NCI:120113
BBtclserve11129917342D 0   0.00000     0.00000 91453
12080-10-3
 12 15  0  0  0  0  0  0  0  0  2 V2000
    3.8995   -1.2971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8331   -1.6555    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    2.9659   -0.9387    0.0000 Fe  0  0  0  0  0  0  0  0  0  0  0  0
    3.5952   -0.1616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9319   -0.6799    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.9659    1.6555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7071   -0.7247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.0176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2588    0.9484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6730    0.9484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2246    0.6156    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    4.6390   -1.3870    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  7  1  0  0  0  0
  3  8  1  0  0  0  0
  3  9  1  0  0  0  0
  3 10  1  0  0  0  0
  4 11  3  0  0  0  0
  5 12  1  0  0  0  0
  7  8  1  0  0  0  0
  6  9  1  0  0  0  0
  8  9  2  0  0  0  0
  6 10  1  0  0  0  0
  7 10  2  0  0  0  0
M  CHG  2   2   1  11   1
M  END
$$$$