A1ET9
  CCTOOLS-0313261112

 46 47  0  0  1  0  0  0  0  0999 V2000
    2.4490    1.9760   -0.8500 C   0  0  0  0  0
    1.2870    2.9030   -0.5210 C   0  0  0  0  0
    1.7320    3.9530    0.5050 C   0  0  0  0  0
    0.1220    2.2130   -0.0220 O   0  0  0  0  0
   -0.3880    1.1570   -0.6540 C   0  0  0  0  0
    0.2110    0.6940   -1.6070 O   0  0  0  0  0
   -1.6730    0.5490   -0.2870 C   0  0  0  0  0
   -2.7370    1.3170    0.1980 C   0  0  0  0  0
   -2.5940    2.6590    0.3570 O   0  0  0  0  0
   -3.9490    0.7250    0.5100 C   0  0  0  0  0
   -4.1190   -0.6480    0.3570 C   0  0  0  0  0
   -5.3140   -1.2230    0.6470 O   0  0  0  0  0
   -3.0630   -1.4310   -0.0860 C   0  0  0  0  0
   -1.8390   -0.8570   -0.3860 C   0  0  0  0  0
   -0.6960   -1.7080   -0.7490 C   0  0  0  0  0
   -0.5940   -2.9350   -0.2290 C   0  0  0  0  0
    0.6200   -3.7660   -0.5600 C   0  0  0  0  0
    1.8040   -3.2610    0.2700 C   0  0  0  0  0
    2.5950   -2.2270   -0.5370 C   0  0  0  0  0
    3.3160   -1.2870    0.3920 C   0  0  0  0  0
    3.4920   -1.6120    1.5430 O   0  0  0  0  0
    3.8320    0.0390   -0.0940 C   0  0  0  0  0
    2.9090    1.1730    0.3660 C   0  0  0  0  0
    1.7960    0.6230    1.0650 O   0  0  0  0  0
    2.1780    1.2990   -1.6610 H   0  0  0  0  0
    3.2940    2.5890   -1.1970 H   0  0  0  0  0
    0.9990    3.4380   -1.4410 H   0  0  0  0  0
    2.5550    4.5380    0.0940 H   0  0  0  0  0
    0.8960    4.6130    0.7360 H   0  0  0  0  0
    2.0620    3.4530    1.4160 H   0  0  0  0  0
   -2.8360    3.1760   -0.4230 H   0  0  0  0  0
   -4.7660    1.3250    0.8790 H   0  0  0  0  0
   -5.9230   -1.2640   -0.1030 H   0  0  0  0  0
   -3.2020   -2.4970   -0.1970 H   0  0  0  0  0
    0.0870   -1.3670   -1.3900 H   0  0  0  0  0
   -1.3520   -3.3150    0.4380 H   0  0  0  0  0
    0.4240   -4.8100   -0.3220 H   0  0  0  0  0
    0.8500   -3.6710   -1.6210 H   0  0  0  0  0
    1.4290   -2.7990    1.1840 H   0  0  0  0  0
    2.4530   -4.0980    0.5260 H   0  0  0  0  0
    3.3210   -2.7400   -1.1690 H   0  0  0  0  0
    1.9130   -1.6580   -1.1670 H   0  0  0  0  0
    4.8340    0.2070    0.3060 H   0  0  0  0  0
    3.8750    0.0340   -1.1840 H   0  0  0  0  0
    3.4730    1.8170    1.0460 H   0  0  0  0  0
    2.0370    0.1050    1.8450 H   0  0  0  0  0
  1  2  1  0  0  0
  1 23  1  0  0  0
  1 25  1  0  0  0
  1 26  1  0  0  0
  2  3  1  0  0  0
  2 27  1  0  0  0
  3 28  1  0  0  0
  3 29  1  0  0  0
  3 30  1  0  0  0
  4  5  1  0  0  0
  4  2  1  0  0  0
  5  6  2  0  0  0
  7  8  1  0  0  0
  7  5  1  0  0  0
  8  9  1  0  0  0
  9 31  1  0  0  0
 10  8  2  0  0  0
 10 32  1  0  0  0
 11 10  1  0  0  0
 12 11  1  0  0  0
 12 33  1  0  0  0
 13 11  2  0  0  0
 13 14  1  0  0  0
 13 34  1  0  0  0
 14  7  2  0  0  0
 15 14  1  0  0  0
 15 35  1  0  0  0
 16 15  2  0  0  0
 16 36  1  0  0  0
 17 16  1  0  0  0
 17 18  1  0  0  0
 17 37  1  0  0  0
 17 38  1  0  0  0
 18 19  1  0  0  0
 18 39  1  0  0  0
 18 40  1  0  0  0
 19 20  1  0  0  0
 19 41  1  0  0  0
 19 42  1  0  0  0
 20 22  1  0  0  0
 21 20  2  0  0  0
 22 23  1  0  0  0
 22 43  1  0  0  0
 22 44  1  0  0  0
 23 24  1  0  0  0
 23 45  1  0  0  0
 24 46  1  0  0  0
M  END
$$$$
