COMPND    HMDB0248313
HETATM    1  N1  UNL     1       0.066  -2.057  -1.384  1.00  0.00           N  
HETATM    2  C1  UNL     1       0.029  -0.626  -1.172  1.00  0.00           C  
HETATM    3  C2  UNL     1       1.198  -0.145  -0.400  1.00  0.00           C  
HETATM    4  C3  UNL     1       1.024   0.749   0.631  1.00  0.00           C  
HETATM    5  C4  UNL     1       2.093   1.223   1.377  1.00  0.00           C  
HETATM    6  C5  UNL     1       3.390   0.799   1.097  1.00  0.00           C  
HETATM    7  C6  UNL     1       3.571  -0.096   0.067  1.00  0.00           C  
HETATM    8  C7  UNL     1       2.496  -0.550  -0.657  1.00  0.00           C  
HETATM    9  C8  UNL     1      -1.214  -0.200  -0.496  1.00  0.00           C  
HETATM   10  C9  UNL     1      -1.899   0.911  -0.967  1.00  0.00           C  
HETATM   11  C10 UNL     1      -3.054   1.320  -0.351  1.00  0.00           C  
HETATM   12  C11 UNL     1      -3.554   0.646   0.733  1.00  0.00           C  
HETATM   13  C12 UNL     1      -2.876  -0.458   1.204  1.00  0.00           C  
HETATM   14  C13 UNL     1      -1.717  -0.879   0.596  1.00  0.00           C  
HETATM   15  H1  UNL     1       0.374  -2.330  -2.331  1.00  0.00           H  
HETATM   16  H2  UNL     1       0.580  -2.559  -0.632  1.00  0.00           H  
HETATM   17  H3  UNL     1       0.083  -0.150  -2.169  1.00  0.00           H  
HETATM   18  H4  UNL     1       0.044   1.113   0.895  1.00  0.00           H  
HETATM   19  H5  UNL     1       1.968   1.925   2.188  1.00  0.00           H  
HETATM   20  H6  UNL     1       4.217   1.171   1.681  1.00  0.00           H  
HETATM   21  H7  UNL     1       4.581  -0.417  -0.141  1.00  0.00           H  
HETATM   22  H8  UNL     1       2.620  -1.256  -1.473  1.00  0.00           H  
HETATM   23  H9  UNL     1      -1.508   1.448  -1.824  1.00  0.00           H  
HETATM   24  H10 UNL     1      -3.587   2.203  -0.734  1.00  0.00           H  
HETATM   25  H11 UNL     1      -4.472   0.960   1.234  1.00  0.00           H  
HETATM   26  H12 UNL     1      -3.268  -0.997   2.064  1.00  0.00           H  
HETATM   27  H13 UNL     1      -1.185  -1.748   0.966  1.00  0.00           H  
CONECT    1    2   15   16
CONECT    2    3    9   17
CONECT    3    4    4    8
CONECT    4    5   18
CONECT    5    6    6   19
CONECT    6    7   20
CONECT    7    8    8   21
CONECT    8   22
CONECT    9   10   10   14
CONECT   10   11   23
CONECT   11   12   12   24
CONECT   12   13   25
CONECT   13   14   14   26
CONECT   14   27
END