BJX98W
  -OEChem-04022104363D

 21 22  0     0  0  0  0  0  0999 V2000
   -4.4969   -0.4620    0.1996 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2494    1.5312   -0.1435 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3487   -2.5397   -0.0196 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.3329   -0.0996   -1.1869 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4988    0.0121    1.0772 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4421    0.1951   -0.0046 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9080    0.2662   -0.0273 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2388    0.2257    1.2122 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2701    0.0982   -1.2001 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3442    0.0623    0.0383 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6320    0.1594    1.2337 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6632    0.0318   -1.1787 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8029   -0.9265    0.0373 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5289    1.4529   -0.0985 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7967   -0.0070    0.0609 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3023    0.3005    2.1525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2468    0.0733   -2.1565 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1437    0.1844    2.1923 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1779   -0.0430   -2.1325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9764    2.3852   -0.1481 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3124   -0.1463   -1.1607 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  2 14  1  0  0  0  0
  3 13  2  0  0  0  0
  4 15  1  0  0  0  0
  4 21  1  0  0  0  0
  5 15  2  0  0  0  0
  6  7  1  0  0  0  0
  6  8  2  0  0  0  0
  6  9  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  2  0  0  0  0
  8 11  1  0  0  0  0
  8 16  1  0  0  0  0
  9 12  2  0  0  0  0
  9 17  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 10 15  1  0  0  0  0
 11 18  1  0  0  0  0
 12 19  1  0  0  0  0
 14 20  1  0  0  0  0
M  END

$$$$