0  B11R1.426  CC1(NC(=O)N(C1=O)CO)C Molport-004-946-916 [0,0,0,0,0,0|2,0,0]=2
1  B11R1.426  CC1=C(C(=O)OC1(C)C)C#N Molport-002-563-153 [0,0,0,0,0,0|3,0,1]=4
2  B10R1.256  CCN1C(=O)CN(C1=S)C Molport-000-893-903 [1,0,0,0,0,0|2,1,0]=4
3  B10R1.256  COC1=C(OC(C1=O)C)C Molport-003-960-153 [1,0,0,0,0,0|3,0,0]=4
4  B10R1.271  CC1=C(C(OC1=O)(C)O)C Molport-020-313-429 [1,0,0,0,0,0|3,0,0]=4
5  B12R1.860  CC(=O)C1=C(C(OC1=O)(C)C)C Molport-002-560-286 [0,1,0,0,0,0|2,0,1]=4
6  B12R1.1116  C=CCN1C(=O)NC(C1=O)(C)C Molport-002-083-749 [0,1,0,0,0,0|1,0,1]=3
7  B12R1.1116  CC1(NC(=O)N(C1=O)CCO)C Molport-000-732-138 [0,1,0,0,0,0|1,0,0]=2
8  B10R0.9  CCN(CC)C(=O)C(C)(C)N Molport-004-777-413 [0,0,1,0,0,0|2,0,1]=4
9  B12R1.798  CC1(OC(=O)C(=CN)C(=O)O1)C Molport-002-344-840 [0,0,0,0,0,1|2,0,1]=4
10  B12R1.798  CC1(OC(=O)C(=[N+]=[N-])C(=O)O1)C Molport-002-043-459 [0,0,0,0,0,1|3,0,0]=4
11  B9R0.44  CCNC(=O)OC(C)(C)C Molport-006-827-077 [1,0,1,0,0,0|0,0,1]=3
12  B9R0.44  CONC(=O)OC(C)(C)C Molport-018-616-979 [1,0,1,0,0,0|1,0,1]=4
13  B9R1.27  CCN1C(=O)CNC1=O Molport-011-008-277 [2,0,0,0,0,0|1,0,0]=3
14  B9R1.27  CCN1C(=O)CNC1=S Molport-000-893-881 [2,0,0,0,0,0|1,1,0]=4
15  B9R1.27  CCN1C(=O)CSC1=S Molport-000-893-900 [2,0,0,0,0,0|0,2,0]=4
16  B9R1.37  CN1CC(=O)N(C1=O)C Molport-033-360-239 [2,0,0,0,0,0|2,0,0]=4
17  B9R1.38  C=C1OC(=O)OC1(C)C Molport-001-761-602 [2,0,0,0,0,0|2,0,0]=4
18  B9R1.38  CC1(NC(=O)NC1=O)C Molport-001-780-185 [2,0,0,0,0,0|1,0,0]=3
19  B9R1.38  CC1(SC(=S)NC1=O)C Molport-006-128-500 [2,0,0,0,0,0|0,2,0]=4
20  B11R0.172  CCN(CC)C(=O)OC(C)(C)C Molport-020-555-135 [0,1,1,0,0,0|1,0,1]=4
21  B11R1.1330  CC1(C(=O)N(C(=O)N1Cl)Cl)C Molport-003-928-274 [1,1,0,0,0,0|2,0,0]=4
22  B13R1.2902  CC1=NN(C(=O)OC1(C)C)CCO Molport-002-705-576 [0,1,0,0,0,1|1,0,0]=3
23  B13R1.3946  CCCN1C(=O)CC(CC1=O)(C)C Molport-004-840-369 [0,1,0,0,0,1|1,0,0]=3
24  B13R1.8379  CC(=C1C(=O)OC(OC1=O)(C)C)O Molport-023-332-748 [0,1,0,0,0,1|1,0,1]=4
25  B13R1.1623  C=C1N(C(=O)OC1(C)C)CCC#N Molport-006-827-830 [0,2,0,0,0,0|1,0,0]=3
26  B13R1.8103  CC1(OC(=O)N(C1(C)O)CCO)C Molport-002-697-319 [0,2,0,0,0,0|0,0,2]=4
27  B13R1.8499  CC1(NC(=O)N(C1=O)CC(=O)O)C Molport-002-005-333 [0,2,0,0,0,0|1,0,1]=4
28  B13R2.22433  CC1(OC(=O)C2(CC2)C(=O)O1)C Molport-001-794-003 [0,0,0,1,0,1|1,0,0]=3