MMs00497409
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  1  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   -0.0081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2430   -1.3112    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4860   -2.6061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0140   -2.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7570   -1.2950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2570   -1.2869    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.6570   -2.3261    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    0.0162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4999    0.0243    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    5.2569   -1.2707    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2429    1.3274    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.0140   -2.5818    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5944    1.0425    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1056    1.0279    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0803   -3.6486    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6196   -3.6340    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8701    0.4205    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2020    1.1991    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2140   -2.5754    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 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4 16  1  0  0  0  0
  5  6  1  0  0  0  0
  5 17  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 13  1  0  0  0  0
  9 10  1  0  0  0  0
  9 18  1  0  0  0  0
  9 19  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 13 20  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  END