MMs00495283
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 20 21  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
    1.4106   -0.5102    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5577    0.4563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0139    0.0964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7207   -1.2266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2199   -1.2759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0122   -0.0023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3054    1.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8062    1.3700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8397    2.5172    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.4500    1.9524    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5114   -0.0516    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    9.3037    1.2221    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2183   -1.3746    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.4081    1.1285    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1285    0.4081    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4081   -1.1285    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0869   -2.2456    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7854   -2.3343    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9392    2.3397    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  2  0  0  0  0
  4  5  1  0  0  0  0
  4  9  2  0  0  0  0
  5  6  2  0  0  0  0
  5 18  1  0  0  0  0
  6  7  1  0  0  0  0
  6 19  1  0  0  0  0
  7  8  2  0  0  0  0
  7 12  1  0  0  0  0
  8  9  1  0  0  0  0
  8 20  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
M  CHG  1  12   1
M  CHG  1  14  -1
M  END