0  B4R0.2  N#CCCN HY-Y1750 [0,0,0,0,0,0|3,0,1]=4
1  B3R0.1  [2H]C[*]O HY-D2582 [1,0,0,0,0,0|2,0,1]=4
2  B3R0.1  [2H][*][*]C HY-D1742 [1,0,0,0,0,0|3,0,0]=4
3  B5R0.1  CC(F)CCN HY-W049770 [0,1,0,0,0,0|2,0,1]=4
4  B5R0.1  C[15NH]CC(=O)O HY-101037S [0,1,0,0,0,0|2,0,0]=3
5  B5R0.1  [15NH2][13CH2][13CH2][13C](=O)O HY-N0230S [0,1,0,0,0,0|2,0,0]=3
6  B5R1.1  C1=NN=CO1 HY-W131122 [0,0,0,1,0,0|2,0,1]=4
7  B5R1.1  C1CSCN1 HY-77599 [0,0,0,1,0,0|1,1,1]=4
8  B2R0.1  C[*]S HY-164763 [2,0,0,0,0,0|1,1,0]=4
9  B2R0.1  N[13CH]=O HY-Y0842S [2,0,0,0,0,0|1,0,0]=3
10  B2R0.1  O=C=O HY-W782399 [2,0,0,0,0,0|0,0,2]=4
11  B2R0.1  [*]OC HY-164202 [2,0,0,0,0,0|1,0,0]=3
12  B2R0.1  [3H][*]C HY-P991180 [2,0,0,0,0,0|2,0,0]=4
13  B4R0.1  N[13C](=O)[15NH][15NH2] HY-W067028S [1,1,0,0,0,0|2,0,0]=4
14  B4R0.1  O=[N+]([O-])CCl HY-133631 [1,1,0,0,0,0|2,0,0]=4
15  B6R0.1  O=[13C]([13CH2][13CH2]O)O[Na] HY-W748200 [0,2,0,0,0,0|2,0,0]=4
16  B6R0.3  NC(CS)C(=O)O HY-W012850 [0,2,0,0,0,0|2,0,0]=4
17  B6R0.3  NCC(O)C(=O)O HY-W012966 [0,2,0,0,0,0|2,0,0]=4
18  B6R0.3  N[13C@@H]([13CH2]S)[13C](=O)O HY-Y0337S4 [0,2,0,0,0,0|2,0,0]=4
19  B6R0.3  N[C@@H](CO)C(=O)O HY-W142089 [0,2,0,0,0,0|2,0,0]=4
20  B6R0.3  N[C@@H](CS)[13C](=O)O HY-Y0337S3 [0,2,0,0,0,0|2,0,0]=4
21  B6R0.3  N[C@@H]([13CH2]S)C(=O)O HY-Y0337S2 [0,2,0,0,0,0|2,0,0]=4
22  B6R0.3  [15NH2][13C@@H]([13CH2]O)[13C](=O)O HY-N0650S5 [0,2,0,0,0,0|2,0,0]=4
23  B6R0.3  [15NH2][13C@@H]([13CH2]S)[13C](=O)O HY-Y0337S [0,2,0,0,0,0|2,0,0]=4
24  B6R0.4  N[13CH2][13CH2][13CH2][13C](=O)O HY-N0067S3 [0,2,0,0,0,0|1,0,0]=3
25  B6R0.4  O=CCCC(=O)O HY-104071 [0,2,0,0,0,0|1,0,1]=4
26  B6R1.8  CC1OC1CO HY-W310318 [0,1,0,1,0,0|0,0,2]=4