MMs03787645
  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
   -1.4581   -0.3520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5740   -1.8475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1875   -2.4198    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7853   -1.2780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2808   -1.3939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0662   -2.6719    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5243   -2.3199    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6401   -0.8244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2536   -0.2521    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.9181   -0.0391    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.2372   -0.7532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5152    0.0321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2783   -2.2526    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8520   -2.6328    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.8109   -4.1322    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1711   -1.9187    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.4579    1.1092    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3716    0.4263    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3336   -2.8239    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  2  0  0  0  0
  1 18  1  0  0  0  0
  2  3  2  0  0  0  0
  2 19  1  0  0  0  0
  3  4  1  0  0  0  0
  3 15  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 10  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 20  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
M  CHG  1  15   1
M  CHG  1  17  -1
M  END