MMs00532035
  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
   -1.5000   -0.0115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2400   -1.3163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4800   -2.6095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0199   -2.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7599   -1.2932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2599   -1.2817    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.1509   -2.4885    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5738   -2.0140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5623   -0.5141    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1322   -0.0615    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7941   -2.8863    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7399   -1.3278    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -4.4799   -2.6325    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4999   -0.0345    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5920    1.0438    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1079    1.0231    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0720   -3.6533    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6279   -3.6326    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8866   -2.3899    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 16  1  0  0  0  0
  2  3  2  0  0  0  0
  2 17  1  0  0  0  0
  3  4  1  0  0  0  0
  3 13  1  0  0  0  0
  4  5  2  0  0  0  0
  4 18  1  0  0  0  0
  5  6  1  0  0  0  0
  5 19  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 11  2  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
  9 12  1  0  0  0  0
 10 11  1  0  0  0  0
 12 20  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1  13   1
M  CHG  1  15  -1
M  END