-molcms-05192601282D

 21 20  0  0  0  0  0  0  0  0999 V2000
    5.5000    1.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.5000    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7066    0.3912    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3695    0.0086    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0000    1.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    1.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    0.1340    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000    0.1340    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000    1.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.8660    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    2.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000    3.5981    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000    2.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    3.5981    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5000    2.7321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5000    2.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5000    1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5000    0.0000    0.0000 Na  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 15  6  2  0  0  0  0
 15 16  1  0  0  0  0
  5 17  2  0  0  0  0
  1 18  2  0  0  0  0
  1 19  2  0  0  0  0
  1 20  1  0  0  0  0
M  CHG  2  20  -1  21   1
M  END