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3  B12R0.138  NC(=O)N[C@@H](CCC(=O)O)C(=O)O M10646 [0,0,0,0,0,0|0,0,0]=0
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5  B11R0.160  CC(=O)N[C@@H](CCCN)C(=O)O M19991 [1,0,0,0,0,0|2,0,1]=4
6  B11R0.160  CSCCC(NC(C)=O)C(=O)O M19550 [1,0,0,0,0,0|3,0,0]=4
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12  B11R0.32  N=C(N)N[C@@H](CC(=O)O)C(=O)O M20807 [0,0,0,0,1,0|1,0,0]=2
13  B11R0.32  NC(=O)NC(CC(=O)O)C(=O)O M20024 [0,0,0,0,1,0|0,0,0]=1
14  B11R0.32  O=C(O)CC(CC(=O)O)C(=O)O M20307 [0,0,0,0,1,0|2,0,0]=3
15  B11R0.32  O=C(O)\C=C(/CC(=O)O)C(=O)O M19692 [0,0,0,0,1,0|2,0,1]=4
16  B11R0.32  O=C(O)\C=C(\CC(=O)O)C(=O)O M21295 [0,0,0,0,1,0|2,0,1]=4
17  B11R0.32  O=C(O)\C=C(\CC(=O)O)C(=O)O M21966 [0,0,0,0,1,0|2,0,1]=4
18  B10R0.88  CSCC[C@H](NC=O)C(=O)O M19603 [2,0,0,0,0,0|2,0,0]=4
19  B12R0.55  N\N=C\N[C@@H](CCC(=O)O)C(=O)O M27423 [1,1,0,0,0,0|0,0,0]=2
20  B12R0.694  O=C(O)CC(O)(CC(=O)O)C(=O)O M15283 [0,1,0,0,1,0|2,0,0]=4
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23  B12R0.694  O=C(O)CC(O)(CC(=O)O)C(=O)O M26789 [0,1,0,0,1,0|2,0,0]=4
24  B12R0.41  NC(=O)CN(CC(=O)O)CC(=O)O M27566 [0,0,0,0,1,1|2,0,0]=4