MMs00353839
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 20 20  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    0.0097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2415    1.3136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7415   -1.3039    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2323   -1.4704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5346   -2.9396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2307   -3.6811    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1226   -2.6702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3467   -2.9725    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.9009   -3.5586    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -5.1202   -2.6848    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0480   -5.0513    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -3.2432   -0.3622    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.7889    1.0674    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7084   -0.6836    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.2007    1.1831    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1303    0.4031    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2993   -1.1734    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6302   -0.3934    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4415    1.3214    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  4  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
  2 18  1  0  0  0  0
  2 19  1  0  0  0  0
  3 20  1  0  0  0  0
  4  5  1  0  0  0  0
  4  8  1  0  0  0  0
  5  6  2  0  0  0  0
  5 13  1  0  0  0  0
  6  7  1  0  0  0  0
  6 10  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  CHG  1  13   1
M  CHG  1  15  -1
M  END