0  B3R0.2  CN(C)N CS-M2143 [0,0,0,0,0,0|4,0,0]=4
1  B3R0.2  FC(Br)Br CS-0037693 [0,0,0,0,0,0|3,0,1]=4
2  B2R0.1  O[Pd]O CS-0100451 [1,0,0,0,0,0|1,0,0]=2
3  B4R0.1  C=C(Br)CN CS-0106981 [0,1,0,0,0,0|3,0,0]=4
4  B4R0.1  CN(N)C=O CS-0084846 [0,1,0,0,0,0|3,0,0]=4
5  B4R0.1  N=C(N)CCl CS-M2910 [0,1,0,0,0,0|3,0,0]=4
6  B4R0.1  N=C(N)CN CS-0112951 [0,1,0,0,0,0|3,0,0]=4
7  B4R0.1  NC(=S)CO CS-0091320 [0,1,0,0,0,0|1,1,0]=3
8  B4R0.1  [C@H](C)(N)CO CS-W011362 [0,1,0,0,0,0|2,0,1]=4
9  B4R0.3  CS(=O)([O-])=S CS-W013381 [0,1,0,0,0,0|1,1,1]=4
10  B3R0.1  NCCO CS-0088236 [1,1,0,0,0,0|1,0,1]=4
11  B5R0.1  CC(=O)NCO CS-0061075 [0,2,0,0,0,0|1,0,0]=3
12  B5R0.1  CC(=O)\C=N\O CS-0039829 [0,2,0,0,0,0|1,0,0]=3
13  B5R0.1  C\C=C\B(O)O CS-0086306 [0,2,0,0,0,0|2,0,0]=4
14  B5R0.1  O=C(O)CCF CS-0038385 [0,2,0,0,0,0|1,0,0]=3
15  B5R0.3  CCC(=O)CO CS-W005327 [0,2,0,0,0,0|1,0,0]=3
16  B5R0.3  COC(=S)NN CS-B1194 [0,2,0,0,0,0|1,1,0]=4
17  B5R0.3  CO[C@@H](C)CO CS-0096324 [0,2,0,0,0,0|1,0,1]=4
18  B5R0.3  N=C(CO)NO CS-0091317 [0,2,0,0,0,0|1,0,0]=3
19  B5R0.5  CC(N)C(N)=O CS-0036447 [0,2,0,0,0,0|2,0,0]=4
20  B5R0.5  CC(O)C(=N)N CS-0037354 [0,2,0,0,0,0|2,0,0]=4
21  B5R0.5  O=C(O)C(=O)O CS-0089651 [0,2,0,0,0,0|0,0,0]=2
22  B5R1.3  OCC1CO1 CS-0016001 [0,1,0,1,0,0|1,0,1]=4