BJA15R
  -OEChem-04022104522D

 57 61  0     1  0  0  0  0  0999 V2000
    5.6103    3.3872    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6138    1.1544    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
    4.6783   -1.0738    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6353    0.9481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9244    2.1049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9674    1.6924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2566    2.8492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2816    0.4100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2781    2.6430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6783    0.5357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9889    1.4862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    0.2310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -0.7690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2619   -0.2690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9889   -2.0243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2601    0.6163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.7310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.2690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9674   -2.2305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.2310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.7690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9280   -0.1280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5708    1.5668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2781   -3.1810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6353   -1.4862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9065    0.0782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5493    1.7730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2171    1.0287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2566   -3.3872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6138   -1.6924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9244   -2.6430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1089    0.6205    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8665    0.3729    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4714    1.8128    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3070    2.5928    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7830    3.1768    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0254    3.4244    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7553    0.0824    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5129   -0.1652    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5749    1.9477    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8819   -0.2690    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3751   -2.1116    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9684   -2.6439    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    1.3510    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.8890    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631    0.5410    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631   -1.0790    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7354   -0.7174    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1567    2.0282    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8640   -3.6425    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4427   -0.8969    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3206   -0.3833    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7419    2.3623    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.8238    1.1566    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4492   -3.9766    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0279   -1.2310    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5311   -2.7708    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  2  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  8  1  0  0  0  0
  3 13  1  0  0  0  0
  3 14  1  0  0  0  0
  3 15  1  0  0  0  0
  4  6  1  0  0  0  0
  4 32  1  0  0  0  0
  4 33  1  0  0  0  0
  5  7  1  0  0  0  0
  5 34  1  0  0  0  0
  5 35  1  0  0  0  0
  6  9  1  0  0  0  0
  6 11  2  0  0  0  0
  7  9  1  0  0  0  0
  7 36  1  0  0  0  0
  7 37  1  0  0  0  0
  8 16  1  0  0  0  0
  8 38  1  0  0  0  0
  8 39  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 14  2  0  0  0  0
 11 40  1  0  0  0  0
 12 13  1  0  0  0  0
 12 17  2  0  0  0  0
 13 18  2  0  0  0  0
 14 41  1  0  0  0  0
 15 19  1  0  0  0  0
 15 42  1  0  0  0  0
 15 43  1  0  0  0  0
 16 22  2  0  0  0  0
 16 23  1  0  0  0  0
 17 20  1  0  0  0  0
 17 44  1  0  0  0  0
 18 21  1  0  0  0  0
 18 45  1  0  0  0  0
 19 24  2  0  0  0  0
 19 25  1  0  0  0  0
 20 21  2  0  0  0  0
 20 46  1  0  0  0  0
 21 47  1  0  0  0  0
 22 26  1  0  0  0  0
 22 48  1  0  0  0  0
 23 27  2  0  0  0  0
 23 49  1  0  0  0  0
 24 29  1  0  0  0  0
 24 50  1  0  0  0  0
 25 30  2  0  0  0  0
 25 51  1  0  0  0  0
 26 28  2  0  0  0  0
 26 52  1  0  0  0  0
 27 28  1  0  0  0  0
 27 53  1  0  0  0  0
 28 54  1  0  0  0  0
 29 31  2  0  0  0  0
 29 55  1  0  0  0  0
 30 31  1  0  0  0  0
 30 56  1  0  0  0  0
 31 57  1  0  0  0  0
M  END

$$$$