化学加——结构式展示

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化学加
作者：黄炜
 邮箱：hwstu@sohu.com  
 39 41  0  0  0  0  0  0  0  0999 V2000
     13.03      2.97      0.00 N   0  0  0  0  0  0  0  0  0  0  0  0
     12.99      1.87      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     13.76      3.22      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     12.57      3.58      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     12.72      0.97      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     12.22      2.40      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
     13.74      3.98      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     14.42      2.85      0.00 N   0  0  0  0  0  0  0  0  0  0  0  0
     13.01      4.21      0.00 N   0  0  0  0  0  0  0  0  0  0  0  0
     11.79      0.95      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     12.79      0.00      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
     11.48      1.83      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     14.40      4.38      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     15.09      3.24      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     11.83      0.02      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
     11.42      2.63      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     15.07      4.00      0.00 N   0  0  0  0  0  0  0  0  0  0  0  0
     14.39      5.14      0.00 N   0  0  0  0  0  0  0  0  0  0  0  0
     10.63      2.89      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      9.73      2.90      0.00 P   0  0  0  0  0  0  0  0  0  0  0  0
      8.58      2.91      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      9.72      1.97      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      9.74      3.67      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      7.85      2.87      0.00 P   0  0  0  0  0  0  0  0  0  0  0  0
      7.07      2.88      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      7.85      1.95      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      7.86      3.65      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      6.09      2.85      0.00 P   0  0  0  0  0  0  0  0  0  0  0  0
      5.05      3.25      0.00 N   0  0  0  0  0  0  0  0  0  0  0  0
      6.09      1.93      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      6.10      3.63      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      3.10      3.25      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      3.10      1.31      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      3.10      5.20      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      2.00      0.59      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      4.27      1.31      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      1.00      1.02      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      0.00      0.45      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      1.16      3.25      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  6  0  0  0
  6 12  1  0  0  0  0
  7  9  1  0  0  0  0
  7 13  1  0  0  0  0
  8 14  2  0  0  0  0
 10 12  1  0  0  0  0
 10 15  1  6  0  0  0
 12 16  1  1  0  0  0
 13 17  2  0  0  0  0
 13 18  1  0  0  0  0
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 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
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 20 23  2  0  0  0  0
 21 24  1  0  0  0  0
 24 25  1  0  0  0  0
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 24 27  2  0  0  0  0
 25 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
 28 31  2  0  0  0  0
 32 29  1  1  0  0  0
 32 33  1  0  0  0  0
 32 34  1  0  0  0  0
 32 39  1  1  0  0  0
 33 35  1  0  0  0  0
 33 36  2  0  0  0  0
 35 37  1  0  0  0  0
 37 38  1  0  0  0  0