化学加——结构式展示

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化学加
作者：黄炜
 邮箱：hwstu@sohu.com  
 36 37  0  0  0  0  0  0  0  0999 V2000
      2.39      3.96      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      3.24      4.34      0.00 N   0  0  0  0  0  0  0  0  0  0  0  0
      2.08      3.03      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      1.59      4.53      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      3.21      5.31      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      4.11      3.88      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      1.10      3.03      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      2.57      2.17      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      0.80      3.96      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      4.04      5.84      0.00 N   0  0  0  0  0  0  0  0  0  0  0  0
      2.33      5.78      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      4.94      4.40      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      0.61      2.17      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      0.00      4.60      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      4.90      5.38      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      5.80      3.95      0.00 F   0  0  0  0  0  0  0  0  0  0  0  0
      5.72      5.90      0.00 N   0  0  0  0  0  0  0  0  0  0  0  0
      6.60      5.45      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      6.63      4.47      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      7.42      5.97      0.00 O   0  0  0  0  0  0  0  0  0  0  0  0
      7.49      4.02      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      7.53      3.04      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      8.72      2.41      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      8.77      1.43      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      9.63      0.97      0.00 C   0  0  0  0  0  0  0  0  0  0  0  0
      8.01      4.91      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
      8.52      4.02      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
      6.50      3.05      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
      6.80      2.31      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
      9.23      3.30      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
      9.75      2.41      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
      7.74      1.43      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
      8.24      0.54      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
      9.66      0.00      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
     10.45      1.49      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
     10.47      0.49      0.00 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  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  1  0  0  0  0
  3  8  1  6  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  2  0  0  0  0
  7  9  1  0  0  0  0
  7 13  1  6  0  0  0
  9 14  1  1  0  0  0
 10 15  2  0  0  0  0
 12 15  1  0  0  0  0
 12 16  1  0  0  0  0
 15 17  1  0  0  0  0
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 25 36  1  0  0  0  0
M  ISO 11  26   2  27   2  28   2  29   2  30   2  31   2  32   2  33   2  34   2  35   2  36   2