mol="ISI" Charge="0"
lab="C1"	NH="1" 
lab="NP1"	NH="2" 
lab="C2"	NH="1" 
lab="NP2"	NH="0" 
lab="C3"	NH="0" 
lab="NP3"	NH="0" 
lab="C4"	NH="0" 
lab="C5"	NH="0" 
lab="C6"	NH="0" 
lab="N7"	NH="0" 
lab="C8"	NH="0" 
lab="N9"	NH="0" 
lab="C10"	NH="2" 
lab="C11"	NH="1" 
lab="O12"	NH="0" 
lab="CA1"	NH="2" 
lab="CA2"	NH="2" 
lab="CB1"	NH="2" 
lab="CD1"	NH="3" 
lab="CE1"	NH="3" 
lab="CG1"	NH="2" 
lab="CG2"	NH="3" 
lab="CG3"	NH="3" 
