BK52LI
  -OEChem-04022112453D

 31 33  0     1  0  0  0  0  0999 V2000
   -2.2490    1.0996   -1.7889 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2437    1.1717    0.1334 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0964   -0.4396    0.0863 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1941    1.5617    0.4655 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5900    1.2090    0.2153 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5240   -0.9147   -0.3482 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4791    0.1328    0.3163 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.3910   -0.0072   -0.9166 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2565   -0.5455    1.4669 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7969   -0.0977   -0.3308 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.5861   -1.0141    0.8651 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0807    0.2558    0.1671 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1653   -1.7459   -0.2384 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1188   -0.6248   -0.1118 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5303   -1.8898   -0.3678 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4097   -0.0995   -0.0789 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4860    1.9483    0.4658 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3158    1.1907    0.5559 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1643   -0.9182   -1.4823 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4500    0.1951    2.2526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7181   -1.3767    1.9334 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5261   -0.4798   -1.0510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4909   -2.0545    0.5325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3930   -0.9541    1.6018 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6322   -2.4685   -0.3471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9146    1.0041   -2.4912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1132    1.0404    0.5485 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0397   -2.8101   -0.6183 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6645    2.9927    0.6982 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4050   -1.8937   -0.5696 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4490   -0.5079   -0.3176 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1 26  1  0  0  0  0
  2 10  1  0  0  0  0
  2 27  1  0  0  0  0
  3  7  1  0  0  0  0
  3 12  1  0  0  0  0
  3 13  1  0  0  0  0
  4 12  2  0  0  0  0
  4 17  1  0  0  0  0
  5 16  1  0  0  0  0
  5 17  2  0  0  0  0
  6 16  1  0  0  0  0
  6 30  1  0  0  0  0
  6 31  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 18  1  0  0  0  0
  8 10  1  0  0  0  0
  8 19  1  0  0  0  0
  9 11  1  0  0  0  0
  9 20  1  0  0  0  0
  9 21  1  0  0  0  0
 10 11  1  0  0  0  0
 10 22  1  0  0  0  0
 11 23  1  0  0  0  0
 11 24  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  2  0  0  0  0
 13 25  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 28  1  0  0  0  0
 17 29  1  0  0  0  0
M  END

$$$$