COMPND    HMDB0014894
HETATM    1  O1  UNL     1      -1.551   2.390  -1.338  1.00  0.00           O  
HETATM    2  C1  UNL     1      -1.950   1.280  -0.650  1.00  0.00           C  
HETATM    3  C2  UNL     1      -3.138   1.376   0.084  1.00  0.00           C  
HETATM    4 CL1  UNL     1      -3.997   2.885   0.084  1.00  0.00          CL  
HETATM    5  C3  UNL     1      -3.615   0.309   0.784  1.00  0.00           C  
HETATM    6  C4  UNL     1      -2.927  -0.874   0.775  1.00  0.00           C  
HETATM    7 CL2  UNL     1      -3.559  -2.230   1.684  1.00  0.00          CL  
HETATM    8  C5  UNL     1      -1.735  -0.993   0.050  1.00  0.00           C  
HETATM    9 CL3  UNL     1      -0.961  -2.555   0.106  1.00  0.00          CL  
HETATM   10  C6  UNL     1      -1.232   0.063  -0.661  1.00  0.00           C  
HETATM   11  C7  UNL     1       0.079   0.050  -1.332  1.00  0.00           C  
HETATM   12  C8  UNL     1       1.270  -0.017  -0.451  1.00  0.00           C  
HETATM   13  C9  UNL     1       2.044  -1.196  -0.417  1.00  0.00           C  
HETATM   14  O2  UNL     1       1.810  -2.237  -1.249  1.00  0.00           O  
HETATM   15  C10 UNL     1       3.107  -1.357   0.469  1.00  0.00           C  
HETATM   16 CL4  UNL     1       4.014  -2.856   0.424  1.00  0.00          CL  
HETATM   17  C11 UNL     1       3.452  -0.378   1.349  1.00  0.00           C  
HETATM   18  C12 UNL     1       2.723   0.764   1.329  1.00  0.00           C  
HETATM   19 CL5  UNL     1       3.164   2.023   2.476  1.00  0.00          CL  
HETATM   20  C13 UNL     1       1.647   0.940   0.439  1.00  0.00           C  
HETATM   21 CL6  UNL     1       0.859   2.474   0.568  1.00  0.00          CL  
HETATM   22  H1  UNL     1      -0.787   2.589  -1.920  1.00  0.00           H  
HETATM   23  H2  UNL     1      -4.544   0.346   1.369  1.00  0.00           H  
HETATM   24  H3  UNL     1       0.209   0.955  -1.964  1.00  0.00           H  
HETATM   25  H4  UNL     1       0.152  -0.791  -2.071  1.00  0.00           H  
HETATM   26  H5  UNL     1       1.182  -2.431  -1.965  1.00  0.00           H  
HETATM   27  H6  UNL     1       4.283  -0.530   2.030  1.00  0.00           H  
CONECT    1    2   22
CONECT    2    3    3   10
CONECT    3    4    5
CONECT    5    6    6   23
CONECT    6    7    8
CONECT    8    9   10   10
CONECT   10   11
CONECT   11   12   24   25
CONECT   12   13   13   20
CONECT   13   14   15
CONECT   14   26
CONECT   15   16   17   17
CONECT   17   18   27
CONECT   18   19   20   20
CONECT   20   21
END