0  B11R0.42  CCCCCC\C=C(/F)[N+](=O)[O-] SPC-d110 [1,1,0,0,0,0|1,0,1]=4
1  B13R2.435  O=C(O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1 SPC-t868 [0,0,0,2,0,0|1,0,1]=4