NCI:124115
BBtclserve11129917372D 0   0.00000     0.00000 94680
889-88-3
 18 22  0  0  0  0  0  0  0  0  1 V2000
    3.5827   -0.4811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3147    0.5189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9135   -1.2243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0827    0.3849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1467    0.2777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3369    2.3334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.8175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8271   -1.6310    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2444   -1.9674    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5735    1.4848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1045    0.1770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9238    0.9070    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5050   -0.6559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2030    2.8334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7226   -2.6255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7444   -2.8334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7625    0.3624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5037   -0.6036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  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  1  0  0  0  0
  4 11  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  6 14  2  0  0  0  0
  8 15  1  0  0  0  0
  9 16  1  0  0  0  0
 12 17  1  0  0  0  0
 13 18  1  0  0  0  0
  5 10  1  0  0  0  0
  7 11  2  0  0  0  0
 10 14  1  0  0  0  0
 15 16  1  0  0  0  0
 17 18  1  0  0  0  0
M  END