
 OpenBabel04291915463D

 46 49  0  0  1  0  0  0  0  0999 V2000
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   10.8642   -0.5886    6.8276 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5213   -0.5908    6.8274 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7993   -0.4834    5.5815 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4486   -0.3846    4.4611 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.7993   -0.2879    3.3405 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.8280   -0.2812    3.3411 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4851   -0.2834    3.3409 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8136   -0.1835    2.1822 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4707   -0.1858    2.1820 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7993   -0.0858    1.0233 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5403    0.0269   -0.2552 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.3586   -1.1202   -0.4307 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5525    0.1256   -1.4063 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.2875    0.2374   -2.6744 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3323    0.3329   -3.7876 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0923    0.4486   -5.0989 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1045    0.5473   -6.2500 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6766    1.3535   -1.2183 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4563   -0.4856    5.5813 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8498   -0.6930    7.9859 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5500   -0.5841    6.8280 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0196   -0.4096    4.7787 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3802   -0.6653    7.7181 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.3242   -0.4336    5.1179 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.3440   -0.2027    2.4508 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9691   -0.3620    4.2312 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3296   -0.1050    1.2919 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1540    0.9032   -0.2356 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8022   -1.9146   -0.4484 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9388   -0.7507   -1.4258 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8753   -0.5866   -2.8005 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7156    1.1973   -3.6553 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7186   -0.5434   -3.8071 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7089   -0.4158   -5.2312 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7060    1.3249   -5.0794 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6952   -0.3219   -6.7210 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9734    1.0613   -7.1793 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1329    2.2332   -0.8148 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7939    1.4700   -0.6249 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6302   -0.5407    6.1974 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0251   -0.7482    8.6038 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.4996   -0.6176    7.2307 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2 25  1  0  0  0  0
  3  4  1  0  0  0  0
  3 26  1  0  0  0  0
  4  5  2  0  0  0  0
  4 27  1  0  0  0  0
  5 24  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 23  1  0  0  0  0
  7  8  1  0  0  0  0
  8 13  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 28  1  0  0  0  0
 10 11  1  0  0  0  0
 10 29  1  0  0  0  0
 11 12  2  0  0  0  0
 11 30  1  0  0  0  0
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 14 15  1  0  0  0  0
 14 23  2  0  0  0  0
 15 17  1  0  0  0  0
 15 16  1  0  0  0  0
 15 32  1  0  0  0  0
 16 33  1  0  0  0  0
 17 18  1  0  0  0  0
 17 22  1  0  0  0  0
 17 34  1  0  0  0  0
 18 19  1  0  0  0  0
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 19 20  1  0  0  0  0
 19 36  1  0  0  0  0
 19 37  1  0  0  0  0
 20 21  1  0  0  0  0
 20 38  1  0  0  0  0
 20 39  1  0  0  0  0
 21 22  1  0  0  0  0
 21 40  1  0  0  0  0
 21 41  1  0  0  0  0
 22 42  1  0  0  0  0
 22 43  1  0  0  0  0
 23 44  1  0  0  0  0
 24 25  2  0  0  0  0
 24 45  1  0  0  0  0
 25 46  1  0  0  0  0
M  END
>  <SKU>
A15883

>  <Product Name>
Vacquinol-1

>  <CAS>
5428-80-8

>  <M.Wt>
352.85724

>  <Formula>
C21H21ClN2O

>  <Synonyms>
NSC13316

>  <URL>
https://www.adooq.com/vacquinol-1.html

$$$$
