
 OpenBabel04291915383D

 15 16  0  0  0  0  0  0  0  0999 V2000
    0.9698    0.0949    0.0091 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3127    0.0949    0.0091 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9841   -1.0629   -0.1009 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3271   -1.0629   -0.1009 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9985    0.0949    0.0091 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2983    1.2527    0.1191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0507    1.2527    0.1191 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9543   -2.1445   -0.2037 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2089   -2.1445   -0.2037 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8227   -3.2029   -0.3042 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1602   -2.4837   -0.2359 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.4538   -0.7949   -0.0754 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8287    0.9846    0.0936 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9481    0.4971    0.0473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5192    2.0605    0.1959 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  1  0  0  0  0
  2 13  1  0  0  0  0
  3  4  2  0  0  0  0
  3 11  1  0  0  0  0
  4  8  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 14  1  0  0  0  0
  6  7  1  0  0  0  0
  7 15  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
M  END
>  <SKU>
A11673

>  <Product Name>
Tioxolone

>  <CAS>
4991-65-5 

>  <M.Wt>
168.16986

>  <Formula>
C7H4O3S

>  <Synonyms>
thioxolone

>  <URL>
https://www.adooq.com/tioxolone.html

$$$$
