BJ29TQ
  -OEChem-04022117373D

 55 57  0     1  0  0  0  0  0999 V2000
   -3.1432   -1.6058    2.2808 F   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5855   -1.8532   -2.6071 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.2983    1.7821   -0.1745 N   0  0  1  0  0  0  0  0  0  0  0  0
   -3.4418    3.1480    1.2278 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2085   -2.0607    2.7296 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9812    1.5117    0.1857 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9099    2.1649    0.0798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3944    2.3739   -0.9399 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1381    1.6309    1.4622 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0745    2.0406   -1.1993 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3307    1.2975    1.2021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4332    1.8987    0.4602 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.1976    0.8129    1.2406 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3530    0.5848   -1.0124 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0242    2.8826   -0.8073 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2841   -0.5068    0.5122 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6821   -0.1143   -0.9053 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7432   -1.6589    1.0833 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9064   -0.5723   -0.7344 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1353   -0.5682    0.3334 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4601   -0.3095   -2.0467 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9880   -1.7900   -1.4101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8249   -2.8766    0.4075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4474   -2.9422   -0.8389 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3663   -1.2169    0.4310 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6910   -0.9585   -1.9492 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1442   -1.4120   -0.7104 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8310   -1.6826    1.6992 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9289    0.4719   -0.1603 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8685    3.2044    0.4342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4675    3.4406   -0.6975 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9657    2.2213   -1.8639 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5123    0.9548    2.2390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1647    2.6442    1.8799 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0655    1.0279   -1.6166 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4446    2.7115   -1.9830 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9024    1.4516    2.1261 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3992    0.2284    0.9706 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9517    2.0839   -0.4883 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2269    1.1508    1.4263 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7587    0.6724    2.2359 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6222   -0.1767   -0.7126 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1560    0.8116   -2.0693 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0638    3.9085    0.6657 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4031    3.4096    1.4434 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6439    3.1406   -1.8015 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9826    3.7822   -0.1822 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0883    2.6417   -0.9083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3419    0.3126   -1.1896 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5253   -0.4216    1.2227 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1218    0.0386   -3.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4036   -3.7733    0.8522 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5111   -3.8900   -1.3652 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2966   -1.1103   -2.8379 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1059   -1.9160   -0.6507 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 18  1  0  0  0  0
  2 22  1  0  0  0  0
  3  7  1  0  0  0  0
  3 14  1  0  0  0  0
  3 15  1  0  0  0  0
  4 12  1  0  0  0  0
  4 44  1  0  0  0  0
  4 45  1  0  0  0  0
  5 28  3  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 12  1  0  0  0  0
  6 29  1  0  0  0  0
  7 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7 30  1  0  0  0  0
  8 10  1  0  0  0  0
  8 31  1  0  0  0  0
  8 32  1  0  0  0  0
  9 11  1  0  0  0  0
  9 33  1  0  0  0  0
  9 34  1  0  0  0  0
 10 35  1  0  0  0  0
 10 36  1  0  0  0  0
 11 37  1  0  0  0  0
 11 38  1  0  0  0  0
 12 13  1  0  0  0  0
 12 39  1  0  0  0  0
 13 16  1  0  0  0  0
 13 40  1  0  0  0  0
 13 41  1  0  0  0  0
 14 17  1  0  0  0  0
 14 42  1  0  0  0  0
 14 43  1  0  0  0  0
 15 46  1  0  0  0  0
 15 47  1  0  0  0  0
 15 48  1  0  0  0  0
 16 18  2  0  0  0  0
 16 19  1  0  0  0  0
 17 20  2  0  0  0  0
 17 21  1  0  0  0  0
 18 23  1  0  0  0  0
 19 22  2  0  0  0  0
 19 49  1  0  0  0  0
 20 25  1  0  0  0  0
 20 50  1  0  0  0  0
 21 26  2  0  0  0  0
 21 51  1  0  0  0  0
 22 24  1  0  0  0  0
 23 24  2  0  0  0  0
 23 52  1  0  0  0  0
 24 53  1  0  0  0  0
 25 27  2  0  0  0  0
 25 28  1  0  0  0  0
 26 27  1  0  0  0  0
 26 54  1  0  0  0  0
 27 55  1  0  0  0  0
M  END

$$$$