0  B22R2.5849837  CC(C)(C)NCC(COc1cccc2c1CCCC2=O)O TS35407 [0,0,0,0,0,0|0,0,0]=0
1  B21R2.19996915  CC(C)(C)NCC(COc1cccc2c1SCCC2)O TS35821 [1,0,0,0,0,0|1,0,1]=3
2  B22R2.145584  CC(C)(C)NCC(COc1cccc2c1CCC(=O)N2)O TS58309 [1,1,0,0,0,0|1,0,1]=4
3  B22R2.145584  CC(C)(C)NCC(COc1cccc2c1CCC(=O)N2)O TS63569 [1,1,0,0,0,0|1,0,1]=4
4  B22R2.6554402  CC(C)(C)NC[C@@H](COc1ccccc1C2CCCC2)O TS35425 [0,0,1,1,0,0|1,0,1]=4