NCI:65782
BBtclserve11129917102D 0   0.00000     0.00000 53484
12176-36-2
 17 19  0  0  0  0  0  0  0  0  2 V2000
    6.3638   -0.5867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4683   -1.5813    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    6.2593    0.4078    0.0000 Fe  0  0  0  0  0  0  0  0  0  0  0  0
    4.4498   -0.8080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7593   -0.4583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7593    1.2738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7593    1.2738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2593    0.4078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2593    0.4078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6198   -1.3658    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    5.2593   -1.3243    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    4.2751    0.2308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1253   -0.0922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6297    0.9946    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7797   -0.6380    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6455    0.8176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.5813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  3  9  1  0  0  0  0
  4 10  3  0  0  0  0
  5 11  3  0  0  0  0
  8 12  1  0  0  0  0
  9 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  2  0  0  0  0
  7  9  2  0  0  0  0
M  CHG  3   2   1  10   1  11   1
M  END
$$$$