REMARK  Name = BDB013064
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.998   0.021  -0.016  0.00  0.00    +0.046 A 
ATOM      2  C   LIG    1        2.340   0.751   1.011  0.00  0.00    +0.173 A 
ATOM      3  N   LIG    1        0.985   0.939   0.885  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1        0.618   1.679   1.972  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1        1.668   1.912   2.727  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1        0.233   0.440  -0.186  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1        0.845  -0.222  -1.132  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1        2.756   1.325   2.121  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1        2.209  -0.404  -1.029  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        7.187  -0.645  -0.070  0.00  0.00    +0.140 A 
ATOM     11  N   LIG    1        6.723   0.577   0.279  0.00  0.00    -0.244 NA
ATOM     12  C   LIG    1        5.375   0.742   0.292  0.00  0.00    +0.121 A 
ATOM     13  C   LIG    1        4.453  -0.247  -0.053  0.00  0.00    +0.005 A 
ATOM     14  C   LIG    1        4.976  -1.499  -0.400  0.00  0.00    +0.013 A 
ATOM     15  C   LIG    1        6.357  -1.705  -0.412  0.00  0.00    +0.039 A 
BRANCH  10  17
ATOM     16  N   LIG    1        9.764  -0.982  -0.094  0.00  0.00    -0.189 NA
ATOM     17  C   LIG    1        8.616  -0.804  -0.073  0.00  0.00    +0.119 C 
ENDBRANCH  10  17
ENDBRANCH   1  13
BRANCH   6  18
ATOM     18  N   LIG    1       -1.125   0.660  -0.214  0.00  0.00    -0.310 N 
ATOM     19  H   LIG    1       -1.609   0.932   0.634  0.00  0.00    +0.149 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -1.977   0.050  -1.216  0.00  0.00    +0.140 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -3.405   0.448  -0.954  0.00  0.00    -0.024 A 
ATOM     22  C   LIG    1       -4.247  -0.303  -0.140  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -3.988  -1.552   0.617  0.00  0.00    +0.080 C 
ATOM     24  C   LIG    1       -5.424  -1.912   1.002  0.00  0.00    +0.234 C 
ATOM     25  O   LIG    1       -6.232  -0.715   0.973  0.00  0.00    -0.491 OA
ATOM     26  C   LIG    1       -5.539   0.123   0.138  0.00  0.00    +0.124 A 
ATOM     27  C   LIG    1       -6.051   1.299  -0.368  0.00  0.00    +0.046 A 
ATOM     28  C   LIG    1       -5.228   2.067  -1.190  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -3.918   1.649  -1.478  0.00  0.00    +0.005 A 
ENDBRANCH  20  21
ENDBRANCH  18  20
ENDBRANCH   6  18
TORSDOF 5