MMs02890107
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 19 19  0  0  0  0  0  0  0  0999 V2000
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000   -0.0115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2400   -1.3163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4800   -2.6095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0200   -2.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7600   -1.2932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2200   -3.9143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4601   -5.2075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7399   -1.3278    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -4.4999   -0.0346    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4799   -2.6326    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5920    1.0438    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1079    1.0231    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6279   -3.6326    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1452   -3.1500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1333   -4.6927    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0521   -6.2513    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2599   -1.2817    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8519   -0.2379    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 12  1  0  0  0  0
  2  3  2  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3  9  1  0  0  0  0
  4  5  2  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  5 14  1  0  0  0  0
  6 18  1  0  0  0  0
  7  8  1  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 18 19  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  END