0  B4R0.1  CC(=O)NN CS-D1403 [0,0,0,0,0,0|3,1,0]=4
1  B4R0.1  NCC(N)=O CS-W019695 [0,0,0,0,0,0|4,0,0]=4
2  B3R0.2  CC(=O)O CS-W019776 [1,0,0,0,0,0|2,0,1]=4
3  B3R0.2  CC(=O)[O-] CS-0082496 [1,0,0,0,0,0|2,0,1]=4
4  B3R0.2  CC(=O)[O-] CS-0084525 [1,0,0,0,0,0|2,0,1]=4
5  B3R0.2  CC(=O)[O-] CS-W002072 [1,0,0,0,0,0|2,0,1]=4
6  B3R0.2  CC(=O)[O-] CS-W004700 [1,0,0,0,0,0|2,0,1]=4
7  B3R0.2  CC(=O)[O-] CS-W020594 [1,0,0,0,0,0|2,0,1]=4
8  B3R0.2  O=C([O-])[O-] CS-B1715 [1,0,0,0,0,0|1,0,2]=4
9  B3R0.2  O=C([O-])[O-] CS-W008901 [1,0,0,0,0,0|1,0,2]=4
10  B5R0.4  CNS(C)(=O)=O CS-W008054 [0,1,0,0,0,0|2,1,0]=4
11  B5R0.4  COS(C)(=O)=O CS-W004702 [0,1,0,0,0,0|3,0,0]=4
12  B5R0.5  O=C([O-])C(=O)[O-] CS-W022571 [0,1,0,0,0,0|2,0,1]=4
13  B2R0.1  O=[Zr]=O CS-0111468 [2,0,0,0,0,0|1,0,0]=3
14  B4R0.3  CS(=O)(=O)[O-] CS-0084592 [1,1,0,0,0,0|1,0,1]=4
15  B4R0.3  CS(C)(=O)=O CS-0017786 [1,1,0,0,0,0|2,0,0]=4
16  B4R0.3  CS(N)(=O)=O CS-W020062 [1,1,0,0,0,0|1,1,0]=4