$SMI<c1ccccc1>NAM<Benzene>MSIM<1.0000>
MODP<1.0000>ALAB<1.000,1.000,1.000,1.000,1.000,1.000>|
$SMI<Oc1ccccc1>NAM<Phenol>MSIM<0.5758>
MODP<1.0000>ALAB<0.000,0.655,0.760,0.826,0.864,0.826,0.760>|
$SMI<Brc1ccccc1>NAM<1-bromo,benzene>MSIM<0.5758>
MODP<1.0000>ALAB<0.000,0.655,0.760,0.826,0.864,0.826,0.760>|
$SMI<Oc1ccccc1Br>NAM<ortho,bromophenol>MSIM<0.3878>
MODP<1.0000>ALAB<0.000,0.514,0.633,0.704,0.704,0.633,0.514,0.000>|