2b05c930ea5eb16acb9a11e3 [0,1,0,1,0,0|2,0,0]=4 3895 B11R1.17 CCCOC1CCCCC1=O e4c34c8c4ab210cd57a1a2afd505d7df [0,1,0,1,0,0|1,0,0]=3 3896 B11R1.17 CCCOC1CCCNC1=O 0dd79fe7c8234340f8d36a3aacd0c241 [0,1,0,1,0,0|1,0,0]=3 3897 B11R1.17 CCCOC1CCCOC1=O bae7db991e4e9db8da62f6e44703e2f5 [0,1,0,1,0,0|0,0,0]=2 3898 B11R1.17 CCCOC1COCCC1=O 6e0c021772ee4b507917c743135eb078 [0,1,0,1,0,0|2,0,0]=4 3899 B11R1.17 CCCOC1SCCCC1=O 912f5c29d1c59e0444ed4666cb57956d [0,1,0,1,0,0|2,0,0]=4 3900 B11R1.17 CCCO[C@@H]1CCCNC1=O 63647725328b6ac5901edd510d2ccbd4 [0,1,0,1,0,0|1,0,0]=3 3901 B11R1.17 CCCO[C@H]1CCCNC1=O bce532d3fac664ccc027a489bde355a9 [0,1,0,1,0,0|1,0,0]=3 3902 B11R1.17 CCNCC1CCCCC1O 6f9959cd04171fe590f2e6148374867d [0,1,0,1,0,0|1,0,1]=4 3903 B11R1.17 CCOCC1CCCCC1=O 1418121428d59b49fd9e78a21f140e3d [0,1,0,1,0,0|1,0,0]=3 3904 B11R1.17 CCOCC1CCCNC1=O 8a41dbb5963950aeecb814af715ca666 [0,1,0,1,0,0|1,0,0]=3 3905 B11R1.17 COCNC1CCCNC1=O 68c991ddb51195679e7efbe35d50d455 [0,1,0,1,0,0|2,0,0]=4 3906 B11R1.17 COCN[C@@H]1CCCNC1=O f0b249091d8bdc6b34af909d6287cf6e [0,1,0,1,0,0|2,0,0]=4 3907 B11R1.17 COCN[C@H]1CCCNC1=O 7694fa3ff5f0d0b3a03d1647bc918a71 [0,1,0,1,0,0|2,0,0]=4 3908 B11R1.17 COCOC1CCCCC1=O 40c2ae16d1ea2c8c8ac779ae86b8465e [0,1,0,1,0,0|2,0,0]=4 3909 B11R1.17 COCOC1CCCNC1=O 81df45c8a0b4bea64707d71f9626af67 [0,1,0,1,0,0|2,0,0]=4 3910 B11R1.17 COCOC1CCCOC1=O 08d61923b975b41062abff82fa122ee8 [0,1,0,1,0,0|1,0,0]=3 3911 B11R1.17 COCO[C@@H]1CCCNC1=O 53c9c6b3feb831f4018d66d103ddca52 [0,1,0,1,0,0|2,0,0]=4 3912 B11R1.17 COCO[C@H]1CCCNC1=O 1fa4ee374558e3fd63a91dfc505a6b4b [0,1,0,1,0,0|2,0,0]=4 3913 B11R1.17 CSCNC1CCCNC1=O 7b65a5412f37e4e60263f317f6f77611 [0,1,0,1,0,0|2,0,0]=4 3914 B11R1.17 CSCN[C@@H]1CCCNC1=O d89576883b4d455b567980e82d53da9a [0,1,0,1,0,0|2,0,0]=4 3915 B11R1.17 CSCN[C@H]1CCCNC1=O 75334433e002a7313c04589f96f76c69 [0,1,0,1,0,0|2,0,0]=4 3916 B11R1.17 CSCOC1CCCCC1=O 02fecc013f186d2622128bee88943975 [0,1,0,1,0,0|2,0,0]=4 3917 B11R1.17 CSCOC1CCCNC1=O 03328cb230ee24c6e17ca65c676c9977 [0,1,0,1,0,0|2,0,0]=4 3918 B11R1.17 CSCOC1CCCOC1=O e670188ee651b11f79096e508bad6d6b [0,1,0,1,0,0|1,0,0]=3 3919 B11R1.17 CSCO[C@@H]1CCCNC1=O 7baa911a388459b92cf0737a22f68076 [0,1,0,1,0,0|2,0,0]=4 3920 B11R1.17 CSCO[C@H]1CCCNC1=O b44fcc670fe88048c050c3bc9ecbb1a5 [0,1,0,1,0,0|2,0,0]=4 3921 B11R1.17 N#CCOC1CCCOC1=O eb3b7030c2028d6b759687e5e54a47e0 [0,1,0,1,0,0|1,0,1]=4 3922 B11R1.17 O=C1CCCCC1COCF 25bbebcaccf0bfdc324c1d3648883a2d [0,1,0,1,0,0|2,0,0]=4 3923 B11R1.17 O=C1CCCCC1NCCI 43b317d86a6ed052fc4b71621ecfbed5 [0,1,0,1,0,0|2,0,0]=4 3924 B11R1.17 O=C1CCCCC1NCCO 90ee47ccf7f96346a67869b80f393421 [0,1,0,1,0,0|2,0,0]=4 3925 B11R1.17 O=C1CCCCC1NCCS 0d61179f00a6f609c429a53f8c5546d2 [0,1,0,1,0,0|2,0,0]=4 3926 B11R1.17 O=C1CCCCC1OCCF 752b273070ae9004da396d378d62e3a0 [0,1,0,1,0,0|2,0,0]=4 3927 B11R1.17 O=C1CCCCC1OCCS 11cd2cf2fe159c6c52530f28d1e1ce33 [0,1,0,1,0,0|2,0,0]=4 3928 B11R1.17 O=C1NCCCC1COCF 5062422dc03b6a7860d63d5234e66043 [0,1,0,1,0,0|2,0,0]=4 3929 B11R1.17 O=C1NCCCC1NCCF 01463875fbe8db99da4052d7b409401c [0,1,0,1,0,0|2,0,0]=4 3930 B11R1.17 O=C1NCCCC1NCCI ea177f0ee970a7b919e1065bbd2b6ff6 [0,1,0,1,0,0|2,0,0]=4 3931 B11R1.17 O=C1NCCCC1NCCO 158a0e1e942fc585d5a5db7721dd18c9 [0,1,0,1,0,0|2,0,0]=4 3932 B11R1.17 O=C1NCCCC1NCCS a316205e81cc1a34556f92bb93267322 [0,1,0,1,0,0|2,0,0]=4 3933 B11R1.17 O=C1NCCCC1OCCF c60a70911ea81c8e401aca9f8b8e3235 [0,1,0,1,0,0|2,0,0]=4 3934 B11R1.17 O=C1NCCCC1OCCS 0767951149d9d79ecdf8a62b1ab7bfc7 [0,1,0,1,0,0|2,0,0]=4 3935 B11R1.17 O=C1NCCC[C@@H]1NCCF 921bcf2e160a1bc47c6b8db171c347fb [0,1,0,1,0,0|2,0,0]=4 3936 B11R1.17 O=C1NCCC[C@@H]1NCCO 00e44fa47e2c777f3532b171331b4734 [0,1,0,1,0,0|2,0,0]=4 3937 B11R1.17 O=C1NCCC[C@@H]1NCCS 44ecc116410bfbe64e3af0a45d0083da [0,1,0,1,0,0|2,0,0]=4 3938 B11R1.17 O=C1NCCC[C@@H]1OCCF 6fbee89c2b75334c4ff88d28a9d72f20 [0,1,0,1,0,0|2,0,0]=4 3939 B11R1.17 O=C1NCCC[C@@H]1OCCS 3350d7a22cbc9d65ae0f039fb9cd53ba [0,1,0,1,0,0|2,0,0]=4 3940 B11R1.17 O=C1NCCC[C@H]1NCCF 7435a95b09b121725da38dfdbd0f3ee1 [0,1,0,1,0,0|2,0,0]=4 3941 B11R1.17 O=C1NCCC[C@H]1NCCO 4a81e6f030a7cccd02aa03931650e97f [0,1,0,1,0,0|2,0,0]=4 3942 B11R1.17 O=C1NCCC[C@H]1NCCS 8588eb2a8304e4f393efbdfef9904046 [0,1,0,1,0,0|2,0,0]=4 3943 B11R1.17 O=C1NCCC[C@H]1OCCF ef52a26a2e6afbba4f85556857ea68c5 [0,1,0,1,0,0|2,0,0]=4 3944 B11R1.17 O=C1NCCC[C@H]1OCCS eb674de704fb2083412720c51a1f54e6 [0,1,0,1,0,0|2,0,0]=4 3945 B11R1.17 O=C1OCCCC1OCCF a1dcf2c0aa2e72a8184b870390d26de0 [0,1,0,1,0,0|1,0,0]=3 3946 B11R1.17 O=C1OCCCC1OCCS c494101fa45a5e51ea26cdf362c8fddd [0,1,0,1,0,0|1,0,0]=3 3947 B11R1.17 O=CCOC1CCCOC1=O 81d31c362e0a7c70e40b0ea10c4c7da2 [0,1,0,1,0,0|1,0,1]=4 3948 B11R1.21 CC(=O)N1CCC(C(C1)C)O 7adeff6695cb5270011160152f5dc3c1 [0,1,0,1,0,0|2,0,0]=4 3949 B11R1.21 CC(=O)N1CCN(C(C1)C)C 50d8989ce0b4067e3d6ba0b493bac455 [0,1,0,1,0,0|2,0,0]=4 3950 B11R1.21 CC(=O)N1CCN([C@@H](C1)C)C 30c328e2aac0bc9794698641b1f0c483 [0,1,0,1,0,0|2,0,0]=4 3951 B11R1.21 CC(=O)N1CCN([C@H](C1)C)C f362f9a09f8a4b3ac5e292ed9eeee420 [0,1,0,1,0,0|2,0,0]=4 3952 B11R1.21 CC(=O)N1CC[C@H]([C@@H](C1)C)O 6e045e1c0a4cea2e681700268345db9d [0,1,0,1,0,0|2,0,0]=4 3953 B11R1.21 CC(=O)N1CC[C@H]([C@H](C1)C)O 59dac939275be5713eca67cfbad99426 [0,1,0,1,0,0|2,0,0]=4 3954 B11R1.48 CC(=O)N1C[C@@H]([C@H](C1)C)CO 9f6c4e1c680e161326b6fea93e5e7530 [0,1,0,1,0,0|2,0,0]=4 3955 B11R1.64 CC1SCC(N1CF)C(=O)O 51ff7e842a2dfd42e4eb7c045a60f994 [0,1,0,1,0,0|2,0,0]=4 3956 B11R1.64 CC1SCC(N1CO)C(=O)O 38fd853215d17a860abb2896820d1265 [0,1,0,1,0,0|2,0,0]=4 3957 B11R1.64 CCN1C(SCC1C(=O)O)C 2ddfad5f683ddfdf94df0eb1af18a76d [0,1,0,1,0,0|1,0,0]=3 3958 B11R1.230 C#CCNC1CC(OC1=O)C 58556a1b51d180ac5983cba6c66e62cf [0,1,0,1,0,0|0,0,2]=4 3959 B11R1.230 C#CCOC1CC(OC1=O)C f5e8fa303cc4b511c7657a23e780cc94 [0,1,0,1,0,0|0,0,2]=4 3960 B11R1.230 CC1CC(C(=O)O1)NCC#N c46861aa773af617f03d1855599f7df1 [0,1,0,1,0,0|1,0,1]=4 3961 B11R1.230 CC1CC(C(=O)O1)NCCBr 04ade738492c50bf7f707108a01838ad [0,1,0,1,0,0|1,0,0]=3 3962 B11R1.230 CC1CC(C(=O)O1)NCCF 5d4e96def386455a2b695f6bacd0f0a9 [0,1,0,1,0,0|1,0,0]=3 3963 B11R1.230 CC1CC(C(=O)O1)NCCI 4c60beccd3babdd2777a1eb5b1847c5a [0,1,0,1,0,0|1,0,0]=3 3964 B11R1.230 CC1CC(C(=O)O1)NCCO 2a7f81767f4e45359be36cc673ed4bce [0,1,0,1,0,0|1,0,0]=3 3965 B11R1.230 CC1CC(C(=O)O1)NCCS cbf6b654c9cd63d40a1a4c73122bb4d6 [0,1,0,1,0,0|1,0,0]=3 3966 B11R1.230 CC1CC(C(=O)O1)OCC#N e957745dfcffb37e10eb645a1dd0fabe [0,1,0,1,0,0|1,0,1]=4 3967 B11R1.230 CC1CC(C(=O)O1)OCCF 9fb52e5b497829b0c77116345efd3b05 [0,1,0,1,0,0|1,0,0]=3 3968 B11R1.230 CC1CC(C(=O)O1)OCCS 3b08dd579b7c53ce435447e10b9029a2 [0,1,0,1,0,0|1,0,0]=3 3969 B11R1.230 CCCNC1CC(OC1=O)C f4af22d6ae9871f61d8d94be3052aa15 [0,1,0,1,0,0|0,0,0]=2 3970 B11R1.230 CCCOC1CC(OC1=O)C ac43bc77e6d33437408bb02628b93fb2 [0,1,0,1,0,0|0,0,0]=2 3971 B11R1.230 CCCO[C@@H]1C[C@@H](NC1=O)C 0ff45f3b02bf67b3784044e9f0bf73df [0,1,0,1,0,0|1,0,0]=3 3972 B11R1.230 COCOC1CC(OC1=O)C ab8bfea20b46dd20f3958f974956a7a5 [0,1,0,1,0,0|1,0,0]=3 3973 B11R1.230 COCO[C@@H]1C[C@@H](NC1=O)C 0dbf13434137026017e13f43eaf0703b [0,1,0,1,0,0|2,0,0]=4 3974 B11R1.230 CSCO[C@@H]1C[C@@H](NC1=O)C 1b6d7015e9c1e06a1e2e941a492ca516 [0,1,0,1,0,0|2,0,0]=4 3975 B11R1.230 C[C@H]1C[C@H](C(=O)N1)OCCF 7e971cc57909655691c4f2b5dee79bd8 [0,1,0,1,0,0|2,0,0]=4 3976 B11R1.230 C[C@H]1C[C@H](C(=O)N1)OCCS a9bf2330978ac0ec1be724bc74cf0d82 [0,1,0,1,0,0|2,0,0]=4 3977 B11R1.233 CCCNC1CCCC1(C)O abfaa72394c628afaf72d4d43012f817 [0,1,0,1,0,0|1,0,1]=4 3978 B11R1.233 CCCN[C@@H]1CCC[C@@]1(C)O f77f495705152282870eef75ccd6d503 [0,1,0,1,0,0|1,0,1]=4 3979 B11R1.233 CCCN[C@H]1CCC[C@]1(C)O ecb4f2c5f4fbf9c549c5b8d3e3cbda1e [0,1,0,1,0,0|1,0,1]=4 3980 B11R1.233 CCOCC1CCCS1(=O)=O 3112f4318fbbe237d9b7adb966c16347 [0,1,0,1,0,0|1,0,1]=4 3981 B11R1.266 CC(=O)C1CCCN(C1)CF 77b04530c9c8fe5269f08db20a9afe5f [0,1,0,1,0,0|2,0,0]=4 3982 B11R1.266 CC(=O)C1CCCN(C1)CO 8261eb9d5d5ff16bb579067036d21f42 [0,1,0,1,0,0|2,0,0]=4 3983 B11R1.266 CC(=O)N1CCCC(C1)CO f42155112b7cd16fb4d18983687e3f89 [0,1,0,1,0,0|2,0,0]=4 3984 B11R1.266 CC(=O)N1CCC[C@@H](C1)CO 927e6b5616738fe79fde33f89557e4a2 [0,1,0,1,0,0|2,0,0]=4 3985 B11R1.266 CC(=O)N1CCC[C@H](C1)CO 4510891a7e792552f2acc330785aa4b4 [0,1,0,1,0,0|2,0,0]=4 3986 B11R1.266 CCC1CCCN(C1)C(=O)C ca0d6e4dee631bdae567e46ba016b820 [0,1,0,1,0,0|2,0,0]=4 3987 B11R1.266 CCN1CCC=C(C1)C(=O)O bd5d0a587e6607e4098300762726f647 [0,1,0,1,0,0|0,0,2]=4 3988 B11R1.266 CCN1CCCC(C1)C(=O)C 7f617dfaecf8f7824e363c0d9143c28b [0,1,0,1,0,0|1,0,0]=3 3989 B11R1.266 CCN1CCCC(C1)C(=O)N daf15f0550ba6cb25300a7e580f13777 [0,1,0,1,0,0|1,0,0]=3 3990 B11R1.266 CCN1CCCC(C1)C(=O)O 28b1470d766111c2957be20a8d45d958 [0,1,0,1,0,0|0,0,0]=2 3991 B11R1.266 CCN1CCCC(C1)C(C)O bf092082f1e9c04f29d7815236419cdc [0,1,0,1,0,0|1,0,1]=4 3992 B11R1.266 CCN1CCC[C@@H](C1)C(=O)N 936b687b6b771ab33dbd6480279f51dd [0,1,0,1,0,0|1,0,0]=3 3993 B11R1.266 CCN1CCC[C@@H](C1)C(=O)O 309277be4e0f7375cc336beae3e6ed94 [0,1,0,1,0,0|0,0,0]=2 3994 B11R1.266 CCN1CCC[C@H](C1)C(=O)N 33cc80d25913d6323816424dd8db6ab9 [0,1,0,1,0,0|1,0,0]=3 3995 B11R1.266 CCN1CCC[C@H](C1)C(=O)O 9b0c0dee0bedc13af0c6f07ce5fca89f [0,1,0,1,0,0|0,0,0]=2 3996 B11R1.266 CCN1CCOC(C1)C(=O)C 68a4dd80583a2c010806cae1931f7b52 [0,1,0,1,0,0|2,0,0]=4 3997 B11R1.266 CCN1CCOC(C1)C(=O)N 11c3db0d3b860368afb0e9e2dc9ec832 [0,1,0,1,0,0|2,0,0]=4 3998 B11R1.266 CCN1CCOC(C1)C(=O)O 34facf27caa98f3dbb050c923a3afb82 [0,1,0,1,0,0|1,0,0]=3 3999 B11R1.266 CCN1CCO[C@@H](C1)C(=O)O 3cd80a8f6f95ce298149e65adb302c64 [0,1,0,1,0,0|1,0,0]=3 4000 B11R1.266 CCN1CCO[C@H](C1)C(=O)O c40e4634821f5b4937ef0c702c4fa2af [0,1,0,1,0,0|1,0,0]=3 4001 B11R1.266 CCN1CCSC(C1)C(=O)O 8c057df49dd6ae347f877cd7db74dcf1 [0,1,0,1,0,0|1,0,0]=3 4002 B11R1.266 COC1CCCN(C1)C(=O)C f81e02993dc7f51c79536bb95682966d [0,1,0,1,0,0|2,0,0]=4 4003 B11R1.266 CO[C@@H]1CCCN(C1)C(=O)C 96d72ebcf3225605bc2a5dcfcb7a87c8 [0,1,0,1,0,0|2,0,0]=4 4004 B11R1.266 CO[C@H]1CCCN(C1)C(=O)C 5457dc6ecda4e49c55a508587e75b86a [0,1,0,1,0,0|2,0,0]=4 4005 B11R1.266 NC(=O)C1CCCN(C1)CF b1e1b2c12bc72b5f991a468a8cf25f2b [0,1,0,1,0,0|2,0,0]=4 4006 B11R1.266 NC(=O)C1CCCN(C1)CO f869d61414b8859c472c276688f75553 [0,1,0,1,0,0|2,0,0]=4 4007 B11R1.266 NC(=O)[C@@H]1CCCN(C1)CF df392df6184fd33c25d95fb2311e88ac [0,1,0,1,0,0|2,0,0]=4 4008 B11R1.266 NC(=O)[C@@H]1CCCN(C1)CO 4111cc604f9d6da7747c8e35919113dc [0,1,0,1,0,0|2,0,0]=4 4009 B11R1.266 NC(=O)[C@H]1CCCN(C1)CF d026f784039104ef76694a252b0254e9 [0,1,0,1,0,0|2,0,0]=4 4010 B11R1.266 NC(=O)[C@H]1CCCN(C1)CO 826f367eeb929191e6a507d170e1785d [0,1,0,1,0,0|2,0,0]=4 4011 B11R1.266 O=C(O)C1CCCN(C1)CF ceed25d342cb3fc235399cbd8505d246 [0,1,0,1,0,0|1,0,0]=3 4012 B11R1.266 O=C(O)C1CCCN(C1)CO a381596e32adf8b77f4338b0827e1d91 [0,1,0,1,0,0|1,0,0]=3 4013 B11R1.266 O=C(O)C1CN(CCO1)CF 8692d03225377f5bed4cb5749d9316df [0,1,0,1,0,0|2,0,0]=4 4014 B11R1.266 O=C(O)C1CN(CCO1)CO d91aca615dde01f9532a06b93e2da032 [0,1,0,1,0,0|2,0,0]=4 4015 B11R1.266 O=C(O)C1CN(CCS1)CF 71eb00422d6cfaa93d59e0b1e480a918 [0,1,0,1,0,0|2,0,0]=4 4016 B11R1.266 O=C(O)C1CN(CCS1)CO e9f549281efb943bf9da7d0d1077ad20 [0,1,0,1,0,0|2,0,0]=4 4017 B11R1.266 O=C(O)[C@@H]1CCCN(C1)CF 98f4760baa1b091572c917aa1f6bbdfc [0,1,0,1,0,0|1,0,0]=3 4018 B11R1.266 O=C(O)[C@@H]1CCCN(C1)CO 8a48e3e9d2eb67d5157b280cd20198f9 [0,1,0,1,0,0|1,0,0]=3 4019 B11R1.266 O=C(O)[C@@H]1CN(CCO1)CF dffeb693815699df6d8d37d13737c690 [0,1,0,1,0,0|2,0,0]=4 4020 B11R1.266 O=C(O)[C@@H]1CN(CCO1)CO 891d48a91a43e6af78418133bd8688a5 [0,1,0,1,0,0|2,0,0]=4 4021 B11R1.266 O=C(O)[C@H]1CCCN(C1)CF 78111171e5e39d066ef68cc901a73060 [0,1,0,1,0,0|1,0,0]=3 4022 B11R1.266 O=C(O)[C@H]1CCCN(C1)CO a47d0df0535c253180a62abd6b0ecb6a [0,1,0,1,0,0|1,0,0]=3 4023 B11R1.266 O=C(O)[C@H]1CN(CCO1)CF c05b8bb14725a5a8854723e036af803a [0,1,0,1,0,0|2,0,0]=4 4024 B11R1.266 O=C(O)[C@H]1CN(CCO1)CO 00b42d1fa9b8c202dca340c8eca31860 [0,1,0,1,0,0|2,0,0]=4 4025 B11R1.420 C#CCNC(C(=O)O)C1CC1 3d00998eb993e639433527a0811c94bb [0,1,0,1,0,0|0,0,2]=4 4026 B11R1.420 C#CCN[C@@H](C(=O)O)C1CC1 36967da98920ecb6dd0e1beb7b26a618 [0,1,0,1,0,0|0,0,2]=4 4027 B11R1.420 C#CCN[C@H](C(=O)O)C1CC1 7e76233c909ddfe0b5b3ce7eef39cbb3 [0,1,0,1,0,0|0,0,2]=4 4028 B11R1.420 C#CCOC(C(=O)O)C1CC1 6d6c858aa0e8f1dd6146894cf87bad92 [0,1,0,1,0,0|0,0,2]=4 4029 B11R1.420 C#CCO[C@@H](C(=O)O)C1CC1 c3358d853ae7c1971b8bc99e580ac5ac [0,1,0,1,0,0|0,0,2]=4 4030 B11R1.420 C#CCO[C@H](C(=O)O)C1CC1 a087a0595e583c8ae3ff917267815aed [0,1,0,1,0,0|0,0,2]=4 4031 B11R1.420 C=CCNC(C(=O)O)C1CC1 8272f744631fd9861f7c8d98a598d362 [0,1,0,1,0,0|0,0,2]=4 4032 B11R1.420 C=CCN[C@@H](C(=O)O)C1CC1 07392c7981b709d1c2a95121f6f8b8f4 [0,1,0,1,0,0|0,0,2]=4 4033 B11R1.420 C=CCN[C@H](C(=O)O)C1CC1 f219fac2f1b525bbd202920643f845c6 [0,1,0,1,0,0|0,0,2]=4 4034 B11R1.420 C=CCOC(C(=O)O)C1CC1 c1d9ab4d2c1ef9ed19b2d6ac02c889a4 [0,1,0,1,0,0|0,0,2]=4 4035 B11R1.420 C=CCO[C@@H](C(=O)O)C1CC1 8ca0b04837c968e7d4f4137d4615b6e4 [0,1,0,1,0,0|0,0,2]=4 4036 B11R1.420 C=CCO[C@H](C(=O)O)C1CC1 aa3ce890f82c63cf9fb5c56429ed21e2 [0,1,0,1,0,0|0,0,2]=4 4037 B11R1.420 CCCNC(C(=O)N)C1CC1 5c357eb7fd01e40d2c238c1f41685869 [0,1,0,1,0,0|1,0,0]=3 4038 B11R1.420 CCCNC(C(=O)O)C1CC1 455c691d4531d0395eb539653eca9826 [0,1,0,1,0,0|0,0,0]=2 4039 B11R1.420 CCCN[C@@H](C(=O)N)C1CC1 2bd38ce08576dfaa79a9cad4c451036e [0,1,0,1,0,0|1,0,0]=3 4040 B11R1.420 CCCN[C@@H](C(=O)O)C1CC1 d4b961c274bf92e5b560f0c02238aa5c [0,1,0,1,0,0|0,0,0]=2 4041 B11R1.420 CCCN[C@H](C(=O)N)C1CC1 c4c00d88bb588bece42941d508538260 [0,1,0,1,0,0|1,0,0]=3 4042 B11R1.420 CCCN[C@H](C(=O)O)C1CC1 c3828e7a5e555f399476afd80364de50 [0,1,0,1,0,0|0,0,0]=2 4043 B11R1.420 CCCOC(C(=O)N)C1CC1 6ef3c33b748c91bd2308d9a9611079fd [0,1,0,1,0,0|1,0,0]=3 4044 B11R1.420 CCCOC(C(=O)O)C1CC1 df6b06785277389e0cf5ceb95ec8637c [0,1,0,1,0,0|0,0,0]=2 4045 B11R1.420 CCCO[C@@H](C(=O)O)C1CC1 418d631ba0767152538777e56ef918f6 [0,1,0,1,0,0|0,0,0]=2 4046 B11R1.420 CCCO[C@H](C(=O)O)C1CC1 3971c20dca62f74835d4585d578c288b [0,1,0,1,0,0|0,0,0]=2 4047 B11R1.420 COCNC(C(=O)N)C1CC1 74161c2b760bb9e1dbca8e6c3ca63b1f [0,1,0,1,0,0|2,0,0]=4 4048 B11R1.420 COCNC(C(=O)O)C1CC1 a5c8f0eebf099c71d949309d47cbadd9 [0,1,0,1,0,0|1,0,0]=3 4049 B11R1.420 COCN[C@@H](C(=O)N)C1CC1 ceca9b9350a8a177e9578e52ece90af8 [0,1,0,1,0,0|2,0,0]=4 4050 B11R1.420 COCN[C@@H](C(=O)O)C1CC1 4c2f9d61b7c878bf35bec4505bd9317e [0,1,0,1,0,0|1,0,0]=3 4051 B11R1.420 COCN[C@H](C(=O)N)C1CC1 d1eebe2a55fefac0886fdacd014a8de5 [0,1,0,1,0,0|2,0,0]=4 4052 B11R1.420 COCN[C@H](C(=O)O)C1CC1 6f2c28f98a87f0453edd20d2c07a7cd8 [0,1,0,1,0,0|1,0,0]=3 4053 B11R1.420 COCOC(C(=O)N)C1CC1 f71744e7ad139dbef60f3d47f03f7924 [0,1,0,1,0,0|2,0,0]=4 4054 B11R1.420 CSCNC(C(=O)N)C1CC1 5b122410cc1d511b1c01b82e92f36699 [0,1,0,1,0,0|2,0,0]=4 4055 B11R1.420 CSCNC(C(=O)O)C1CC1 d5ca0b32996360e01392d57270b056d7 [0,1,0,1,0,0|1,0,0]=3 4056 B11R1.420 CSCN[C@@H](C(=O)N)C1CC1 31ea5174d93f05e6a227cbc5995666d6 [0,1,0,1,0,0|2,0,0]=4 4057 B11R1.420 CSCN[C@@H](C(=O)O)C1CC1 cbcabe8278e8b1ee2cd69c7be378ecb8 [0,1,0,1,0,0|1,0,0]=3 4058 B11R1.420 CSCN[C@H](C(=O)N)C1CC1 cc7a6fc611828f3b73fe5f69ce4c17bf [0,1,0,1,0,0|2,0,0]=4 4059 B11R1.420 CSCN[C@H](C(=O)O)C1CC1 b1b0311080ab812fda8821dea746f9b4 [0,1,0,1,0,0|1,0,0]=3 4060 B11R1.420 CSCOC(C(=O)N)C1CC1 cfb81395676d8a01adb25132034bcc29 [0,1,0,1,0,0|2,0,0]=4 4061 B11R1.420 CSCOC(C(=O)O)C1CC1 6a2e5b3da6d0d61194f0813cfbf0352b [0,1,0,1,0,0|1,0,0]=3 4062 B11R1.420 CSCO[C@@H](C(=O)O)C1CC1 af3fb69d2d02fd3fe38cbc818bb379e8 [0,1,0,1,0,0|1,0,0]=3 4063 B11R1.420 CSCO[C@H](C(=O)O)C1CC1 796899b7c6a3c3bb4785a5b51f9b886f [0,1,0,1,0,0|1,0,0]=3 4064 B11R1.420 N#CCNC(C(=O)O)C1CC1 ab5e8fe5bb7952f902655b7b5a7f1de3 [0,1,0,1,0,0|1,0,1]=4 4065 B11R1.420 N#CCN[C@@H](C(=O)O)C1CC1 b0ec52eb0e5a94d8ea3d0b6afc7dfbad [0,1,0,1,0,0|1,0,1]=4 4066 B11R1.420 N#CCN[C@H](C(=O)O)C1CC1 170233828efccf6c7ece3b3950d64f75 [0,1,0,1,0,0|1,0,1]=4 4067 B11R1.420 N#CCOC(C(=O)O)C1CC1 325ec61cc301d1d565a904743d54033c [0,1,0,1,0,0|1,0,1]=4 4068 B11R1.420 N#CCO[C@@H](C(=O)O)C1CC1 e52bb5bd71a6f2c28192bb8d2750e596 [0,1,0,1,0,0|1,0,1]=4 4069 B11R1.420 N#CCO[C@H](C(=O)O)C1CC1 de49c2494ca67dde3db0a289817bcfe2 [0,1,0,1,0,0|1,0,1]=4 4070 B11R1.420 NC(=O)C(NCCF)C1CC1 b8140591125e6885c1f38adbcdae3965 [0,1,0,1,0,0|2,0,0]=4 4071 B11R1.420 NC(=O)C(NCCO)C1CC1 6d86fc742b1958265b70567d954778d9 [0,1,0,1,0,0|2,0,0]=4 4072 B11R1.420 NC(=O)C(NCCS)C1CC1 4261897f5aa228586c2852bb92bb0810 [0,1,0,1,0,0|2,0,0]=4 4073 B11R1.420 NC(=O)C(OCCF)C1CC1 5e5fd9581dd59fbb8c4eb12705b0e5cc [0,1,0,1,0,0|2,0,0]=4 4074 B11R1.420 NC(=O)C(OCCS)C1CC1 7f5db5656147e9e41f958bc77ef39a32 [0,1,0,1,0,0|2,0,0]=4 4075 B11R1.420 NC(=O)[C@@H](NCCF)C1CC1 c854508d7c37ab09d110d7414a12091a [0,1,0,1,0,0|2,0,0]=4 4076 B11R1.420 NC(=O)[C@@H](NCCO)C1CC1 c096d46d83e817dac4f7c2f3407cb787 [0,1,0,1,0,0|2,0,0]=4 4077 B11R1.420 NC(=O)[C@@H](NCCS)C1CC1 6f0a2212634b46bb14c3706e5bd747df [0,1,0,1,0,0|2,0,0]=4 4078 B11R1.420 NC(=O)[C@H](NCCF)C1CC1 074355141b406daada80ebad9e99f0b4 [0,1,0,1,0,0|2,0,0]=4 4079 B11R1.420 NC(=O)[C@H](NCCO)C1CC1 d42d66bab90df8efac0a428b699ff78e [0,1,0,1,0,0|2,0,0]=4 4080 B11R1.420 NC(=O)[C@H](NCCS)C1CC1 11808f0a4946178fec839247c10ff517 [0,1,0,1,0,0|2,0,0]=4 4081 B11R1.420 O=C(O)C(NCCF)C1CC1 e7fe5bd92515ef6ea65fa1477b375a22 [0,1,0,1,0,0|1,0,0]=3 4082 B11R1.420 O=C(O)C(NCCO)C1CC1 d8038ee336245b27c5c814aafc823153 [0,1,0,1,0,0|1,0,0]=3 4083 B11R1.420 O=C(O)C(NCCS)C1CC1 467df0e45c4aa07545ba28e39c3cd260 [0,1,0,1,0,0|1,0,0]=3 4084 B11R1.420 O=C(O)C(OCCF)C1CC1 53e84fb9b8c8d1bc041e6d643a933312 [0,1,0,1,0,0|1,0,0]=3 4085 B11R1.420 O=C(O)C(OCCS)C1CC1 60d954a7b1b7b7858cb722cc708cfbde [0,1,0,1,0,0|1,0,0]=3 4086 B11R1.420 O=C(O)[C@@H](NCCF)C1CC1 9305b01b360d9a600bc42535ad02b9e4 [0,1,0,1,0,0|1,0,0]=3 4087 B11R1.420 O=C(O)[C@@H](NCCO)C1CC1 9e69bc67e5071dbec7981270a0d2c3c0 [0,1,0,1,0,0|1,0,0]=3 4088 B11R1.420 O=C(O)[C@@H](NCCS)C1CC1 a1b6bc3e3da0041e17cc93888dc1de83 [0,1,0,1,0,0|1,0,0]=3 4089 B11R1.420 O=C(O)[C@@H](OCCF)C1CC1 60c7423a125e4312736ae187d090cc55 [0,1,0,1,0,0|1,0,0]=3 4090 B11R1.420 O=C(O)[C@@H](OCCS)C1CC1 2d72122426418896e0996c9e519faf49 [0,1,0,1,0,0|1,0,0]=3 4091 B11R1.420 O=C(O)[C@H](NCCF)C1CC1 0676a0ca3c9e3729cbec267bd02a57c6 [0,1,0,1,0,0|1,0,0]=3 4092 B11R1.420 O=C(O)[C@H](NCCO)C1CC1 ac9cce098cad9e4e4e1d055dbfc71fa1 [0,1,0,1,0,0|1,0,0]=3 4093 B11R1.420 O=C(O)[C@H](NCCS)C1CC1 1a4a27f862c9fd9edd3697bf2667c2bf [0,1,0,1,0,0|1,0,0]=3 4094 B11R1.420 O=C(O)[C@H](OCCF)C1CC1 2ae9f5bc5bf88ed67bf982914482cd07 [0,1,0,1,0,0|1,0,0]=3 4095 B11R1.420 O=C(O)[C@H](OCCS)C1CC1 993e0137588ff3e6cc89698d14dad6c1 [0,1,0,1,0,0|1,0,0]=3 4096 B11R1.420 O=CCNC(C(=O)O)C1CC1 e73d6d877e163c15f8358df86be51a97 [0,1,0,1,0,0|1,0,1]=4 4097 B11R1.420 O=CCN[C@@H](C(=O)O)C1CC1 b31da54c9c635750c2a197abe3a2675b [0,1,0,1,0,0|1,0,1]=4 4098 B11R1.420 O=CCN[C@H](C(=O)O)C1CC1 82b0d76ed9bde55ef92d6d45de2f33a9 [0,1,0,1,0,0|1,0,1]=4 4099 B11R1.420 O=CCOC(C(=O)O)C1CC1 1a000bf07dae374ea88d2bb63974a487 [0,1,0,1,0,0|1,0,1]=4 4100 B11R1.420 O=CCO[C@@H](C(=O)O)C1CC1 c065247f5d96808db942eb7f0f044b37 [0,1,0,1,0,0|1,0,1]=4 4101 B11R1.420 O=CCO[C@H](C(=O)O)C1CC1 b0d7797c06536f4f40297ef92b3eb035 [0,1,0,1,0,0|1,0,1]=4 4102 B11R1.565 CC(=O)N1CCCC(CC1)C 0c9587fec1108a5850215ac415a6d746 [0,1,0,1,0,0|2,0,0]=4 4103 B11R1.565 CC(=O)N1CCCC(CC1)F 915e30e048d9a491acf41fe1321e215c [0,1,0,1,0,0|2,0,0]=4 4104 B11R1.565 CC(=O)N1CCCC(CC1)O a5a31536ab5c5569640f751e53c17fc8 [0,1,0,1,0,0|2,0,0]=4 4105 B11R1.565 CC(=O)N1CCCN(CC1)C afc3122bb1f4de47ef10b14a402a8344 [0,1,0,1,0,0|2,0,0]=4 4106 B11R1.565 CC(=O)N1CCC[C@@H](CC1)O 486148636055b72d2ceae9c7fe667aef [0,1,0,1,0,0|2,0,0]=4 4107 B11R1.565 CC(=O)N1CCC[C@H](CC1)O fb7a7287697369fbda7ffe704edcb7c7 [0,1,0,1,0,0|2,0,0]=4 4108 B11R1.706 CC(=O)N1CCCCCCC1 ff71a082476683b4f8504acf30a24baa [0,1,0,1,0,0|2,0,0]=4 4109 B11R1.905 C#CCNC1(CCC1)C(=O)O d2d2cf3a4f579c4d716df77798545245 [0,1,0,1,0,0|0,0,2]=4 4110 B11R1.905 C=CCNC1(CCC1)C(=O)O 42470bca0c37efb2eebe268decc064e3 [0,1,0,1,0,0|0,0,2]=4 4111 B11R1.905 CCCNC1(CCC1)C(=O)N 152a17a963fc017af19cd36de0cd803a [0,1,0,1,0,0|1,0,0]=3 4112 B11R1.905 CCCNC1(CCC1)C(=O)O 57a601b4fbf8463082854f68aebeefbb [0,1,0,1,0,0|0,0,0]=2 4113 B11R1.905 CCCNC1(CCC1)C(=S)N e401ff33a845b00c1abe7bf9ce510d8f [0,1,0,1,0,0|1,1,0]=4 4114 B11R1.905 CCCNC1(COC1)C(=O)N 202a729cbe5b483ff09607f75d80f448 [0,1,0,1,0,0|2,0,0]=4 4115 B11R1.905 CCCNC1(COC1)C(=O)O 5e6acd028bbe16951f713e2532a28d1b [0,1,0,1,0,0|1,0,0]=3 4116 B11R1.905 CCCNC1(CSC1)C(=O)O b5b94f55e7ff600e53cf71ffa6c1947b [0,1,0,1,0,0|1,0,0]=3 4117 B11R1.905 CCOCC1(CCC1)C(=O)N 9953f5a0d7eaad50a05fe9a303a53124 [0,1,0,1,0,0|1,0,0]=3 4118 B11R1.905 CCOCC1(CCC1)C(=O)O 6c433745590370db3994a3f9941e242e [0,1,0,1,0,0|0,0,0]=2 4119 B11R1.905 CCOCC1(COC1)C(=O)O b1eebabc0c6665c9f8b284c7b390bdb5 [0,1,0,1,0,0|1,0,0]=3 4120 B11R1.905 COCNC1(CCC1)C(=O)N 42d41fffea0350742fee528352aaa1ce [0,1,0,1,0,0|2,0,0]=4 4121 B11R1.905 CSCNC1(CCC1)C(=O)N 5f38d67027a9cffa2f9d326ad764d15b [0,1,0,1,0,0|2,0,0]=4 4122 B11R1.905 CSCNC1(CCC1)C(=O)O 811ac2305fc75ff13b4716db095a27c3 [0,1,0,1,0,0|1,0,0]=3 4123 B11R1.905 CSCNC1(CSC1)C(=O)O 40468163d70c65b974ec900e2766aad6 [0,1,0,1,0,0|2,0,0]=4 4124 B11R1.905 N#CCNC1(CCC1)C(=O)O 20b722dd2e22ae5347a3bd556dc9e1d2 [0,1,0,1,0,0|1,0,1]=4 4125 B11R1.905 N#CNCC1(CCC1)C(=O)O ef2fb49caacb9f93c6dc5592dadfa3f9 [0,1,0,1,0,0|1,0,1]=4 4126 B11R1.905 NC(=O)C1(CCC1)COCF 0f576d9ca88f542968ecf747f577423c [0,1,0,1,0,0|2,0,0]=4 4127 B11R1.905 NC(=O)C1(CCC1)NCCF 1eb292db275746ef6bdea1ac6d20b129 [0,1,0,1,0,0|2,0,0]=4 4128 B11R1.905 NC(=O)C1(CCC1)NCCO b699d9c8e729a04f5c50b5030fc17430 [0,1,0,1,0,0|2,0,0]=4 4129 B11R1.905 NC(=O)C1(CCC1)NCCS 2b1c25b258ca04c49863539ff46440cb [0,1,0,1,0,0|2,0,0]=4 4130 B11R1.905 O=C(O)C1(CCC1)COCF f1cf95c2de0121be85534197fb8ad9cd [0,1,0,1,0,0|1,0,0]=3 4131 B11R1.905 O=C(O)C1(CCC1)NCCF e8ce91de3c3ff123b0637bba734290ab [0,1,0,1,0,0|1,0,0]=3 4132 B11R1.905 O=C(O)C1(CCC1)NCCO 7e9ff699c1df3d3e5ab191629589c059 [0,1,0,1,0,0|1,0,0]=3 4133 B11R1.905 O=C(O)C1(CCC1)NCCS de1727a68da9d90bd69caa887d603c0b [0,1,0,1,0,0|1,0,0]=3 4134 B11R1.905 O=C(O)C1(COC1)COCF 3710baa33ece6adc7344c80c50380157 [0,1,0,1,0,0|2,0,0]=4 4135 B11R1.905 O=C(O)C1(COC1)NCCO 9f92d11aa7235c3cfb9ca17ba8b770c4 [0,1,0,1,0,0|2,0,0]=4 4136 B11R1.905 O=C(O)C1(COC1)NCCS d56f27aa5eba4b6951cc59d5d39e9839 [0,1,0,1,0,0|2,0,0]=4 4137 B11R1.905 O=C(O)C1(CSC1)NCCF 14d9695b208e5a7487f2feb03f4c7ce0 [0,1,0,1,0,0|2,0,0]=4 4138 B11R1.905 O=C(O)C1(CSC1)NCCO 45868338dcabe3c644f643222ea7c9ed [0,1,0,1,0,0|2,0,0]=4 4139 B11R1.905 O=C(O)C1(CSC1)NCCS 72307a9b314a620fd3fff982d67f7fb5 [0,1,0,1,0,0|2,0,0]=4 4140 B11R1.905 O=CCNC1(CCC1)C(=O)O e617592ef397b7377dc4504c7f558d9d [0,1,0,1,0,0|1,0,1]=4 4141 B11R1.1239 CCNC1(CCCC1)C(=O)N d7ddd095c3a6638226aa5953506d353a [0,1,0,1,0,0|2,0,0]=4 4142 B11R1.1239 CCNC1(CCCC1)C(=O)O 7853b17a8186cd50faeab1383bcf7d07 [0,1,0,1,0,0|1,0,0]=3 4143 B11R1.1239 CCNC1(CCOC1)C(=O)O 15e917df167a5b514aef712f85f6f31a [0,1,0,1,0,0|1,0,0]=3 4144 B11R1.1239 CCNC1(CCSC1)C(=O)O 41a0ee4812c3cf923c770ec585322e39 [0,1,0,1,0,0|1,0,0]=3 4145 B11R1.1239 CCN[C@@]1(CCOC1)C(=O)O 3afd944786837190fa4818d7cfd40e28 [0,1,0,1,0,0|1,0,0]=3 4146 B11R1.1239 CCN[C@]1(CCOC1)C(=O)O fa233e9054306f17937a9fec2ae59f62 [0,1,0,1,0,0|1,0,0]=3 4147 B11R1.1239 O=C(O)C1(CCCC1)NCF 917e168d4e0a25afa0177abb3493dd11 [0,1,0,1,0,0|2,0,0]=4 4148 B11R1.1239 O=C(O)C1(CCCC1)NCO deedbcd954a841c64dbef35500be40fb [0,1,0,1,0,0|2,0,0]=4 4149 B11R1.1239 O=C(O)C1(CCOC1)NCF 9422463fface6225466f6731553c7a39 [0,1,0,1,0,0|2,0,0]=4 4150 B11R1.1239 O=C(O)C1(CCOC1)NCO 711a757dd48d65a40b17a9b788ee3ef3 [0,1,0,1,0,0|2,0,0]=4 4151 B11R1.1239 O=C(O)C1(CCSC1)NCF cf39ffd4c13c7c41acc4d61077751b1c [0,1,0,1,0,0|2,0,0]=4 4152 B11R1.1239 O=C(O)C1(CCSC1)NCO 3fae1dc2d5c31d9670e750b45d12912c [0,1,0,1,0,0|2,0,0]=4 4153 B11R1.1239 O=C(O)[C@@]1(CCOC1)NCF c1bc2ffbb54395faeac4f156892bbb76 [0,1,0,1,0,0|2,0,0]=4 4154 B11R1.1239 O=C(O)[C@@]1(CCOC1)NCO 28be12823534eec4fc3227552df0461a [0,1,0,1,0,0|2,0,0]=4 4155 B11R1.1239 O=C(O)[C@]1(CCOC1)NCF d9e8d22c58d04ac2694737f5aa8393ca [0,1,0,1,0,0|2,0,0]=4 4156 B11R1.1239 O=C(O)[C@]1(CCOC1)NCO 06be82f47f4793d29dfe3c271695c2ab [0,1,0,1,0,0|2,0,0]=4 4157 B11R1.421 CC1(CCCN1CF)C(=O)O ae63ac4d34589c4dc9106f235cb9a346 [0,1,0,1,0,0|2,0,0]=4 4158 B11R1.421 CC1(CCCN1CO)C(=O)O 385a7db6fd8dbf2487149bdb9e5f944c [0,1,0,1,0,0|2,0,0]=4 4159 B11R1.421 CCN1CCCC1(C)C(=O)O 4322ebc4e2588bece5fee6b8fcf0245c [0,1,0,1,0,0|1,0,0]=3 4160 B11R1.421 CCN1CCC[C@@]1(C)C(=O)N c755e15d7cfa87c653b8bfbc713caeca [0,1,0,1,0,0|2,0,0]=4 4161 B11R1.421 CCN1CCC[C@@]1(C)C(=O)O 41aa10bfb2e5973c365a924fa121a4db [0,1,0,1,0,0|1,0,0]=3 4162 B11R1.421 CCN1CCC[C@]1(C)C(=O)O b342af4b52817276153fc9dc54709be7 [0,1,0,1,0,0|1,0,0]=3 4163 B11R1.421 CCN1CCSC1(C)C(=O)O d95cacf88b4764e2b55b99c1e28b9975 [0,1,0,1,0,0|2,0,0]=4 4164 B11R1.421 C[C@@]1(CCCN1CF)C(=O)O d45da79b73808048cf02341577df054a [0,1,0,1,0,0|2,0,0]=4 4165 B11R1.421 C[C@@]1(CCCN1CO)C(=O)O bbdb9847a475bbd1dd20c0e0dca54620 [0,1,0,1,0,0|2,0,0]=4 4166 B11R1.421 C[C@]1(CCCN1CF)C(=O)O 9ebe550e988d1d5e96db7a7479d13ef8 [0,1,0,1,0,0|2,0,0]=4 4167 B11R1.421 C[C@]1(CCCN1CO)C(=O)O debd9ec1abf19e8ab5d79c86a041d17b [0,1,0,1,0,0|2,0,0]=4 4168 B11R1.1418 CC(NCF)(C(=O)O)C1CC1 75ca37eff7fa707188dee0b7698d08d6 [0,1,0,1,0,0|2,0,0]=4 4169 B11R1.1418 CC(NCO)(C(=O)O)C1CC1 8613fa9218f68b71114eeb27ca5ca4a9 [0,1,0,1,0,0|2,0,0]=4 4170 B11R1.1418 CCNC(C)(C(=O)O)C1CC1 ec8fcea3580194ff6b5e976b5a018427 [0,1,0,1,0,0|1,0,0]=3 4171 B11R2.167 CCN1CC2CC1C(=O)N2 a7169525e771127ccbdc0111139bcb56 [0,0,0,2,0,0|2,0,0]=4 4172 B11R2.167 CCN1C[C@@H]2C[C@H]1C(=O)N2 023d6de4c9c7d0431bb6e6eea8e3d723 [0,0,0,2,0,0|2,0,0]=4 4173 B11R2.167 CCN1C[C@H]2C[C@@H]1C(=O)N2 b4dfae78ac3f1e54fac638f8103aad4f [0,0,0,2,0,0|2,0,0]=4 4174 B11R2.824 CC(=O)N1C2CCC1CC2 03fa0afe35e2b1875ebccdc62e280ee5 [0,0,0,2,0,0|2,0,0]=4 4175 B11R2.824 CC(=O)N1[C@H]2CC[C@@H]1CC2 bb0824b30b24742919f8bc0e3edae056 [0,0,0,2,0,0|2,0,0]=4 4176 B11R2.845 CC(=O)N1CC2CCC1C2 385da044f803c3658eaf6205f7c45b18 [0,0,0,2,0,0|2,0,0]=4 4177 B11R2.845 CC(=O)N1C[C@@H]2CC[C@H]1C2 091d1dc4f2ba9af11a5947aacab8edb2 [0,0,0,2,0,0|2,0,0]=4 4178 B11R2.845 CC(=O)N1C[C@H]2CC[C@@H]1C2 049c179e37bf694487eaee700ba6c76d [0,0,0,2,0,0|2,0,0]=4 4179 B11R2.1852 CC(=O)N1C2C1CCCC2 1ac38bd168268a7b023f716d059aa634 [0,0,0,2,0,0|2,0,0]=4 4180 B11R2.814 CC(=O)N1CC2C1CCC2 b66cf4cc41f614540ee6f24fdee08dfd [0,0,0,2,0,0|2,0,0]=4 4181 B11R2.814 CC(=O)N1C[C@H]2[C@@H]1CCC2 f5a3d79dc235cd39c2fa6c2c93ea603f [0,0,0,2,0,0|2,0,0]=4 4182 B11R2.842 CC(=O)N1CC2CCC2C1 7eb2171ce43333196f6381ab44e5d4e9 [0,0,0,2,0,0|2,0,0]=4 4183 B11R2.839 CC(=O)N1CCC2CC2C1 e08f204b16cf8f8250d1dacf3d1f81a6 [0,0,0,2,0,0|2,0,0]=4 4184 B11R2.837 CC(=O)N(C1CC1)C2CC2 cc6360d42128c7cc828294c3c86f1e5c [0,0,0,2,0,0|2,0,0]=4 4185 B11R0.280 C=C(Br)CNC(CCC)CCC 1eb0868fc868752ef1f9470058d39b21 [0,0,0,0,0,2|2,0,0]=4 4186 B11R0.280 C=C(Br)COC(CCC)CCC 4a94a500ee5707ab491369b9081e7938 [0,0,0,0,0,2|2,0,0]=4 4187 B11R0.280 C=C(C)CNC(CCC)CCC f683a58e817cb8b367e248875117a6ff [0,0,0,0,0,2|2,0,0]=4 4188 B11R0.280 C=C(C)COC(CCC)CCC 90445e1daf0d02109d98cf3a8cc311e4 [0,0,0,0,0,2|2,0,0]=4 4189 B11R0.280 C=C(Cl)CNC(CCC)CCC b0ac141110a8ac8a9bcec7979c13aa26 [0,0,0,0,0,2|2,0,0]=4 4190 B11R0.280 C=C(Cl)COC(CCC)CCC 1b7157dfdec12201a89a323127fce85c [0,0,0,0,0,2|2,0,0]=4 4191 B11R0.280 C=C(F)COC(CCC)CCC 72f710f4129a6d10664a6dec9c47e92b [0,0,0,0,0,2|2,0,0]=4 4192 B11R0.280 C=C(I)COC(CCC)CCC 32812527cf4300cc20209470d0416345 [0,0,0,0,0,2|2,0,0]=4 4193 B11R0.280 CCCC(CCC)NCC(=O)C 833da7eedffec9361c52416f77e4f958 [0,0,0,0,0,2|1,0,0]=3 4194 B11R0.280 CCCC(CCC)NCC(=O)N abddf1b51c62a4257a9823e8a2671bc9 [0,0,0,0,0,2|1,0,0]=3 4195 B11R0.280 CCCC(CCC)NCC(=O)O ffbc4fcb894c26a78f04fd5410d48350 [0,0,0,0,0,2|0,0,0]=2 4196 B11R0.280 CCCC(CCC)NCC(C)O 66a8bb4fed07165064787b4c5a95d191 [0,0,0,0,0,2|1,0,1]=4 4197 B11R0.280 CCCC(CCC)NC[C@@H](C)O f9fb895e6f81e42450bc9f84331818ff [0,0,0,0,0,2|1,0,1]=4 4198 B11R0.280 CCCC(CCC)NC[C@H](C)O 8b439e287844bfbe3ad745a6722f931b [0,0,0,0,0,2|1,0,1]=4 4199 B11R0.280 CCCC(CCC)NC[N+](=O)[O-] 72597cc83a7c0ac4a707bd2b2025f17f [0,0,0,0,0,2|1,0,1]=4 4200 B11R0.280 CCCC(CCC)OCC(=O)C d732fcb25f98148e5701eb038f90c6ae [0,0,0,0,0,2|1,0,0]=3 4201 B11R0.280 CCCC(CCC)OCC(=O)N 06ba7f5102c6d14baca362d4f57c858d [0,0,0,0,0,2|1,0,0]=3 4202 B11R0.280 CCCC(CCC)OCC(=O)O 82028908e65f1789899ce56b7642c927 [0,0,0,0,0,2|0,0,0]=2 4203 B11R0.280 CCCC(CCC)OCC(=S)N fa047e3f750bd9894233e7a4efa24b23 [0,0,0,0,0,2|1,1,0]=4 4204 B11R0.280 CCCC(CCC)OCS(=O)O 71a964b56cd44ec587dabc1d830b447a [0,0,0,0,0,2|1,0,0]=3 4205 B11R0.280 CCCC(CCC)OC[N+](=O)[O-] 33436b37b4b50f5ccfaab89bd2ded416 [0,0,0,0,0,2|1,0,1]=4 4206 B11R0.280 CCCC(CCO)NCC(=O)N 24a8c9206a46f40eee66faf7d40e5ad5 [0,0,0,0,0,2|2,0,0]=4 4207 B11R0.280 CCCC(CCO)NCC(=O)O a4d3cb5d04042006dd58bc379544863b [0,0,0,0,0,2|1,0,0]=3 4208 B11R0.280 CCCN(CCC)CCC(=O)C bac41b7f9a9f294c1a25c0ae4104aaea [0,0,0,0,0,2|2,0,0]=4 4209 B11R0.280 CCCN(CCC)CCC(=O)N 3d910c824eb6d2ba65cfb1402d8aa2d3 [0,0,0,0,0,2|2,0,0]=4 4210 B11R0.280 CCCN(CCC)CCC(=O)O 2fd0f8730000bf6896af941420d45315 [0,0,0,0,0,2|1,0,0]=3 4211 B11R0.280 CCCN(CCC)COC(=O)C c9375e4e64347f5cf09bbb5bed4929f7 [0,0,0,0,0,2|2,0,0]=4 4212 B11R0.280 CCCN(CCC)CSC(=O)N 5c13fa902bb4ea2192e39aebd3486f5a [0,0,0,0,0,2|2,0,0]=4 4213 B11R0.280 CCCN(CCO)CCC(=O)O a1373a0d7592da866e42114040cd727d [0,0,0,0,0,2|2,0,0]=4 4214 B11R0.280 CCNC(CCC(=O)O)CSC 95707ec4b3e320f0df72a2ed3bda9c86 [0,0,0,0,0,2|2,0,0]=4 4215 B11R0.280 COCC(CCO)NCC(=O)O be004cfa7ee7f38ca63dfb8c26e2ea0c [0,0,0,0,0,2|2,0,0]=4 4216 B11R0.280 COCC(COC)NCC(=O)O e074f63a9345168b861a9bf63c8a142a [0,0,0,0,0,2|2,0,0]=4 4217 B11R0.280 COCC(COC)OCC(=O)O ccb1fb682dd3e27c901185bae7d159de [0,0,0,0,0,2|2,0,0]=4