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[0,1,0,0,0,0|1,0,0]=2 16 B10R0.53 CC[C@H](NC(=O)OC)C(=O)O 93827 [0,1,0,0,0,0|1,0,0]=2 17 B10R0.53 CC[C@H](NC(=O)OC)C(=O)O 93828 [0,1,0,0,0,0|1,0,0]=2 18 B10R0.162 CC(=O)O[C@H](C(=O)O)C(C)C C11725 [0,1,0,0,0,0|2,0,0]=3 19 B10R1.30 CC[C@@H]1NC(=O)CNC1=O D72769 [0,0,0,1,0,0|2,0,0]=3 20 B10R1.59 C[C@H]1OC(=O)N[C@@H]1C(=O)O 93924 [0,0,0,1,0,0|2,0,0]=3 21 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O AC4019 [0,0,0,1,0,0|2,0,1]=4 22 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 70893 [0,0,0,1,0,0|3,0,0]=4 23 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 C14251 [0,0,0,1,0,0|3,0,0]=4 24 B10R1.113 O=C1CNC[C@@H](C(=O)O)N1 76385 [0,0,0,1,0,0|1,0,0]=2 25 B10R1.113 O=C1CSC[C@@H](C(=O)O)N1 AT25443 [0,0,0,1,0,0|0,0,0]=1 26 B10R1.359 CC1(C)CC[C@@H](C(=O)O)N1 AT23798 [0,0,0,1,0,0|2,0,1]=4 27 B10R1.361 CC(=O)N1CC[C@H]1C(=O)O A50756 [0,0,0,1,0,0|1,0,0]=2 28 B10R1.442 NC(=O)NC1(C(=O)O)CC1 AT25782 [0,0,0,1,0,0|2,0,0]=3 29 B10R0.70 C=C(C)C[C@H](CN)CC(=O)O F19500 [0,0,0,0,0,1|3,0,0]=4 30 B10R0.70 CC(C)=C[C@H](CN)CC(=O)O F19337 [0,0,0,0,0,1|3,0,0]=4 31 B7R0.15 CC[C@@H](CN)C(=O)O 97589 [2,0,0,0,0,0|1,0,1]=4 32 B7R0.2 CC(=O)N[C@@H](C)CO C91213 [2,0,0,0,0,0|0,0,1]=3 33 B7R0.6 C=C(Br)CNC(C)=O AC9658 [2,0,0,0,0,0|2,0,0]=4 34 B7R0.6 CC(=S)NCC(=O)O D92690 [2,0,0,0,0,0|0,1,0]=3 35 B9R0.14 CC(=O)N[C@H](CO)CCO AB10263 [1,1,0,0,0,0|0,1,1]=4 36 B9R0.11 C=C(C)CC(C)(C)C(=O)O E72364 [1,1,0,0,0,0|2,0,0]=4 37 B9R0.11 C[C@](O)(CC(=O)O)C(=O)O AT23394 [1,1,0,0,0,0|2,0,0]=4 38 B9R0.23 CNC(=O)[C@H](C)NC(C)=O FD21102 [1,1,0,0,0,0|1,0,0]=3 39 B9R0.42 CNC(=O)N[C@@H](C)C(=O)O AT23080 [1,1,0,0,0,0|0,0,0]=2 40 B9R0.42 COC(=O)C[C@H](C)C(=O)O FD10315 [1,1,0,0,0,0|1,0,0]=3 41 B9R0.42 COC(=O)C[C@H](O)C(=O)O AT10894 [1,1,0,0,0,0|1,1,0]=4 42 B9R0.42 COC(=O)N[C@@H](C)C(=O)O 93826 [1,1,0,0,0,0|0,0,0]=2 43 B9R0.57 C[C@H](NS(C)(=O)=O)C(=O)O AT10436 [1,1,0,0,0,0|1,0,0]=3 44 B9R0.57 C[C@H](NS(C)(=O)=O)C(=O)O AT10471 [1,1,0,0,0,0|1,0,0]=3 45 B11R0.115 CC[C@H](C)[C@H](NC(C)=O)C(N)=O FD21826 [0,2,0,0,0,0|2,0,0]=4 46 B11R0.236 C=CC[C@H](NC(=O)OC)C(=O)O 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O=C1N[C@@H](CCl)C(=O)O1 AC7463 [1,0,0,1,0,0|1,0,0]=3 62 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 AT11433 [1,0,0,1,0,0|1,0,1]=4 63 B9R1.35 NC1=N[C@H](C(=O)O)CS1 D77103 [1,0,0,1,0,0|1,0,1]=4 64 B9R1.35 O=C1C[C@H](C(=O)O)CN1 P15832 [1,0,0,1,0,0|2,0,0]=4 65 B9R1.35 O=C1NC[C@@H](C(=O)O)O1 W19722 [1,0,0,1,0,0|2,0,0]=4 66 B9R1.35 O=C1N[C@H](C(=O)O)CO1 93866 [1,0,0,1,0,0|0,1,0]=3 67 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F D97117 [1,0,0,1,0,0|1,0,1]=4 68 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O P14778 [1,0,0,1,0,0|0,1,1]=4 69 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O P16430 [1,0,0,1,0,0|0,1,1]=4 70 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O P14685 [1,0,0,1,0,0|0,1,1]=4 71 B9R1.152 O=C1CC(F)(C(=O)O)C1 F53583 [1,0,0,1,0,0|2,0,0]=4 72 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O P18271 [1,0,0,1,0,0|2,0,0]=4 73 B9R1.168 CC(=O)C1(C(=O)O)CC1 F19705 [0,0,0,1,1,0|1,0,0]=3 74 B11R1.157 O=C(O)C[C@H]1CCCC(=O)C1 97098 [0,0,0,1,0,1|2,0,0]=4 75 B11R1.157 O=C(O)C[C@H]1CCCC(=O)C1 97101 [0,0,0,1,0,1|2,0,0]=4 76 B11R1.645 CC(=O)N[C@H]1CC(=O)OC1=O F12501 [0,0,0,1,0,1|0,1,1]=4 77 B11R1.166 CC1CC(=O)CCC1C(=O)O AT19934 [0,0,0,1,0,1|2,0,0]=4 78 B11R1.175 CC(=O)N1CC[C@H](C(=O)O)C1 C78417 [0,0,0,1,0,1|1,0,0]=3 79 B11R1.929 CC(=O)CC1(C(=O)O)CCC1 C77467 [0,1,0,1,0,0|2,0,0]=4 80 B11R1.277 C[C@@H]1NC(=O)[C@H](CO)NC1=O AT17303 [0,1,0,1,0,0|1,1,0]=4 81 B11R1.870 COC(=O)N1CC[C@H]1C(=O)O 93915 [0,1,0,1,0,0|1,0,0]=3 82 B11R1.1493 COC(=O)CC1(C(=O)O)CC1 AT13576 [0,1,0,1,0,0|2,0,0]=4 83 B11R1.23 COC(=O)[C@@H]1CCCC(=O)N1 C92643 [0,1,0,1,0,0|1,0,0]=3 84 B11R1.23 COC(=O)[C@@H]1CCCC(=O)N1 C92649 [0,1,0,1,0,0|1,0,0]=3 85 B11R2.47 O=C1NC2CCC1NC2=O 32184 [0,0,0,2,0,0|2,0,0]=4 86 B7R0.16 C=C(C)[C@H](N)C(=O)O N10436 [1,0,0,0,1,0|2,0,0]=4