MMs00010296
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 18 17  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
   -0.7462   -1.3012    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.5550   -2.0474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8519   -1.2936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8475    0.2064    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0474   -0.5550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0518    0.9450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0410   -0.5970    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5970    1.0410    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0410    0.5970    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1707   -2.5082    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3291   -2.9644    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1531   -2.0398    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -3.3443   -1.3088    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.4924   -2.6025    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.5334   -2.0055    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0894   -3.6434    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9719   -2.9009    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  1 10  1  0  0  0  0
  2  3  1  0  0  0  0
  2  6  1  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  1  0  0  0  0
  3 12  1  0  0  0  0
  4  5  2  0  0  0  0
  4 13  1  0  0  0  0
  6  7  2  0  0  0  0
  6 14  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
M  CHG  1  13  -1
M  CHG  1  14  -1
M  CHG  1  15   1
M  END