化学加——结构式展示

TIPS:滚动鼠标可以放大缩小结构,点击拖动可以局部更改。

化学加
作者：黄炜
 邮箱：hwstu@sohu.com  
 39 42  0  0  0  0  0  0  0  0999 V2000
      2.71      7.39      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      2.50      6.40      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      3.71      7.50      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      2.30      8.31      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      3.37      5.90      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      1.58      6.00      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      4.12      6.58      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      3.92      8.48      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      3.05      8.99      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      4.12      5.23      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      0.88      6.72      0.00 S   0  0  0  0  0  0  0  0  0  0  0  0
      2.30      9.66      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      3.64      9.80      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      3.66      4.33      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      4.98      4.69      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      0.00      6.23      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      0.32      7.56      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      1.66      7.35      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      2.66      4.28      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      4.94      3.69      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      2.20      3.38      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      2.27      4.87      0.00 S   0  0  0  0  0  0  0  0  0  0  0  0
      5.88      3.31      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      2.75      2.53      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      6.02      2.31      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      6.67      3.93      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      2.29      1.64      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      3.76      2.59      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      6.95      1.93      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      5.22      1.69      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      2.84      0.79      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      4.30      1.74      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      7.09      0.94      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      5.36      0.69      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      3.85      0.84      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      6.30      0.32      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      4.39      0.00      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      2.78      5.09      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
      4.73      6.03      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  1  0  0  0
  2  5  1  0  0  0  0
  2  6  1  1  0  0  0
  3  7  1  0  0  0  0
  3  8  1  1  0  0  0
  4  9  1  0  0  0  0
  5  7  1  0  0  0  0
  5 10  1  0  0  0  0
  5 38  1  1  0  0  0
  6 11  1  0  0  0  0
  8  9  1  0  0  0  0
  9 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
 10 15  1  0  0  0  0
 10 39  1  6  0  0  0
 11 16  2  0  0  0  0
 11 17  2  0  0  0  0
 11 18  1  0  0  0  0
 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  2  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 23 25  1  0  0  0  0
 23 26  2  0  0  0  0
 24 27  2  0  0  0  0
 24 28  1  0  0  0  0
 25 29  2  0  0  0  0
 25 30  1  0  0  0  0
 27 31  1  0  0  0  0
 28 32  2  0  0  0  0
 29 33  1  0  0  0  0
 30 34  2  0  0  0  0
 31 35  2  0  0  0  0
 32 35  1  0  0  0  0
 33 36  2  0  0  0  0
 34 36  1  0  0  0  0
 35 37  1  0  0  0  0