0  B14R1.135  O=C(OC)[C@@H](N)CC1=CC=CC(O)=C1      AK130675 [0,0,1,0,0,0|3,0,0]=4
1  B13R1.135  N[C@@H](CC1=CC=CC=C1)C(OC)=O      AK-44164 [1,0,1,0,0,0|2,0,0]=4
2  B13R1.135  O=C(OC)C(N)CC1=CC=CC=C1      AK-88496 [1,0,1,0,0,0|2,0,0]=4
3  B13R1.135  O=C(OC)[C@H](N)CC1=CC=CC=C1      AK-44133 [1,0,1,0,0,0|2,0,0]=4
4  B13R1.148  NC(CC1=CC(Br)=CC=C1)C(O)=O      AK-49664 [1,0,1,0,0,0|0,1,0]=3
5  B13R1.148  NC(CC1=CC(F)=CC=C1)C(O)=O      AK-80309 [1,0,1,0,0,0|0,1,0]=3
6  B13R1.148  N[C@@H](CC1=CC=CC(C)=C1)C(O)=O      AK-41282 [1,0,1,0,0,0|1,0,0]=3
7  B13R1.148  N[C@H](CC1=CC=CC(F)=C1)C(O)=O      AK-45521 [1,0,1,0,0,0|0,1,0]=3
8  B13R1.148  O=C(O)C(N)CC1=CC=CC(C)=C1      AK-89323 [1,0,1,0,0,0|1,0,0]=3
9  B13R1.148  O=C(O)C(N)CC1=CC=CC(O)=C1      AK-50979 [1,0,1,0,0,0|1,0,0]=3
10  B13R1.148  O=C(O)[C@@H](N)CC1=CC=CC(Br)=C1      AK-77026 [1,0,1,0,0,0|0,1,0]=3
11  B13R1.148  O=C(O)[C@@H](N)CC1=CC=CC(Cl)=C1      AK-50137 [1,0,1,0,0,0|0,0,0]=2
12  B13R1.148  O=C(O)[C@@H](N)CC1=CC=CC(Cl)=C1      AK-93785 [1,0,1,0,0,0|0,0,0]=2
13  B13R1.148  O=C(O)[C@@H](N)CC1=CC=CC(N)=C1      AK325880 [1,0,1,0,0,0|1,0,0]=3
14  B13R1.148  O=C(O)[C@@H](N)CC1=CC=CC(O)=C1      AK-86473 [1,0,1,0,0,0|1,0,0]=3
15  B13R1.148  O=C(O)[C@H](N)CC1=CC=CC(Br)=C1      AK-94768 [1,0,1,0,0,0|0,1,0]=3
16  B13R1.148  O=C(O)[C@H](N)CC1=CC=CC(Cl)=C1      AK162592 [1,0,1,0,0,0|0,0,0]=2
17  B13R1.148  [C@H](N)(CC1=CC=CC(F)=C1)C(O)=O      AK-81280 [1,0,1,0,0,0|0,1,0]=3
18  B13R2.369  O=C1NC2=C(C=CC=C2)CC1N      AK-27578 [2,0,0,0,0,0|0,0,0]=2
19  B13R2.162  O=C1NC2=C(C=CC=C2Cl)CC1      AK312263 [2,0,0,0,0,0|0,0,0]=2
20  B13R2.162  OC1=CC=CC2=C1NC(CO2)=O      AK-24440 [2,0,0,0,0,0|2,0,0]=4
21  B15R1.5521  O=C(OC)[C@@H](N)CC1=CC=C(Cl)C(Cl)=C1      AK170205 [0,1,1,0,0,0|2,0,0]=4
22  B13R2.4825  C1=CC=C(C2=C1C(C(=O)N2)=O)Cl      AK-26712 [1,0,0,0,1,0|1,0,1]=4
23  B15R2.61507  O=C1C(N)CCC2=CC=CC(F)=C2N1      AK164174 [1,0,0,0,0,1|0,1,0]=3