REMARK  Name = BDB014715
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.056   1.572  -0.016  0.00  0.00    +0.121 C 
ATOM      2  N   LIG    1        1.063   2.869  -0.019  0.00  0.00    -0.285 NA
ATOM      3  H   LIG    1        1.998   3.255   0.121  0.00  0.00    +0.188 HD
ENDROOT
BRANCH   1  12
ATOM      4  C   LIG    1        2.430  -0.243   0.975  0.00  0.00    +0.013 C 
ATOM      5  C   LIG    1        3.727  -1.032   1.034  0.00  0.00    +0.070 C 
ATOM      6  C   LIG    1        4.928  -0.283   0.461  0.00  0.00    +0.114 C 
ATOM      7  N   LIG    1        4.598   0.372  -0.798  0.00  0.00    -0.297 N 
ATOM      8  C   LIG    1        5.507   0.546  -1.836  0.00  0.00    +0.213 C 
ATOM      9  O   LIG    1        5.336   1.371  -2.733  0.00  0.00    -0.276 OA
ATOM     10  C   LIG    1        6.731  -0.334  -1.839  0.00  0.00    +0.109 C 
ATOM     11  C   LIG    1        3.471   1.300  -0.757  0.00  0.00    +0.147 C 
ATOM     12  C   LIG    1        2.363   0.826   0.146  0.00  0.00    +0.026 C 
BRANCH   4  14
ATOM     13  C   LIG    1        1.452  -1.673   2.831  0.00  0.00    +0.125 C 
ATOM     14  N   LIG    1        1.372  -0.679   1.776  0.00  0.00    -0.350 N 
ATOM     15  H   LIG    1        0.704   0.067   1.990  0.00  0.00    +0.145 HD
ENDBRANCH   4  14
ENDBRANCH   1  12
BRANCH   1  16
ATOM     16  N   LIG    1       -0.097   0.828  -0.144  0.00  0.00    -0.298 N 
ATOM     17  H   LIG    1        0.038  -0.176  -0.065  0.00  0.00    +0.154 HD
BRANCH  16  18
ATOM     18  C   LIG    1       -1.433   1.236  -0.279  0.00  0.00    +0.051 A 
ATOM     19  C   LIG    1       -2.436   0.253  -0.314  0.00  0.00    +0.035 A 
ATOM     20  C   LIG    1       -3.789   0.593  -0.443  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1       -4.090   1.945  -0.542  0.00  0.00    +0.119 A 
ATOM     22  N   LIG    1       -3.168   2.933  -0.516  0.00  0.00    -0.261 NA
ATOM     23  C   LIG    1       -1.869   2.554  -0.389  0.00  0.00    +0.134 A 
BRANCH  20  24
ATOM     24  C   LIG    1       -4.816  -0.432  -0.477  0.00  0.00    +0.021 A 
ATOM     25  C   LIG    1       -6.131  -0.260  -0.093  0.00  0.00    +0.116 A 
ATOM     26  N   LIG    1       -6.746  -1.467  -0.268  0.00  0.00    -0.274 N 
ATOM     27  C   LIG    1       -8.128  -1.785  -0.004  0.00  0.00    +0.172 C 
ATOM     28  N   LIG    1       -5.924  -2.423  -0.734  0.00  0.00    -0.179 NA
ATOM     29  C   LIG    1       -4.754  -1.792  -0.864  0.00  0.00    +0.143 A 
ENDBRANCH  20  24
ENDBRANCH  16  18
ENDBRANCH   1  16
TORSDOF 5