REMARK  Name = BDB056273
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.212   0.690   2.038  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        0.319  -0.697   2.187  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1        1.562  -1.317   2.040  0.00  0.00    +0.014 A 
ATOM      4  C   LIG    1        2.701  -0.552   1.751  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1        2.598   0.842   1.652  0.00  0.00    +0.014 A 
ATOM      6  C   LIG    1        1.354   1.462   1.796  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        4.008  -1.248   1.618  0.00  0.00    +0.247 C 
ATOM      8  N   LIG    1        4.914  -0.737   0.709  0.00  0.00    -0.296 N 
ATOM      9  C   LIG    1        6.107  -1.466   0.264  0.00  0.00    +0.117 C 
ATOM     10  C   LIG    1        6.111  -0.534  -0.966  0.00  0.00    +0.016 C 
ATOM     11  C   LIG    1        7.032   0.687  -0.897  0.00  0.00    +0.091 C 
ATOM     12  N   LIG    1        7.763   0.701  -2.171  0.00  0.00    -0.315 NA
ATOM     13  H   LIG    1        7.953   1.655  -2.475  0.00  0.00    +0.122 HD
ATOM     14  C   LIG    1        6.916  -0.004  -3.131  0.00  0.00    +0.081 C 
ATOM     15  C   LIG    1        6.391  -1.176  -2.318  0.00  0.00    +0.026 C 
ATOM     16  C   LIG    1        4.624  -0.248  -0.641  0.00  0.00    +0.117 C 
ATOM     17  O   LIG    1        4.233  -2.241   2.304  0.00  0.00    -0.270 OA
ENDBRANCH   4   7
BRANCH   1  19
ATOM     18  O   LIG    1       -1.121   2.342   2.984  0.00  0.00    -0.270 OA
ATOM     19  C   LIG    1       -1.087   1.380   2.219  0.00  0.00    +0.247 C 
ATOM     20  N   LIG    1       -2.205   0.919   1.528  0.00  0.00    -0.297 N 
ATOM     21  C   LIG    1       -3.496   1.517   1.850  0.00  0.00    +0.109 C 
ATOM     22  C   LIG    1       -4.647   0.643   1.369  0.00  0.00    +0.038 C 
ATOM     23  C   LIG    1       -4.636   0.479  -0.169  0.00  0.00    +0.060 C 
ATOM     24  C   LIG    1       -3.177   0.465  -0.696  0.00  0.00    +0.038 C 
ATOM     25  C   LIG    1       -2.164   0.035   0.360  0.00  0.00    +0.109 C 
BRANCH  23  26
ATOM     26  N   LIG    1       -5.371  -0.731  -0.626  0.00  0.00    -0.299 NA
ATOM     27  C   LIG    1       -6.704  -0.911  -0.022  0.00  0.00    +0.085 C 
ATOM     28  C   LIG    1       -7.636  -0.005  -0.807  0.00  0.00    +0.017 C 
ATOM     29  C   LIG    1       -7.019   0.056  -2.196  0.00  0.00    +0.017 C 
ATOM     30  C   LIG    1       -5.684  -0.670  -2.071  0.00  0.00    +0.085 C 
ENDBRANCH  23  26
ENDBRANCH   1  19
TORSDOF 3