B0EKF4
  -OEChem-04022112523D

 48 49  0     1  0  0  0  0  0999 V2000
   -1.7185    1.7469   -2.0289 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9280    1.8687   -1.8730 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2901    0.7563    2.8983 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0162   -0.9745   -1.3647 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9642    1.2857    0.3748 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0907   -0.2405   -0.3322 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4303   -1.6988    0.0045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7310    0.7176    0.6813 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5777   -0.0373   -0.3852 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.9378   -1.9153    0.1158 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2379    0.4969    0.7916 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5718   -0.9554    1.1176 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1707    1.4000   -0.7656 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.3463    1.5558   -0.8363 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3959    1.3420    0.5631 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.0429    0.0265    0.1870 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7245    1.7689    1.9962 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3145    0.0129   -0.3863 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3674   -1.1726    0.4137 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9105   -1.1998   -0.7329 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9634   -2.3853    0.0674 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2349   -2.3987   -0.5061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5225   -0.0207   -1.3195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9532   -1.9891    0.9494 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0667   -2.3864   -0.7663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5762    1.7613    0.3907 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2710    0.5842    1.6687 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1533   -0.2906    0.5935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1406   -2.9489    0.4181 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4009   -1.7737   -0.8686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7184    0.7785   -0.1536 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6507    1.1524    1.5668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6591   -1.0920    1.1223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2150   -1.1937    2.1271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5245    2.1304   -0.0315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0647   -1.9264   -1.0046 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0221   -0.7949   -1.4976 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4546    1.0609   -2.6660 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3953    1.0283    1.1758 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7721    2.1183   -0.1160 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8036    1.9022    2.1273 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2169    2.7044    2.2541 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8519    0.9400   -0.5664 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3835   -1.1975    0.8732 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9007   -1.2105   -1.1787 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4389   -3.3192    0.2472 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5158    1.0582    3.7946 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6992   -3.3430   -0.7751 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 13  1  0  0  0  0
  1 38  1  0  0  0  0
  2 14  2  0  0  0  0
  3 17  1  0  0  0  0
  3 47  1  0  0  0  0
  4  9  1  0  0  0  0
  4 36  1  0  0  0  0
  4 37  1  0  0  0  0
  5 14  1  0  0  0  0
  5 15  1  0  0  0  0
  5 39  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 23  1  0  0  0  0
  7 10  1  0  0  0  0
  7 24  1  0  0  0  0
  7 25  1  0  0  0  0
  8 11  1  0  0  0  0
  8 26  1  0  0  0  0
  8 27  1  0  0  0  0
  9 13  1  0  0  0  0
  9 28  1  0  0  0  0
 10 12  1  0  0  0  0
 10 29  1  0  0  0  0
 10 30  1  0  0  0  0
 11 12  1  0  0  0  0
 11 31  1  0  0  0  0
 11 32  1  0  0  0  0
 12 33  1  0  0  0  0
 12 34  1  0  0  0  0
 13 14  1  0  0  0  0
 13 35  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 40  1  0  0  0  0
 16 18  2  0  0  0  0
 16 19  1  0  0  0  0
 17 41  1  0  0  0  0
 17 42  1  0  0  0  0
 18 20  1  0  0  0  0
 18 43  1  0  0  0  0
 19 21  2  0  0  0  0
 19 44  1  0  0  0  0
 20 22  2  0  0  0  0
 20 45  1  0  0  0  0
 21 22  1  0  0  0  0
 21 46  1  0  0  0  0
 22 48  1  0  0  0  0
M  END

$$$$