REMARK  Name = BDB015999
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.803   2.249   0.376  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.017   1.183   0.305  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.330   1.391   0.078  0.00  0.00    +0.131 A 
ATOM      4  C   LIG    1       -1.850   2.680  -0.046  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -0.923   3.704   0.044  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        0.397   3.523   0.243  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.097   0.417   0.986  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.734   0.683   0.772  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.240   1.995   0.605  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        3.174   3.045   0.665  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        4.532   2.800   0.881  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.990   1.493   1.041  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        4.574  -4.517   0.664  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        4.774  -3.127   0.994  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        5.818  -2.774   1.764  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        5.699  -1.447   1.860  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.579  -0.943   1.155  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        4.005  -2.070   0.602  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.259   2.971  -0.234  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -3.764   3.938  -1.080  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -5.123   3.876  -0.961  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -6.095   4.687  -1.653  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -5.542   2.937  -0.095  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -4.408   2.390   0.350  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.181   0.273   0.011  0.00  0.00    -0.326 N 
ATOM     26  H   LIG    1       -2.808   0.360  -0.787  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.566  -1.058   0.081  0.00  0.00    +0.074 C 
ATOM     28  C   LIG    1       -0.878  -1.428  -1.249  0.00  0.00    +0.053 C 
ATOM     29  C   LIG    1       -0.786  -2.938  -1.491  0.00  0.00    +0.116 C 
ATOM     30  C   LIG    1       -0.816  -3.736  -0.191  0.00  0.00    +0.031 C 
ATOM     31  C   LIG    1       -2.093  -3.482   0.615  0.00  0.00    +0.004 C 
ATOM     32  C   LIG    1       -2.659  -2.073   0.433  0.00  0.00    +0.022 C 
BRANCH  29  33
ATOM     33  O   LIG    1       -1.881  -3.337  -2.317  0.00  0.00    -0.392 OA
ATOM     34  H   LIG    1       -1.785  -4.289  -2.495  0.00  0.00    +0.210 HD
ENDBRANCH  29  33
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 6