化学加——结构式展示

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化学加
作者：黄炜
 邮箱：hwstu@sohu.com  
 33 36  0  0  0  0  0  0  0  0999 V2000
      2.48      1.53      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      1.64      1.56      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      2.72      0.72      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      3.06      2.15      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      1.37      0.75      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      1.10      2.19      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      2.04      0.25      0.00 N   0  0  0  0  0  0  0  0  0  0  0  0
      3.54      0.53      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      2.76      3.36      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      3.88      1.95      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      0.54      0.62      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      0.27      2.05      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      4.12      1.14      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      3.59      4.23      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      0.00      1.24      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      4.42      3.98      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      5.12      4.52      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      4.89      3.29      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      6.13      3.95      0.00 N   0  0  0  0  0  0  0  0  0  0  0  0
      7.12      4.52      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      8.11      3.95      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      9.11      4.54      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
     10.11      3.97      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     10.11      2.82      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     11.08      4.55      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     11.11      2.26      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      9.12      2.24      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
     12.08      3.99      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     12.10      2.85      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      9.12      1.10      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
     10.11      0.53      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
      8.13      0.53      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
      9.41      0.00      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  2  0  0  0  0
  5  7  1  0  0  0  0
  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  8 13  2  0  0  0  0
  9 14  1  0  0  0  0
 10 13  1  0  0  0  0
 11 15  2  0  0  0  0
 12 15  1  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
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 24 26  1  0  0  0  0
 24 27  1  0  0  0  0
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 27 30  1  0  0  0  0
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 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
 30 33  1  0  0  0  0
M  ISO  3  31   2  32   2  33   2