MMs02845245
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 18 18  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
    1.3314    0.6910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6729    0.0200    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7256    1.0886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0347    2.4199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5549    2.1742    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4864    3.2269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9596    2.8278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4055    2.4288    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7056    3.7615    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.8793    5.0134    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2029    3.8512    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.5528    1.0651    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0651   -0.5528    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5528   -1.0651    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9122    0.9097    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4642    3.9225    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0289    4.3107    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  2  0  0  0  0
  2  6  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 10  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 17  1  0  0  0  0
  7 18  1  0  0  0  0
  8  9  3  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  END