CIT
  Converted by convert_cif2sdf.py  2024/03/29 11:09:15

 21 20  0  0  0  0  0  0  0  0999 V2000
   -2.1914   -0.3833    0.1743 C   0  0  0  0  0
   -2.0804    0.2587    1.1907 O   0  0  0  0  0
   -3.4104   -0.6823   -0.3009 O   0  0  0  0  0
   -0.9614   -0.8469   -0.5616 C   0  0  0  0  0
    0.2876   -0.3754    0.1844 C   0  0  0  0  0
    0.2876   -0.9218    1.5043 O   0  0  0  0  0
    1.5366   -0.8469   -0.5616 C   0  0  0  0  0
    2.7666   -0.3833    0.1743 C   0  0  0  0  0
    2.6556    0.2587    1.1907 O   0  0  0  0  0
    3.9856   -0.6823   -0.3009 O   0  0  0  0  0
    0.2876    1.1283    0.2645 C   0  0  0  0  0
    0.2876    1.6762    1.3398 O   0  0  0  0  0
    0.2876    1.8591   -0.8619 O   0  0  0  0  0
   -4.2004   -0.3846    0.1710 H   0  0  0  0  0
   -0.9614   -1.9358   -0.6189 H   0  0  0  0  0
   -0.9614   -0.4307   -1.5690 H   0  0  0  0  0
    0.2876   -1.8845    1.4089 H   0  0  0  0  0
    1.5366   -1.9358   -0.6189 H   0  0  0  0  0
    1.5366   -0.4307   -1.5690 H   0  0  0  0  0
    4.7756   -0.3846    0.1710 H   0  0  0  0  0
    0.2876    2.8252   -0.8110 H   0  0  0  0  0
  1  2  2  0  0  0
  1  3  1  0  0  0
  1  4  1  0  0  0
  3 14  1  0  0  0
  4  5  1  0  0  0
  4 15  1  0  0  0
  4 16  1  0  0  0
  5  6  1  0  0  0
  5  7  1  0  0  0
  5 11  1  0  0  0
  6 17  1  0  0  0
  7  8  1  0  0  0
  7 18  1  0  0  0
  7 19  1  0  0  0
  8  9  2  0  0  0
  8 10  1  0  0  0
 10 20  1  0  0  0
 11 12  2  0  0  0
 11 13  1  0  0  0
 13 21  1  0  0  0
M  END
$$$$