LMBQ95
  -OEChem-05032302043D

 73 77  0     1  0  0  0  0  0999 V2000
    4.0866    2.4621   -1.1923 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.8491   -3.2781    0.6764 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.6333   -3.9052    1.7715 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.7411   -3.6659   -0.3981 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9921    0.3598   -0.8004 F   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1415    0.6985   -1.0031 F   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3521   -0.0463    0.8937 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.1219    3.5679   -0.2575 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4225    2.6583   -2.5875 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7292    3.4314   -0.8895 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1137   -4.0783    1.3646 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5851   -1.8109    0.9311 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9593    2.1240    0.2874 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5678    1.6857   -1.0869 N   0  0  2  0  0  0  0  0  0  0  0  0
   -4.8840   -3.4070   -0.7152 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4699   -0.2055   -0.5040 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2268    2.9965    1.3417 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5997   -1.1016   -1.2214 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6834   -1.8923   -0.9975 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0891   -4.1889   -0.6977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3354   -3.6846   -0.0310 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2778   -3.7989   -1.5263 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9011    1.6888    0.2409 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2450    0.3564    0.6058 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4179    0.4308   -1.8614 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9531    0.0112   -1.8687 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8950    2.7926    0.1464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6394   -1.0182   -0.2763 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9538   -3.3985    0.3334 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1329    1.1885   -0.5585 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7716   -2.5740    0.1642 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7029   -1.7036    0.9203 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8055   -2.5082    1.1481 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7791    4.0185    1.5208 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6915    0.2494   -1.4257 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3984    1.1196    0.8091 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5155   -0.7585   -0.9251 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2224    0.1116    1.3097 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1554    3.5158    1.1932 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7811   -0.8274    0.4426 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9015    4.1297    0.1871 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6876    2.4342    1.8950 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1799    3.6622   -0.1171 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9662    1.9666    1.5909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7122    2.5806    0.5849 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1933   -3.1643    0.7291 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0977    0.7755   -0.1467 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8868   -5.2529   -0.6229 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9441   -4.4002    0.5076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3257   -2.6900    0.3978 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2312   -2.8803   -2.0984 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8494   -4.5910   -1.9941 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6045    1.9483    1.0388 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0315   -0.3628    0.8707 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6229    0.4818    1.4982 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0178   -0.3720   -1.4218 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7430    0.5891   -2.8948 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8595   -0.9097   -2.4573 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3383    0.7810   -2.3508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7029   -2.8422   -1.5411 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4761    2.4471    2.1582 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0732   -1.6678    1.6766 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8835   -3.0649    2.0758 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5154    4.8834    0.9015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7453    4.3410    2.5675 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4978    0.2827   -2.4940 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9763    1.8395    1.5040 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9489   -1.4798   -1.6123 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4254    0.0626    2.3760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4993    4.9723   -0.3690 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1190    1.9487    2.6838 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7562    4.1437   -0.9024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3708    1.1272    2.1495 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  2  0  0  0  0
  1  9  2  0  0  0  0
  1 14  1  0  0  0  0
  1 30  1  0  0  0  0
  2 46  1  0  0  0  0
  3 46  1  0  0  0  0
  4 46  1  0  0  0  0
  5 47  1  0  0  0  0
  6 47  1  0  0  0  0
  7 47  1  0  0  0  0
 10 27  2  0  0  0  0
 11 29  2  0  0  0  0
 12 40  1  0  0  0  0
 12 46  1  0  0  0  0
 13 45  1  0  0  0  0
 13 47  1  0  0  0  0
 14 23  1  0  0  0  0
 14 25  1  0  0  0  0
 15 20  1  0  0  0  0
 15 29  1  0  0  0  0
 15 60  1  0  0  0  0
 16 24  1  0  0  0  0
 16 26  1  0  0  0  0
 16 28  1  0  0  0  0
 17 27  1  0  0  0  0
 17 34  1  0  0  0  0
 17 61  1  0  0  0  0
 18 19  1  0  0  0  0
 18 28  2  0  0  0  0
 19 31  2  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 48  1  0  0  0  0
 21 22  1  0  0  0  0
 21 49  1  0  0  0  0
 21 50  1  0  0  0  0
 22 51  1  0  0  0  0
 22 52  1  0  0  0  0
 23 24  1  0  0  0  0
 23 27  1  0  0  0  0
 23 53  1  0  0  0  0
 24 54  1  0  0  0  0
 24 55  1  0  0  0  0
 25 26  1  0  0  0  0
 25 56  1  0  0  0  0
 25 57  1  0  0  0  0
 26 58  1  0  0  0  0
 26 59  1  0  0  0  0
 28 32  1  0  0  0  0
 29 31  1  0  0  0  0
 30 35  2  0  0  0  0
 30 36  1  0  0  0  0
 31 33  1  0  0  0  0
 32 33  2  0  0  0  0
 32 62  1  0  0  0  0
 33 63  1  0  0  0  0
 34 39  1  0  0  0  0
 34 64  1  0  0  0  0
 34 65  1  0  0  0  0
 35 37  1  0  0  0  0
 35 66  1  0  0  0  0
 36 38  2  0  0  0  0
 36 67  1  0  0  0  0
 37 40  2  0  0  0  0
 37 68  1  0  0  0  0
 38 40  1  0  0  0  0
 38 69  1  0  0  0  0
 39 41  2  0  0  0  0
 39 42  1  0  0  0  0
 41 43  1  0  0  0  0
 41 70  1  0  0  0  0
 42 44  2  0  0  0  0
 42 71  1  0  0  0  0
 43 45  2  0  0  0  0
 43 72  1  0  0  0  0
 44 45  1  0  0  0  0
 44 73  1  0  0  0  0
M  END

$$$$