0 B3R0.2 CB(O)O SPC-j988 [0,0,0,0,0,0|2,0,0]=2 1 B4R0.1 C#C[C@H](C)O SPC-s670 [0,1,0,0,0,0|2,0,1]=4 2 B4R0.1 C#C[C@H](C)O SPC-t138 [0,1,0,0,0,0|2,0,1]=4 3 B4R0.1 CC(=O)CN SPC-t886 [0,1,0,0,0,0|2,0,0]=3 4 B4R0.1 NC(=O)CI SPC-s873 [0,1,0,0,0,0|2,0,0]=3 5 B4R1.2 OC1CC1 SPC-h306 [0,0,0,1,0,0|2,0,1]=4 6 B5R0.3 C=C(CO)CO SPC-g493 [0,2,0,0,0,0|1,0,0]=3 7 B5R0.5 OB(O)B(O)O SPC-s717 [0,2,0,0,0,0|1,0,1]=4 8 B5R1.2 O=C1CCN1 SPC-t120 [0,1,0,1,0,0|2,0,0]=4 9 B5R1.2 O=C1CNC1 SPC-h722 [0,1,0,1,0,0|2,0,0]=4 10 B5R1.2 O=C1CSC1 SPC-a100 [0,1,0,1,0,0|1,1,0]=4 11 B5R1.2 OC1COC1 SPC-a002 [0,1,0,1,0,0|1,0,1]=4 12 B5R1.3 OC[C@H]1CO1 SPC-t630 [0,1,0,1,0,0|1,0,1]=4