COMPND    HMDB0000058
HETATM    1  N1  UNL     1      -5.523  -0.632  -0.324  1.00  0.00           N  
HETATM    2  C1  UNL     1      -4.538   0.383  -0.252  1.00  0.00           C  
HETATM    3  N2  UNL     1      -4.795   1.675  -0.052  1.00  0.00           N  
HETATM    4  C2  UNL     1      -3.817   2.583   0.005  1.00  0.00           C  
HETATM    5  N3  UNL     1      -2.520   2.209  -0.141  1.00  0.00           N  
HETATM    6  C3  UNL     1      -2.180   0.928  -0.346  1.00  0.00           C  
HETATM    7  C4  UNL     1      -3.213   0.004  -0.401  1.00  0.00           C  
HETATM    8  N4  UNL     1      -2.604  -1.193  -0.614  1.00  0.00           N  
HETATM    9  C5  UNL     1      -1.280  -1.003  -0.682  1.00  0.00           C  
HETATM   10  N5  UNL     1      -0.997   0.302  -0.519  1.00  0.00           N  
HETATM   11  C6  UNL     1       0.330   0.899  -0.531  1.00  0.00           C  
HETATM   12  O1  UNL     1       1.116   0.205  -1.417  1.00  0.00           O  
HETATM   13  C7  UNL     1       2.117  -0.433  -0.743  1.00  0.00           C  
HETATM   14  C8  UNL     1       2.535  -1.748  -1.334  1.00  0.00           C  
HETATM   15  O2  UNL     1       3.632  -2.223  -0.659  1.00  0.00           O  
HETATM   16  P1  UNL     1       4.135  -1.266   0.611  1.00  0.00           P  
HETATM   17  O3  UNL     1       4.903  -2.163   1.586  1.00  0.00           O  
HETATM   18  O4  UNL     1       5.204  -0.099   0.027  1.00  0.00           O  
HETATM   19  O5  UNL     1       2.851  -0.581   1.470  1.00  0.00           O  
HETATM   20  C9  UNL     1       1.692  -0.544   0.697  1.00  0.00           C  
HETATM   21  C10 UNL     1       0.953   0.773   0.843  1.00  0.00           C  
HETATM   22  O6  UNL     1       1.900   1.750   1.090  1.00  0.00           O  
HETATM   23  H1  UNL     1      -6.041  -0.902  -1.187  1.00  0.00           H  
HETATM   24  H2  UNL     1      -5.753  -1.154   0.549  1.00  0.00           H  
HETATM   25  H3  UNL     1      -4.084   3.624   0.171  1.00  0.00           H  
HETATM   26  H4  UNL     1      -0.572  -1.803  -0.846  1.00  0.00           H  
HETATM   27  H5  UNL     1       0.278   1.989  -0.768  1.00  0.00           H  
HETATM   28  H6  UNL     1       3.025   0.227  -0.758  1.00  0.00           H  
HETATM   29  H7  UNL     1       1.747  -2.517  -1.302  1.00  0.00           H  
HETATM   30  H8  UNL     1       2.820  -1.565  -2.386  1.00  0.00           H  
HETATM   31  H9  UNL     1       5.440   0.576   0.728  1.00  0.00           H  
HETATM   32  H10 UNL     1       1.039  -1.420   0.891  1.00  0.00           H  
HETATM   33  H11 UNL     1       0.186   0.729   1.644  1.00  0.00           H  
HETATM   34  H12 UNL     1       2.015   2.391   0.371  1.00  0.00           H  
CONECT    1    2   23   24
CONECT    2    3    3    7
CONECT    3    4
CONECT    4    5    5   25
CONECT    5    6
CONECT    6    7    7   10
CONECT    7    8
CONECT    8    9    9
CONECT    9   10   26
CONECT   10   11
CONECT   11   12   21   27
CONECT   12   13
CONECT   13   14   20   28
CONECT   14   15   29   30
CONECT   15   16
CONECT   16   17   17   18   19
CONECT   18   31
CONECT   19   20
CONECT   20   21   32
CONECT   21   22   33
CONECT   22   34
END