RESIDUE   A1IKB     53
CONECT      C02    3 C03  N28  O01 
CONECT      C03    4 C02  C04  H032 H031
CONECT      C04    4 C03  C05  H042 H041
CONECT      C05    4 C04  C06  H051 H052
CONECT      C06    4 C05  C07  H062 H061
CONECT      C07    4 C06  C08  H071 H072
CONECT      C08    4 C07  C09  H082 H081
CONECT      C09    4 C08  N10  H091 H092
CONECT      C11    3 C27  N10  N12 
CONECT      C13    3 C14  C21  N12 
CONECT      C14    3 C13  C15  H141
CONECT      C15    3 C14  C16  C19 
CONECT      C16    3 C15  O17  O18 
CONECT      C19    3 C15  C20  H191
CONECT      C20    3 C19  C21  H201
CONECT      C21    3 C13  C20  C22 
CONECT      C22    3 C21  C23  C27 
CONECT      C23    3 C22  N24  H231
CONECT      C25    3 C26  N24  H251
CONECT      C26    3 C25  C27  H261
CONECT      C27    3 C11  C22  C26 
CONECT      N10    3 C09  C11  H101
CONECT      N12    2 C11  C13 
CONECT      N24    2 C23  C25 
CONECT      N28    3 C02  O29  H281
CONECT      O01    1 C02 
CONECT      O17    1 C16 
CONECT      O18    2 C16  H1  
CONECT      O29    2 N28  H291
CONECT      H032   1 C03 
CONECT      H031   1 C03 
CONECT      H042   1 C04 
CONECT      H041   1 C04 
CONECT      H051   1 C05 
CONECT      H052   1 C05 
CONECT      H062   1 C06 
CONECT      H061   1 C06 
CONECT      H071   1 C07 
CONECT      H072   1 C07 
CONECT      H082   1 C08 
CONECT      H081   1 C08 
CONECT      H091   1 C09 
CONECT      H092   1 C09 
CONECT      H141   1 C14 
CONECT      H191   1 C19 
CONECT      H201   1 C20 
CONECT      H231   1 C23 
CONECT      H251   1 C25 
CONECT      H261   1 C26 
CONECT      H101   1 N10 
CONECT      H281   1 N28 
CONECT      H1     1 O18 
CONECT      H291   1 O29 
END   
HET    A1IKB             53
HETSYN     A1IKB 5-[[8-(hydroxyamino)-8-oxooctyl]amino]benzo[c][2,6]naph
HETSYN   2 A1IKB thyridine-8-carboxylic acid
HETNAM     A1IKB 5-[[8-(oxidanylamino)-8-oxidanylidene-octyl]amino]benzo
HETNAM   2 A1IKB [c][2,6]naphthyridine-8-carboxylic acid
FORMUL      A1IKB    C21 H24 N4 O4