0  B6R0.2  NC(=O)CC(=O)O 4027194 [0,0,0,0,0,0|3,0,0]=3
1  B7R0.2  CC(C)NC(=O)CBr 4023681 [0,1,0,0,0,0|2,0,1]=4
2  B7R0.2  CC(C)NC(=O)CN 4030242 [0,1,0,0,0,0|2,0,1]=4
3  B7R0.2  CC(C)NC(=O)CN 4091078 [0,1,0,0,0,0|2,0,1]=4
4  B7R0.2  CCC(C)CC(C)=O 4031282 [0,1,0,0,0,0|2,0,1]=4
5  B7R0.2  CCN(C)CC(C)=O 4028374 [0,1,0,0,0,0|3,0,0]=4
6  B7R0.2  CCN(C)CC(C)=O 4088950 [0,1,0,0,0,0|3,0,0]=4
7  B7R0.2  CNC(=O)CC(=N)N 4043145 [0,1,0,0,0,0|3,0,0]=4
8  B7R0.2  CNC(=O)CC(=O)O 4027258 [0,1,0,0,0,0|2,0,0]=3
9  B7R0.2  COC(=O)CC(=N)N 4042869 [0,1,0,0,0,0|3,0,0]=4
10  B7R0.16  CC(=O)C(=O)N(C)C 4051999 [0,1,0,0,0,0|3,0,0]=4
11  B7R1.2  CC1=NN=C(C)N1 4030190 [0,0,0,1,0,0|3,0,0]=4
12  B7R1.2  CC1=NN=C(N)O1 4013100 [0,0,0,1,0,0|3,0,0]=4
13  B7R1.2  CC1=NN=C(O)O1 4040622 [0,0,0,1,0,0|2,0,1]=4
14  B7R1.2  CC1=NN=C(S)O1 4110496 [0,0,0,1,0,0|2,1,0]=4
15  B7R1.2  CC1CNC(=O)O1 4043936 [0,0,0,1,0,0|2,0,1]=4
16  B7R1.20  CC(=O)CC1CC1 4002838 [0,0,0,1,0,0|2,0,1]=4
17  B7R0.6  CC(=O)CCN(C)C 4090669 [0,0,0,0,0,1|3,0,0]=4
18  B7R0.6  CC(=O)CCN(C)C 5108147 [0,0,0,0,0,1|3,0,0]=4
19  B7R0.6  CC(C)OCC(=O)O 4020858 [0,0,0,0,0,1|2,0,1]=4
20  B4R0.1  CC(=O)CN 4035253 [2,0,0,0,0,0|1,0,1]=4
21  B6R0.1  CCNC(=O)CBr 4023688 [1,1,0,0,0,0|1,0,1]=4
22  B6R0.1  CNCC(=O)NC 4033340 [1,1,0,0,0,0|2,0,0]=4
23  B6R0.4  COCCC(C)=O 4022132 [1,1,0,0,0,0|1,0,1]=4
24  B8R0.9  CCC(=O)NCC(=O)O 4027002 [0,1,0,0,0,1|2,0,0]=4
25  B8R0.5  COCC(=O)CC(C)=O 4036230 [0,2,0,0,0,0|1,0,0]=3
26  B8R1.3  CC1=NNC(=O)CC1 3003063 [0,0,0,1,0,1|2,0,0]=4
27  B8R1.23  O=C1CC(C(=O)O)C1 4036673 [0,0,0,1,0,1|2,0,0]=4
28  B8R1.51  CC1(C)COC(=O)C1 4108200 [0,0,0,1,0,1|1,0,1]=4
29  B8R1.1  CC1=NN=C(CCl)O1 4011029 [0,1,0,1,0,0|2,0,0]=4
30  B8R1.1  CC1=NN=C(CN)O1 4101407 [0,1,0,1,0,0|2,0,0]=4
31  B8R1.1  CC1=NN=C(CO)O1 4012867 [0,1,0,1,0,0|2,0,0]=4
32  B8R1.1  O=C1CCC(CBr)O1 4085450 [0,1,0,1,0,0|1,0,1]=4
33  B8R1.4  O=C1CNCC(=O)N1 4041602 [0,1,0,1,0,0|1,0,0]=3
34  B8R1.4  O=C1COCC(=O)N1 4045755 [0,1,0,1,0,0|1,0,0]=3
35  B8R1.18  CC1=C(C)OC(=O)N1 4044048 [0,1,0,1,0,0|2,0,0]=4
36  B8R1.50  CN1C(=O)CNC1=O 4048943 [0,1,0,1,0,0|2,0,0]=4
37  B8R0.28  NC(=O)COCC(=O)O 4026979 [0,0,0,0,0,2|2,0,0]=4