B2JR3Q
  -OEChem-04022114083D

 19 19  0     0  0  0  0  0  0999 V2000
    2.8802   -0.2721   -0.1103 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.7111    0.7657    0.3857 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5392   -0.7422   -1.4407 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1431   -1.2115    0.9650 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2611    0.7356   -0.2602 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8811   -0.4963   -0.2298 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3796    0.5109    0.2627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5194    1.5645    0.0967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0855   -0.8035    0.3016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8836    1.3034   -0.0305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4497   -1.0645    0.1745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3488   -0.0111    0.0082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7462   -0.2789   -0.1230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1625    2.5902    0.0652 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5783   -1.6494    0.4478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5721    2.1352   -0.1597 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7980   -2.0941    0.2106 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2061    1.4908   -0.9556 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1756    0.2659   -0.2617 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  5  1  0  0  0  0
  2  7  1  0  0  0  0
  5 18  1  0  0  0  0
  5 19  1  0  0  0  0
  6 13  3  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 14  1  0  0  0  0
  9 11  2  0  0  0  0
  9 15  1  0  0  0  0
 10 12  2  0  0  0  0
 10 16  1  0  0  0  0
 11 12  1  0  0  0  0
 11 17  1  0  0  0  0
 12 13  1  0  0  0  0
M  END

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