REMARK  Name = BDB059088
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.141   0.341   0.111  0.00  0.00    -0.301 N 
ATOM      2  C   LIG    1       -0.511  -0.970  -0.077  0.00  0.00    +0.111 C 
ATOM      3  C   LIG    1       -1.948  -0.780  -0.554  0.00  0.00    +0.059 C 
ATOM      4  C   LIG    1       -2.734   0.122   0.402  0.00  0.00    +0.098 C 
ATOM      5  C   LIG    1       -4.140   0.337  -0.069  0.00  0.00    -0.010 A 
ATOM      6  C   LIG    1       -5.012  -0.370   0.748  0.00  0.00    -0.016 A 
ATOM      7  C   LIG    1       -6.379  -0.362   0.524  0.00  0.00    +0.006 A 
ATOM      8  C   LIG    1       -6.870   0.387  -0.546  0.00  0.00    +0.000 A 
ATOM      9  C   LIG    1       -5.993   1.104  -1.374  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1       -4.242  -1.093   1.787  0.00  0.00    +0.196 C 
ATOM     11  C   LIG    1       -4.617   1.080  -1.140  0.00  0.00    +0.007 A 
ATOM     12  O   LIG    1       -2.900  -0.564   1.677  0.00  0.00    -0.364 OA
ATOM     13  C   LIG    1       -1.989   1.433   0.661  0.00  0.00    +0.059 C 
ATOM     14  C   LIG    1       -0.557   1.165   1.112  0.00  0.00    +0.111 C 
ENDROOT
BRANCH   1  24
ATOM     15  O   LIG    1        3.943   2.908  -0.310  0.00  0.00    -0.267 OA
ATOM     16  C   LIG    1        3.453   1.796  -0.146  0.00  0.00    +0.256 A 
ATOM     17  C   LIG    1        4.273   0.573  -0.068  0.00  0.00    +0.038 A 
ATOM     18  C   LIG    1        5.764   0.714  -0.107  0.00  0.00    +0.042 C 
ATOM     19  C   LIG    1        6.491  -0.570   0.297  0.00  0.00    +0.005 C 
ATOM     20  C   LIG    1        5.833  -1.793  -0.331  0.00  0.00    +0.006 C 
ATOM     21  C   LIG    1        4.365  -1.905   0.090  0.00  0.00    +0.056 C 
ATOM     22  C   LIG    1        3.615  -0.594   0.035  0.00  0.00    +0.053 A 
ATOM     23  N   LIG    1        2.248  -0.710   0.083  0.00  0.00    -0.220 NA
ATOM     24  C   LIG    1        1.526   0.370   0.065  0.00  0.00    +0.198 A 
ATOM     25  N   LIG    1        2.110   1.603  -0.030  0.00  0.00    -0.295 N 
ATOM     26  H   LIG    1        1.533   2.417  -0.143  0.00  0.00    +0.172 HD
ENDBRANCH   1  24
TORSDOF 1