BY57WS
  -OEChem-04012115432D

 54 55  0     0  0  0  0  0  0999 V2000
    2.8660    2.9920    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5211   -0.5958    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0902   -0.2868    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6491   -3.2694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8301   -1.5469    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2423   -2.3559    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    3.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    1.4920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    2.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    2.4920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.4920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3660    0.1260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3660    1.8580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    4.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5981    3.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5981    3.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    2.4920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    1.4920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301    0.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301   -0.0080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1391   -0.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8301   -1.5469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0613   -4.0784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4680   -4.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.3720    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0010    2.8020    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6900    1.0289    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631    0.1820    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100   -0.0450    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8291   -0.1840    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6760   -0.4110    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9030    0.4360    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9030    2.1680    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0560    2.3949    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8291    1.5480    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2181    4.9920    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    5.6120    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9781    4.9920    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5981    3.3720    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2181    3.9920    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5981    4.6120    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5981    4.6120    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9781    3.9920    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5981    3.3720    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8671    1.3020    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    3.6120    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1946   -2.0484    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6306   -3.6324    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5473   -4.4251    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9016   -5.2442    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7202   -5.5584    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0344   -4.7398    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 11  1  0  0  0  0
  1 48  1  0  0  0  0
  2 22  1  0  0  0  0
  2 24  1  0  0  0  0
  3 23  2  0  0  0  0
  4  6  1  0  0  0  0
  4 25  1  0  0  0  0
  5 23  1  0  0  0  0
  5 24  1  0  0  0  0
  5 49  1  0  0  0  0
  6 24  2  0  0  0  0
  7  9  1  0  0  0  0
  7 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  8 10  1  0  0  0  0
  8 15  1  0  0  0  0
  8 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 11  2  0  0  0  0
  9 18  1  0  0  0  0
 10 11  1  0  0  0  0
 10 19  2  0  0  0  0
 12 29  1  0  0  0  0
 12 30  1  0  0  0  0
 12 31  1  0  0  0  0
 13 32  1  0  0  0  0
 13 33  1  0  0  0  0
 13 34  1  0  0  0  0
 14 35  1  0  0  0  0
 14 36  1  0  0  0  0
 14 37  1  0  0  0  0
 15 38  1  0  0  0  0
 15 39  1  0  0  0  0
 15 40  1  0  0  0  0
 16 41  1  0  0  0  0
 16 42  1  0  0  0  0
 16 43  1  0  0  0  0
 17 44  1  0  0  0  0
 17 45  1  0  0  0  0
 17 46  1  0  0  0  0
 18 20  2  0  0  0  0
 18 27  1  0  0  0  0
 19 20  1  0  0  0  0
 19 28  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 47  1  0  0  0  0
 22 23  1  0  0  0  0
 25 26  1  0  0  0  0
 25 50  1  0  0  0  0
 25 51  1  0  0  0  0
 26 52  1  0  0  0  0
 26 53  1  0  0  0  0
 26 54  1  0  0  0  0
M  END

$$$$