LL96MG
  -OEChem-05032301523D

 47 49  0     0  0  0  0  0  0999 V2000
   -2.9210   -1.8948   -1.3130 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0584    1.8923    0.5031 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6357   -0.5195   -0.3804 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8294    1.6160    0.4690 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5380    2.2614    0.3728 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0927    1.0315    0.5888 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4860   -1.7941    1.8817 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1332   -1.9634    0.3880 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3183   -0.7088   -0.4450 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3341   -3.1021    2.6626 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5976   -0.7143    2.5050 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6967   -0.1791   -0.5344 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2637   -0.1105   -1.0362 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1345   -0.5599   -1.0033 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2768    0.1064   -0.4977 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0105    1.0939   -0.0586 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6899   -0.9748   -1.1054 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5792   -1.7691   -1.4862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3523   -0.7506   -0.7088 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5562    1.3256    0.1150 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3176    1.5713   -0.1538 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9971   -0.4972   -1.2007 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3110    0.7758   -0.7249 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7767    0.6881    0.2031 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4784    3.1762    0.9593 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5317   -1.4763    1.9772 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7574   -2.7627   -0.0333 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1164   -2.3613    0.3395 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9805   -3.8790    2.2413 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6141   -2.9650    3.7123 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3016   -3.4660    2.6305 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8129   -0.6129    3.5746 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7563    0.2679    2.0560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4638   -0.9664    2.4035 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4280    0.8112   -1.5919 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4667   -1.9660   -1.4921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0957   -2.6103   -1.9628 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6387    2.5475    0.1924 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7701   -1.1156   -1.6475 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3292    1.1467   -0.8001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7823    3.1336    0.8224 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5751    2.0703    0.1382 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5953    3.6725    1.3756 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8330    3.8032    0.1341 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2088    3.0982    1.7718 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8463    0.3802    0.4173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2635    1.9239    1.0313 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 18  1  0  0  0  0
  1 19  1  0  0  0  0
  2 16  1  0  0  0  0
  2 25  1  0  0  0  0
  3 19  2  0  0  0  0
  3 24  1  0  0  0  0
  4 20  1  0  0  0  0
  4 24  2  0  0  0  0
  5 20  1  0  0  0  0
  5 41  1  0  0  0  0
  5 42  1  0  0  0  0
  6 24  1  0  0  0  0
  6 46  1  0  0  0  0
  6 47  1  0  0  0  0
  7  8  1  0  0  0  0
  7 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7 26  1  0  0  0  0
  8  9  1  0  0  0  0
  8 27  1  0  0  0  0
  8 28  1  0  0  0  0
  9 12  1  0  0  0  0
  9 13  2  0  0  0  0
 10 29  1  0  0  0  0
 10 30  1  0  0  0  0
 10 31  1  0  0  0  0
 11 32  1  0  0  0  0
 11 33  1  0  0  0  0
 11 34  1  0  0  0  0
 12 16  1  0  0  0  0
 12 17  2  0  0  0  0
 13 14  1  0  0  0  0
 13 35  1  0  0  0  0
 14 15  1  0  0  0  0
 14 18  2  0  0  0  0
 15 19  1  0  0  0  0
 15 20  2  0  0  0  0
 16 21  2  0  0  0  0
 17 22  1  0  0  0  0
 17 36  1  0  0  0  0
 18 37  1  0  0  0  0
 21 23  1  0  0  0  0
 21 38  1  0  0  0  0
 22 23  2  0  0  0  0
 22 39  1  0  0  0  0
 23 40  1  0  0  0  0
 25 43  1  0  0  0  0
 25 44  1  0  0  0  0
 25 45  1  0  0  0  0
M  END

$$$$