HMDB0302233
     RDKit          3D
3,6-Dimethylcoumaran
 23 24  0  0  0  0  0  0  0  0999 V2000
    3.6722   -0.1947    0.3537 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2037    0.0108    0.2489 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4622    0.6160    1.2392 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0928    0.8022    1.1302 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5708    0.3758    0.0025 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1506   -0.2329   -1.0025 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5333   -0.4146   -0.8793 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7098   -0.5795   -2.0358 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9917   -0.7292   -1.4612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9794    0.4115   -0.4323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9588    0.1230    0.6585 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9066   -1.2741    0.2465 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0468    0.2420    1.2966 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1914    0.3712   -0.4654 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9865    0.9535    2.1314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4788    1.2828    1.9228 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1126   -0.8949   -1.6685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8129   -0.6283   -2.1731 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9848   -1.7178   -0.9289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1939    1.3361   -0.9961 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6360    1.0057    0.8228 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3969   -0.1402    1.5741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6450   -0.7244    0.4157 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
  7  2  1  0
 10  5  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  3 15  1  0
  4 16  1  0
  7 17  1  0
  9 18  1  0
  9 19  1  0
 10 20  1  0
 11 21  1  0
 11 22  1  0
 11 23  1  0
M  END