0  B6R0.5  CC(C)(C)NC=O fd731f01e449e88bdf1e84dfcee6c8d2 [0,2,0,0,0,0|0,0,1]=3
1  B6R0.5  CC(C)(C)NCF 3cacbed1609b720894d3f72aa5b5474f [0,2,0,0,0,0|1,0,0]=3
2  B6R0.5  CC(C)(C)NCO 98c610d421d69102d9fd33b99f13912a [0,2,0,0,0,0|0,0,0]=2
3  B6R0.5  CCNC(C)(C)C 075494290386c2ca265fcbc967febc26 [0,2,0,0,0,0|1,0,0]=3