0 B12R0.41 C=C(C)CN(CC(=O)N)CC(=O)N 2230a_100000232323_100000748629 [0,0,0,0,0,0|4,0,0]=4 1 B12R0.41 C=C(F)CN(CC(=O)N)CC(=O)N 2230a_100000232323_100009893438 [0,0,0,0,0,0|4,0,0]=4 2 B12R0.41 CC(O)CN(CC(=O)N)CC(=O)N 2230a_100000232323_100011218427 [0,0,0,0,0,0|3,0,1]=4 3 B12R0.41 C[C@@H](O)CN(CC(=O)N)CC(=O)N 2230a_100000232323_100009817552 [0,0,0,0,0,0|3,0,1]=4 4 B12R0.41 NC(=O)CN(CC(=O)N)CC(=O)N 2230a_100000232323_100000747473 [0,0,0,0,0,0|3,0,0]=3 5 B11R0.35 C#CCN(CC(=O)N)CC(=O)O 269956a_100011236498_100000187820 [1,0,0,0,0,0|2,0,1]=4 6 B11R0.35 C#CCN(CC(=O)[O-])CC(=O)O 269956a_100011236498_100020667443 [1,0,0,0,0,0|1,0,2]=4 7 B11R0.35 C=C(C)CN(CCO)CC(=O)O 269956a_100000747938_100000748629 [1,0,0,0,0,0|2,0,1]=4 8 B11R0.35 C=C(F)CN(CCO)CC(=O)O 269956a_100000747938_100000042424 [1,0,0,0,0,0|2,0,1]=4 9 B11R0.35 C=CCN(CC(=C)C)CC(=O)O 269956a_100000744315_100000748629 [1,0,0,0,0,0|3,0,0]=4 10 B11R0.35 C=CCN(CC(=C)F)CC(=O)O 269956a_100000744315_100000042424 [1,0,0,0,0,0|3,0,0]=4 11 B11R0.35 C=CCN(CC(=O)N)CC(=O)N 2230a_100000232323_100000210623 [1,0,0,0,0,0|3,0,0]=4 12 B11R0.35 C=CCN(CC(=O)N)CC(=O)O 269956a_100000744315_100000187820 [1,0,0,0,0,0|2,0,0]=3 13 B11R0.35 C=CCN(CC(=O)O)CC(C)O 269956a_100000744315_100011218427 [1,0,0,0,0,0|2,0,1]=4 14 B11R0.35 C=CCN(CC(=O)O)C[C@@H](C)O 269956a_100000744315_100009817552 [1,0,0,0,0,0|2,0,1]=4 15 B11R0.35 C=CCN(CC(=O)O)C[N+](=O)[O-] 269956a_100000744315_100000761209 [1,0,0,0,0,0|2,0,1]=4 16 B11R0.35 C=CCN(CC(=O)[O-])CC(=O)O 269956a_100000744315_100020667443 [1,0,0,0,0,0|1,0,1]=3 17 B11R0.35 CC(O)CN(CCO)CC(=O)O 269956a_100000747938_100011218427 [1,0,0,0,0,0|1,0,2]=4 18 B11R0.35 C[C@@H](O)CN(CCO)CC(=O)O 269956a_100000747938_100009817552 [1,0,0,0,0,0|1,0,2]=4 19 B11R0.35 NC(=O)CN(CC=O)CC(=O)N 2230a_100000232323_200015260668 [1,0,0,0,0,0|2,0,0]=3 20 B11R0.35 NC(=O)CN(CCO)CC(=O)N 2230a_100000232323_100000211926 [1,0,0,0,0,0|2,0,1]=4 21 B11R0.35 NC(=O)CN(CCO)CC(=O)O 269956a_100000747938_100000187820 [1,0,0,0,0,0|1,0,1]=3 22 B11R0.35 O=C(O)CN(CCO)C[N+](=O)[O-] 269956a_100000747938_100000761209 [1,0,0,0,0,0|1,0,2]=4 23 B11R0.35 O=C([O-])CN(CCO)CC(=O)O 269956a_100000747938_100020667443 [1,0,0,0,0,0|0,0,2]=3 24 B13R0.52 CC(=O)C(C)N(CC(=O)N)CC(=O)N 2230a_100000232323_100009814033 [0,1,0,0,0,0|3,0,0]=4 25 B13R0.52 CC(C(=O)N)N(CC(=O)N)CC(=O)N 2230a_100000232323_100000702099 [0,1,0,0,0,0|3,0,0]=4 26 B13R0.52 NC(=O)CN(CC(=O)N)C(F)C(=O)N 2230a_100000232323_100009813875 [0,1,0,0,0,0|3,0,0]=4 27 B13R0.197 CNC(=O)CN(CC(=O)N)CC(=O)N 2230a_100000232323_100000183359 [0,1,0,0,0,0|3,0,0]=4 28 B13R0.197 COC(=O)CN(CC(=O)N)CC(=O)N 2230a_100000232323_100000747449 [0,1,0,0,0,0|2,0,0]=3 29 B13R1.3487 NC(=O)CN1C[C@H](C[C@H]1C(=O)O)O 269956a_100000750407_100000187820 [0,0,0,1,0,0|2,0,1]=4 30 B13R1.3487 O=C([O-])CN1C[C@H](C[C@H]1C(=O)O)O 269956a_100000750407_100020667443 [0,0,0,1,0,0|1,0,2]=4 31 B11R0.32 CC(=O)N(CC(=O)N)CC(=O)N 11a_100000232323_100015343762 [0,0,0,0,1,0|3,0,0]=4 32 B11R0.32 CC(=O)N(CC(=O)N)CC(=O)N 1626a_100000232323_100015343762 [0,0,0,0,1,0|3,0,0]=4 33 B13R0.177 NC(=O)CCN(CC(=O)N)CC(=O)N 2230a_100000232323_100000744528 [0,0,0,0,0,1|3,0,0]=4 34 B10R0.70 CCN(CC(=O)N)CC(=O)O 269956a_100000746405_100000187820 [2,0,0,0,0,0|1,0,1]=4 35 B10R0.70 CCN(CC(=O)[O-])CC(=O)O 269956a_100000746405_100020667443 [2,0,0,0,0,0|0,0,2]=4 36 B10R0.70 NC(=O)CN(CO)CC(=O)[O-] 269956a_100016989150_100000187820 [2,0,0,0,0,0|1,0,1]=4 37 B10R0.70 O=C([O-])CN(CO)CC(=O)[O-] 269956a_100016989150_100020667443 [2,0,0,0,0,0|0,0,2]=4 38 B10R0.79 C#CCN(CC=O)CC(=O)O 269956a_100011236498_200015260668 [2,0,0,0,0,0|1,0,1]=4 39 B10R0.79 C=CCN(CC=C)CC(=O)O 269956a_100000744315_100000210623 [2,0,0,0,0,0|2,0,0]=4 40 B10R0.79 C=CCN(CC=O)CC(=O)O 269956a_100000744315_200015260668 [2,0,0,0,0,0|1,0,0]=3 41 B10R0.79 C=CCN(CCO)CC(=O)O 269956a_100000744315_100000211926 [2,0,0,0,0,0|1,0,1]=4 42 B10R0.79 C=CCN(CCO)CC(=O)O 269956a_100000747938_100000210623 [2,0,0,0,0,0|1,0,1]=4 43 B10R0.79 O=C(O)CN(CCO)CCO 269956a_100000747938_100000211926 [2,0,0,0,0,0|0,0,2]=4 44 B10R0.79 O=CCN(CCO)CC(=O)O 269956a_100000747938_200015260668 [2,0,0,0,0,0|0,0,1]=3 45 B12R0.53 C=CCN(CC(=O)O)C(C)C(=O)C 269956a_100000744315_100009814033 [1,1,0,0,0,0|2,0,0]=4 46 B12R0.53 CC(=O)C(C)N(CCO)CC(=O)O 269956a_100000747938_100009814033 [1,1,0,0,0,0|1,0,1]=4 47 B12R0.53 CC(C(=O)O)N(CCO)CC(=O)N 269956a_100011300695_100000187820 [1,1,0,0,0,0|1,0,1]=4 48 B12R0.53 CC(C(=O)O)N(CCO)CC(=O)[O-] 269956a_100011300695_100020667443 [1,1,0,0,0,0|0,0,2]=4 49 B12R0.399 C#CCN(CC(=O)O)CC(=O)OC 269956a_100011236498_100000747449 [1,1,0,0,0,0|1,0,1]=4 50 B12R0.399 C=CCN(CC(=O)O)CC(=O)CC 269956a_100000744315_100000747405 [1,1,0,0,0,0|2,0,0]=4 51 B12R0.399 C=CCN(CC(=O)O)CC(=O)NC 269956a_100000744315_100000183359 [1,1,0,0,0,0|2,0,0]=4 52 B12R0.399 C=CCN(CC(=O)O)CC(=O)OC 269956a_100000744315_100000747449 [1,1,0,0,0,0|1,0,0]=3 53 B12R0.399 CCC(=O)CN(CCO)CC(=O)O 269956a_100000747938_100000747405 [1,1,0,0,0,0|1,0,1]=4 54 B12R0.399 CNC(=O)CN(CCO)CC(=O)O 269956a_100000747938_100000183359 [1,1,0,0,0,0|1,0,1]=4 55 B12R0.399 COC(=O)CN(CCO)CC(=O)O 269956a_100000747938_100000747449 [1,1,0,0,0,0|0,0,1]=3 56 B14R0.530 COC(=O)CCN(CC(=O)N)CC(=O)N 2230a_100000232323_100000204255 [0,1,0,0,0,1|2,0,0]=4 57 B14R0.127 COC(=O)C(C)N(CC(=O)N)CC(=O)N 2230a_100000232323_100000211248 [0,2,0,0,0,0|2,0,0]=4 58 B14R0.28 C=COC(=O)CN(CC(=O)N)CC(=O)N 2230a_100000232323_100000036128 [0,2,0,0,0,0|2,0,0]=4 59 B14R0.28 CCOC(=O)CN(CC(=O)N)CC(=O)N 2230a_100000232323_100000188475 [0,2,0,0,0,0|2,0,0]=4 60 B14R0.28 NC(=O)CN(CC(=O)N)CC(=O)NCO 2230a_100000232323_100000185155 [0,2,0,0,0,0|2,0,0]=4 61 B14R0.1458 C=C(C)CN(CC(=O)OC)CC(=O)OC 2230a_100000750971_100000748629 [0,2,0,0,0,0|2,0,0]=4 62 B14R0.1458 C=C(F)CN(CC(=O)OC)CC(=O)OC 2230a_100000750971_100009893438 [0,2,0,0,0,0|2,0,0]=4 63 B14R0.1458 COC(=O)CN(CC(=O)N)CC(=O)OC 2230a_100000750971_100000747473 [0,2,0,0,0,0|1,0,0]=3 64 B14R0.1458 COC(=O)CN(CC(=O)OC)CC(C)O 2230a_100000750971_100011218427 [0,2,0,0,0,0|1,0,1]=4 65 B14R0.1458 COC(=O)CN(CC(=O)OC)C[C@@H](C)O 2230a_100000750971_100009817552 [0,2,0,0,0,0|1,0,1]=4 66 B12R1.276 O=CCN1C[C@H](C[C@H]1C(=O)O)O 269956a_100000750407_200015260668 [1,0,0,1,0,0|1,0,1]=4 67 B12R1.392 NC(=O)CN1CC=C[C@H]1C(=O)O 269956a_100000057196_100000187820 [1,0,0,1,0,0|2,0,0]=4 68 B12R1.392 O=C([O-])CN1CC=C[C@H]1C(=O)O 269956a_100000057196_100020667443 [1,0,0,1,0,0|1,0,1]=4 69 B14R1.3299 COC(=O)CN1C[C@H](C[C@H]1C(=O)O)O 269956a_100000750407_100000747449 [0,1,0,1,0,0|1,0,1]=4 70 B12R0.52 C=CCN(CCC(=O)C)CC(=O)O 269956a_100000744315_100000053229 [1,0,0,0,0,1|2,0,0]=4 71 B12R0.52 C=CCN(CCC(=O)N)CC(=O)O 269956a_100000744315_100000744528 [1,0,0,0,0,1|2,0,0]=4 72 B12R0.52 C=CCN(COC(=O)C)CC(=O)O 269956a_100000744315_100000076356 [1,0,0,0,0,1|2,0,0]=4 73 B12R0.52 CC(=O)CCN(CCO)CC(=O)O 269956a_100000747938_100000053229 [1,0,0,0,0,1|1,0,1]=4 74 B12R0.52 CC(=O)OCN(CCO)CC(=O)O 269956a_100000747938_100000076356 [1,0,0,0,0,1|1,0,1]=4 75 B12R0.52 NC(=O)CCN(CCO)CC(=O)O 269956a_100000747938_100000744528 [1,0,0,0,0,1|1,0,1]=4