HMDB0002005
     RDKit          3D
Methionine sulfoxide
 21 20  0  0  0  0  0  0  0  0999 V2000
    3.3419   -0.3882    0.7283 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6547   -0.6708    0.2572 S   0  0  0  0  0  4  0  0  0  0  0  0
    1.4267   -1.9791   -0.4457 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9224    0.7273   -0.5813 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4997    0.4930   -0.9800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3102    0.2136    0.2766 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.7349   -0.9661    0.8927 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7293    0.0009    0.0102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2824   -1.0837    0.3086 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5160    0.9766   -0.5765 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5676    0.6935    0.7985 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0641   -0.8159    0.0003 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5266   -0.8473    1.7283 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5032    1.0327   -1.4936 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9762    1.5937    0.1098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9232    1.3797   -1.4759 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6219   -0.3701   -1.6381 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1618    1.0814    0.9734 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1864   -1.7915    0.3963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1368   -1.0219    1.8728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8808    1.7419   -0.0126 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  6  8  1  0
  8  9  2  0
  8 10  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  4 14  1  0
  4 15  1  0
  5 16  1  0
  5 17  1  0
  6 18  1  1
  7 19  1  0
  7 20  1  0
 10 21  1  0
M  END