MMs01298903
  MOE2007           2D
CORINA 3.40 0006  02.08.2006
 30 31  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
   -0.7512    1.2984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2512    1.2970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0000   -0.0027    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2488   -1.3010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7488   -1.2997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5000   -0.0040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2488   -1.3037    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7488   -1.3051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5000   -0.0067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0000   -0.0080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7488   -1.3077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9977   -2.6061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4977   -2.6048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7465   -3.9031    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -7.4954   -5.2028    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2465   -3.9018    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  -11.2488   -1.3091    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
  -11.9977   -2.6088    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0000   -0.0107    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.2000    0.0011    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1521    2.3381    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8521    2.3357    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8479   -2.3408    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1479   -2.3384    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2927    1.1779    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6280    0.4054    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9009    1.0331    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6009    1.0307    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5968   -3.6459    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 21  1  0  0  0  0
  2  3  2  0  0  0  0
  2 22  1  0  0  0  0
  3  4  1  0  0  0  0
  3 23  1  0  0  0  0
  4  5  2  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  5 24  1  0  0  0  0
  6 25  1  0  0  0  0
  7  8  1  0  0  0  0
  7 26  1  0  0  0  0
  7 27  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 14  2  0  0  0  0
 10 11  2  0  0  0  0
 10 28  1  0  0  0  0
 11 12  1  0  0  0  0
 11 29  1  0  0  0  0
 12 13  2  0  0  0  0
 12 18  1  0  0  0  0
 13 14  1  0  0  0  0
 13 30  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  1  15   1
M  CHG  1  17  -1
M  CHG  1  18   1
M  CHG  1  20  -1
M  END