HMDB0254366
     RDKit          3D
(4-Chloro-2-methylphenoxy)acetic acid
 22 22  0  0  0  0  0  0  0  0999 V2000
    0.9028    2.1028   -1.0453 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1076    0.8726   -0.2354 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2453    0.6885    0.5221 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4559   -0.4432    1.2798 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9131   -0.6376    2.2270 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.4719   -1.4054    1.2554 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3240   -1.2213    0.4919 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1003   -0.1003   -0.2669 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0043    0.1426   -1.0397 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1218   -0.6577   -1.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8268   -0.8623    0.0528 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8526   -1.6093    0.1210 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3600   -0.2251    1.1920 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2443    1.8871   -1.9337 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4991    2.9055   -0.4125 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8992    2.3519   -1.4846 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0137    1.4464    0.5372 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5826   -2.3179    1.8324 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4564   -1.9927    0.4650 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7971   -1.6063   -1.6928 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8216   -0.1094   -1.9056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5190    0.7910    1.2594 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  1  0
  4  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
  8  2  1  0
  1 14  1  0
  1 15  1  0
  1 16  1  0
  3 17  1  0
  6 18  1  0
  7 19  1  0
 10 20  1  0
 10 21  1  0
 13 22  1  0
M  END