0  B13R1.135  N[C@@H](CC1=CC=CC=C1)C(OC)=O      AK-44164 [1,0,1,0,0,0|2,0,0]=4
1  B13R1.135  O=C(OC)C(N)CC1=CC=CC=C1      AK-88496 [1,0,1,0,0,0|2,0,0]=4
2  B13R1.135  O=C(OC)[C@H](N)CC1=CC=CC=C1      AK-44133 [1,0,1,0,0,0|2,0,0]=4
3  B13R1.202  C1=C(C(=CC=C1)Cl)CC(C(O)=O)N      AK-59197 [1,0,1,0,0,0|1,0,0]=3
4  B13R1.202  N[C@H](CC1=CC=CC=C1Cl)C(O)=O      AK-44107 [1,0,1,0,0,0|1,0,0]=3
5  B13R1.202  O=C(O)C(N)CC1=CC=CC=C1Br      AK-80271 [1,0,1,0,0,0|1,0,0]=3
6  B13R1.202  O=C(O)C(N)CC1=CC=CC=C1C      AK-89321 [1,0,1,0,0,0|0,0,0]=2
7  B13R1.202  O=C(O)[C@@H](N)CC1=CC=CC=C1Br      AK-89325 [1,0,1,0,0,0|1,0,0]=3
8  B13R1.202  O=C(O)[C@@H](N)CC1=CC=CC=C1Cl      AK109418 [1,0,1,0,0,0|1,0,0]=3
9  B13R1.202  O=C(O)[C@@H](N)CC1=CC=CC=C1O      AK172674 [1,0,1,0,0,0|1,0,0]=3
10  B13R1.202  O=C(O)[C@H](N)CC1=CC=CC=C1Br      AK-95498 [1,0,1,0,0,0|1,0,0]=3
11  B13R1.202  O=C(O)[C@H](N)CC1=CC=CC=C1C      AK109372 [1,0,1,0,0,0|0,0,0]=2
12  B13R1.202  [C@@H](N)(CC1=C(F)C=CC=C1)C(O)=O      AK-26481 [1,0,1,0,0,0|1,0,0]=3
13  B13R1.202  [C@H](N)(CC1=C(F)C=CC=C1)C(O)=O      AK-81279 [1,0,1,0,0,0|1,0,0]=3
14  B13R2.5179  O=C1NC2=C(C(Br)=CC=C2)CC1      AK-92900 [2,0,0,0,0,0|1,0,0]=3
15  B13R2.5179  OC1=CC=CC2=C1CCC(=O)N2      AK-72483 [2,0,0,0,0,0|1,0,0]=3
16  B13R2.369  O=C1NC2=C(C=CC=C2)CC1N      AK-27578 [2,0,0,0,0,0|0,0,0]=2
17  B15R2.1601  O=C(C1NCC2=C(C=CC=C2)C1)OC      AK130460 [0,0,1,1,0,0|2,0,0]=4
18  B15R2.1601  O=C([C@@H]1NCC2=C(C=CC=C2)C1)OC      AK152024 [0,0,1,1,0,0|2,0,0]=4
19  B15R2.1616  O=C(C1(N)CC2=C(C=CC=C2)C1)OC      AK-93784 [0,0,1,1,0,0|2,0,0]=4