BN7EA6
  -OEChem-04022112463D

 50 52  0     1  0  0  0  0  0999 V2000
   -1.6404    0.6009   -0.5312 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1215   -1.6976   -0.8531 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5012   -3.0719   -0.4935 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7975   -3.3458    0.9831 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3913    4.7091   -0.4829 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5236   -1.0316    2.4655 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6873   -0.0775   -0.8019 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.3651    1.0325   -1.0268 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1661   -1.3960   -1.3869 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0482    0.2679   -1.4033 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0439   -0.6384   -1.1178 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.0288    2.3332   -0.3300 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8207    1.1946   -0.5121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3783   -1.0219   -0.5269 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1704    2.3790    1.0454 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0920    3.5154   -1.0424 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6662    0.7790    0.4425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5313   -1.2491    0.8409 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4734   -1.1477   -1.3818 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4800    3.5885    1.6575 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9450   -0.6655    0.7382 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7796   -1.6021    1.3537 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7216   -1.5008   -0.8688 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5781    4.7146    0.8561 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1332   -1.1787   -0.0745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8747   -1.7282    0.4988 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4226   -1.1291    1.7380 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4277   -2.6329    0.2144 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7811   -0.2574    0.2782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4763    1.2197   -2.1037 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1031   -1.3560   -2.4812 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8342   -2.2233   -1.1243 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6241   -0.6440   -1.5968 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9294    0.7400   -2.3868 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1373   -0.5064   -2.2042 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7326    2.2626   -0.6852 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0807    1.4868    1.6576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0503    3.5456   -2.1181 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2134    1.5214    1.0172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3731   -0.9744   -2.4499 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6379    3.6482    2.7282 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0628   -1.2927    0.5666 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1588   -0.7608    1.8105 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9162   -1.7832    2.4173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5743   -1.5988   -1.5342 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8171    5.6822    1.2849 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9353   -1.0841   -1.1480 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0301   -0.5976    0.1703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8466   -2.0033    0.8980 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6986   -4.0152   -0.3104 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1 11  1  0  0  0  0
  2  9  1  0  0  0  0
  2 11  1  0  0  0  0
  3 28  1  0  0  0  0
  3 50  1  0  0  0  0
  4 28  2  0  0  0  0
  5 16  1  0  0  0  0
  5 24  2  0  0  0  0
  6 27  3  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 10  1  0  0  0  0
  7 29  1  0  0  0  0
  8 12  1  0  0  0  0
  8 30  1  0  0  0  0
  9 31  1  0  0  0  0
  9 32  1  0  0  0  0
 10 13  1  0  0  0  0
 10 33  1  0  0  0  0
 10 34  1  0  0  0  0
 11 14  1  0  0  0  0
 11 35  1  0  0  0  0
 12 15  1  0  0  0  0
 12 16  2  0  0  0  0
 13 17  2  0  0  0  0
 13 36  1  0  0  0  0
 14 18  1  0  0  0  0
 14 19  2  0  0  0  0
 15 20  2  0  0  0  0
 15 37  1  0  0  0  0
 16 38  1  0  0  0  0
 17 21  1  0  0  0  0
 17 39  1  0  0  0  0
 18 22  2  0  0  0  0
 18 27  1  0  0  0  0
 19 23  1  0  0  0  0
 19 40  1  0  0  0  0
 20 24  1  0  0  0  0
 20 41  1  0  0  0  0
 21 25  1  0  0  0  0
 21 42  1  0  0  0  0
 21 43  1  0  0  0  0
 22 26  1  0  0  0  0
 22 44  1  0  0  0  0
 23 26  2  0  0  0  0
 23 45  1  0  0  0  0
 24 46  1  0  0  0  0
 25 28  1  0  0  0  0
 25 47  1  0  0  0  0
 25 48  1  0  0  0  0
 26 49  1  0  0  0  0
M  END

$$$$