B7J8BD
  -OEChem-04012118222D

 80 84  0     1  0  0  0  0  0999 V2000
    9.2619    0.0256    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6783   -0.7791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9674    1.9871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2619   -3.4385    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
   12.7619   -2.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2619   -1.7064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7619   -2.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2619   -1.7064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2619   -3.4385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7619   -0.8404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7619   -4.3045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7619   -0.8404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7619   -2.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7619   -4.3045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6783    0.8304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2619    0.0256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2619    0.0256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    0.5256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2619    0.0256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2619   -5.1705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2619   -3.4385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -0.4744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7619    0.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7619   -0.8404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7619    0.8917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7619   -0.8404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9889    1.7809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    1.0256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2619   -5.1705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2619   -3.4385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.9744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3211    2.5252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7619   -4.3045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.5256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.4744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6318    3.4757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3426    2.3190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9639    4.2200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6747    3.0633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9854    4.0138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2746    5.1705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1793   -2.7845    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8695   -3.1830    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8445   -1.4944    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1542   -1.0958    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.3445   -2.3604    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.6542   -1.9619    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6793   -1.9185    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3695   -2.3170    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.6793   -3.6505    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.3695   -4.0490    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3445   -0.6283    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6542   -0.2298    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.1793   -4.5165    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.8695   -4.9151    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1793   -1.0525    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8695   -1.4510    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.2988   -2.8824    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.0719   -2.0355    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2249   -2.2624    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.9519   -5.7075    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.9519   -2.9015    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0719    1.4286    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0719   -1.3773    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4519    1.4286    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4519   -1.3773    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    1.6456    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.5719   -5.7075    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.5719   -2.9015    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.5944    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.3819   -4.3045    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631    0.8356    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631   -0.7844    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2384    3.6036    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1500    1.7296    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0681    2.9354    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5713    4.4752    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8639    4.9779    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4672    5.7598    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6852    5.3631    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  1  0  0  0  0
  1 17  1  0  0  0  0
  2 16  1  0  0  0  0
  2 22  1  0  0  0  0
  3 27  2  0  0  0  0
  4  9  1  0  0  0  0
  4 11  1  0  0  0  0
  4 13  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 42  1  0  0  0  0
  5 43  1  0  0  0  0
  6  8  1  0  0  0  0
  6 44  1  0  0  0  0
  6 45  1  0  0  0  0
  7  9  1  0  0  0  0
  7 46  1  0  0  0  0
  7 47  1  0  0  0  0
  8 10  1  0  0  0  0
  8 48  1  0  0  0  0
  8 49  1  0  0  0  0
  9 50  1  0  0  0  0
  9 51  1  0  0  0  0
 10 12  1  0  0  0  0
 10 52  1  0  0  0  0
 10 53  1  0  0  0  0
 11 14  1  0  0  0  0
 11 54  1  0  0  0  0
 11 55  1  0  0  0  0
 12 56  1  0  0  0  0
 12 57  1  0  0  0  0
 13 58  1  0  0  0  0
 13 59  1  0  0  0  0
 13 60  1  0  0  0  0
 14 20  2  0  0  0  0
 14 21  1  0  0  0  0
 15 16  2  0  0  0  0
 15 18  1  0  0  0  0
 15 27  1  0  0  0  0
 16 19  1  0  0  0  0
 17 23  2  0  0  0  0
 17 24  1  0  0  0  0
 18 22  1  0  0  0  0
 18 28  2  0  0  0  0
 19 25  2  0  0  0  0
 19 26  1  0  0  0  0
 20 29  1  0  0  0  0
 20 61  1  0  0  0  0
 21 30  2  0  0  0  0
 21 62  1  0  0  0  0
 22 31  2  0  0  0  0
 23 25  1  0  0  0  0
 23 63  1  0  0  0  0
 24 26  2  0  0  0  0
 24 64  1  0  0  0  0
 25 65  1  0  0  0  0
 26 66  1  0  0  0  0
 27 32  1  0  0  0  0
 28 34  1  0  0  0  0
 28 67  1  0  0  0  0
 29 33  2  0  0  0  0
 29 68  1  0  0  0  0
 30 33  1  0  0  0  0
 30 69  1  0  0  0  0
 31 35  1  0  0  0  0
 31 70  1  0  0  0  0
 32 36  1  0  0  0  0
 32 37  2  0  0  0  0
 33 71  1  0  0  0  0
 34 35  2  0  0  0  0
 34 72  1  0  0  0  0
 35 73  1  0  0  0  0
 36 38  2  0  0  0  0
 36 74  1  0  0  0  0
 37 39  1  0  0  0  0
 37 75  1  0  0  0  0
 38 40  1  0  0  0  0
 38 41  1  0  0  0  0
 39 40  2  0  0  0  0
 39 76  1  0  0  0  0
 40 77  1  0  0  0  0
 41 78  1  0  0  0  0
 41 79  1  0  0  0  0
 41 80  1  0  0  0  0
M  END

$$$$