B4X5YP
  -OEChem-04022108442D

 41 44  0     0  0  0  0  0  0999 V2000
    2.2849   -2.0953    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7490   -1.0953    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0170   -1.0953    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8830    0.4047    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1509   -0.5953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0169   -2.0953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8830   -0.5953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2849   -1.0953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1509   -2.5953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9820    0.8386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7840    0.8385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7595    1.8135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0065    1.8135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2295    0.1184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5365    0.1184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3830    2.5953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3830    2.5953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7690    2.1358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9970    2.1358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2318    0.4177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5342    0.4177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7660    1.4332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5495   -0.1204    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7524   -0.1204    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2290   -2.6779    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6275   -1.9877    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0729   -0.5127    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6743   -1.2030    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7524   -3.0703    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5494   -3.0703    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3744   -0.4844    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3916   -0.4845    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1140    3.1539    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6520    3.1539    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6380    2.7418    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1280    2.7418    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7789   -0.0057    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9871   -0.0058    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4083    1.6183    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3578    1.6182    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  2  7  2  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  7  1  0  0  0  0
  4 10  1  0  0  0  0
  4 11  1  0  0  0  0
  5  8  1  0  0  0  0
  5 24  1  0  0  0  0
  5 25  1  0  0  0  0
  6  9  1  0  0  0  0
  6 26  1  0  0  0  0
  6 27  1  0  0  0  0
  8 28  1  0  0  0  0
  8 29  1  0  0  0  0
  9 30  1  0  0  0  0
  9 31  1  0  0  0  0
 10 12  1  0  0  0  0
 10 14  2  0  0  0  0
 11 13  1  0  0  0  0
 11 15  2  0  0  0  0
 12 16  1  0  0  0  0
 12 18  2  0  0  0  0
 13 17  1  0  0  0  0
 13 19  2  0  0  0  0
 14 20  1  0  0  0  0
 14 32  1  0  0  0  0
 15 21  1  0  0  0  0
 15 33  1  0  0  0  0
 16 17  2  0  0  0  0
 16 34  1  0  0  0  0
 17 35  1  0  0  0  0
 18 22  1  0  0  0  0
 18 36  1  0  0  0  0
 19 23  1  0  0  0  0
 19 37  1  0  0  0  0
 20 22  2  0  0  0  0
 20 38  1  0  0  0  0
 21 23  2  0  0  0  0
 21 39  1  0  0  0  0
 22 40  1  0  0  0  0
 23 41  1  0  0  0  0
M  END

$$$$